A0A093HQR6_STRCA Loading...

F-box/LRR-repeat protein 3

AlphaFold DB , UniProt , Accession A0A093HQR6, Species STRCA (Struthio camelus australis), Gene n/a, Length 433 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	33.5	Very low	28.5	Very low	243 Å²	243	169.6 Å²	169.6	100%	1.197	83%	0.828	S	S	*	*				0	125.2	0	-98.5	174.6	164.3	0	0	109
2	K	30.4	Very low	28.2	Very low	192 Å²	192	167.2 Å²	167.2	84%	0.835	82%	0.821	S	S	*	*			trans	49.7	104.6	160.8	-67.5	-178.4	177.5	177.7	0	118.7
3	R	27.9	Very low	28	Very low	250 Å²	250	162.8 Å²	162.8	94%	0.943	82%	0.818	S	S	*	*				78.5	131.6	84.3	-79.8	-177	178.3	-177.4	0.2	112.4
4	G	28	Very low	28	Very low	81 Å²	81	158.8 Å²	158.8	84%	0.835	81%	0.812	S	S	*	*			cis	-177.5	-175	12.9	0	0	0	0	0	118.6
5	R	28.8	Very low	27.8	Very low	218 Å²	218	154.7 Å²	154.7	82%	0.823	80%	0.803	S	S	*	*			trans	-36.1	149.1	175.1	-102.3	168.8	168.4	168.1	-3.8	121.2	I7	R5-I7 HydrophobicContact CG-CD1 4.24Å
6	K	29.5	Very low	27.7	Very low	204 Å²	204	155.8 Å²	155.8	89%	0.887	80%	0.803	S	S	*	*				-178.5	119.6	116.4	-95.4	176.9	178.5	-176	0	106.6
7	I	29.3	Very low	27.6	Very low	117 Å²	117	156.9 Å²	156.9	60%	0.6	81%	0.805	S	S	*	*				76.5	126.5	52.2	-64.7	-177	0	0	0	115.2	R5	R5-I7 HydrophobicContact CG-CD1 4.24Å
8	N	27.3	Very low	27.5	Very low	133 Å²	133	153.6 Å²	153.6	71%	0.711	80%	0.804	S	S	*	*			trans	92.2	112.2	164.2	-70.7	-3.5	0	0	0	117.6
9	E	26.4	Very low	27.5	Very low	166 Å²	166	150.8 Å²	150.8	78%	0.776	81%	0.806	S	S	*	*				84.8	142.6	54.5	-82.4	-162.1	171.2	0	0	114.4
10	T	26.4	Very low	27.5	Very low	126 Å²	126	152.8 Å²	152.8	77%	0.773	81%	0.81	S	S	*	*			trans	83	146.2	168.4	66.7	0	0	0	0	118
11	N	26	Very low	27.6	Very low	136 Å²	136	155.2 Å²	155.2	73%	0.727	81%	0.814	S	S	*	*			cis	-167.7	145	-35.9	-126.7	-12.7	0	0	0	105
12	N	25.4	Very low	27.3	Very low	140 Å²	140	152 Å²	152	75%	0.749	80%	0.796	S	S	*	*			trans	48.1	133.3	141.9	-88.4	-4.1	0	0	0	123.3
13	S	25.4	Very low	27.3	Very low	111 Å²	111	148.4 Å²	148.4	78%	0.776	80%	0.795	S	S	*	*				111.5	152.7	121.4	72.6	0	0	0	0	119.3
14	S	27	Very low	27.5	Very low	106 Å²	106	145.1 Å²	145.1	74%	0.741	79%	0.787	S	S	*	*			trans	84.1	105.2	178.5	69.9	0	0	0	0	115.2
15	S	25.8	Very low	27.7	Very low	97 Å²	97	152.7 Å²	152.7	68%	0.678	79%	0.79	S	S	*	*			cis	69.1	119.9	48.9	79.6	0	0	0	0	114.3
16	E	26.1	Very low	27.9	Very low	172 Å²	172	151.3 Å²	151.3	80%	0.804	79%	0.793	S	S	*	*			trans	72.7	137.6	158.1	-66.1	160.1	-177.8	0	0	114.6
17	E	25.4	Very low	27.8	Very low	176 Å²	176	151.6 Å²	151.6	82%	0.822	79%	0.794	S	S	*	*			cis	-171.4	151.6	35.6	-138.1	167.1	-168.6	0	0	111
18	A	26.2	Very low	28	Very low	96 Å²	96	153.4 Å²	153.4	79%	0.793	80%	0.804	S	S	*	*			trans	37.9	123.6	146.7	0	0	0	0	0	122.4
19	A	27.4	Very low	28.3	Very low	102 Å²	102	152.8 Å²	152.8	84%	0.843	81%	0.805	S	S	*	*				-160.5	121	127.9	0	0	0	0	0	111.5
20	E	28.2	Very low	28.7	Very low	189 Å²	189	152.8 Å²	152.8	88%	0.883	81%	0.81	S	S	*	*			trans	-53.4	144.1	171.4	-65.4	166.7	128.8	0	0	113.2
21	K	30	Very low	29.3	Very low	205 Å²	205	155.2 Å²	155.2	89%	0.891	81%	0.813	S	S	*	*				-169.9	109.9	127.4	-104.5	163.9	-174.4	178.6	0	110.6	S23	K21-S23 PolarHBondContact O-N 2.87Å
22	E	26.9	Very low	30	Very low	176 Å²	176	157.9 Å²	157.9	82%	0.822	82%	0.818	S	S	*	*			trans	-56.8	127.1	162.8	-76.5	-175.3	123.4	0	0	110.4
23	S	29.8	Very low	30.8	Very low	116 Å²	116	158.6 Å²	158.6	81%	0.811	82%	0.822	S	S	*	*			trans	-137	106.4	153	-173.1	0	0	0	0	108.2	K21 R25	K21-S23 PolarHBondContact O-N 2.87Å; S23-R25 PolarHBondContact O-N 3.24Å
24	K	32.8	Very low	31.8	Very low	180 Å²	180	158.9 Å²	158.9	78%	0.783	82%	0.819	S	S	*	*			trans	-63	110.9	-179.2	-70.4	174.9	177.6	173.8	0	109.9
25	R	31.4	Very low	33.1	Very low	240 Å²	240	160.6 Å²	160.6	91%	0.906	82%	0.818	S	S	*	*			trans	-119.9	123.5	156.7	-105.2	-178.7	172.7	-178.5	-2.1	108.6	S23 K27	S23-R25 PolarHBondContact O-N 3.24Å; R25-K27 PolarHBondContact O-N 3.26Å
26	H	32	Very low	34.5	Very low	189 Å²	189	161.8 Å²	161.8	88%	0.875	82%	0.821	S	S	*	*			trans	-49.7	119.3	-178.1	-74.1	23.9	0	0	0	111.5
27	K	28.6	Very low	36.1	Very low	210 Å²	210	164.5 Å²	164.5	91%	0.913	82%	0.824	S	S	*	*			trans	-96.3	108.4	165.5	-111.9	-177.6	178.1	-175.8	0	108.2	R25	R25-K27 PolarHBondContact O-N 3.26Å
28	I	34.3	Very low	37.9	Very low	155 Å²	155	160.8 Å²	160.8	80%	0.795	82%	0.817	S	S	*	*			trans	-52.3	133.4	163.8	-67	162.8	0	0	0	107.7
29	T	32.6	Very low	40	Very low	121 Å²	121	160.4 Å²	160.4	74%	0.742	81%	0.807	S	S	*	*			trans	-40.4	130.8	174.1	34.3	0	0	0	0	113	E31	T29-E31 PolarHBondContact O-N 2.88Å
30	D	35.3	Very low	42.6	Very low	166 Å²	166	160.3 Å²	160.3	89%	0.888	79%	0.792	S	S	*	*			trans	-50	104.9	167.3	-91.2	-39.8	0	0	0	110.2	K32	D30-K32 PolarHBondContact O-N 2.67Å
31	E	38.5	Very low	45.3	Very low	177 Å²	177	159.3 Å²	159.3	83%	0.827	78%	0.78	S	S	*	*			trans	-64	114.3	158.6	-79.2	-175	156.5	0	0	107.5	T29 N33	T29-E31 PolarHBondContact O-N 2.88Å; E31-N33 PolarHBondContact O-N 3.28Å
32	K	41.2	Very low	47.9	Very low	192 Å²	192	151 Å²	151	84%	0.835	75%	0.75	S	S	*	*			trans	-51	106.2	164.7	-71.5	174.7	176.7	175.3	0	107.8	D30 V34	D30-K32 PolarHBondContact O-N 2.67Å; K32-V34 PolarHBondContact O-N 2.86Å
33	N	40.9	Very low	50.6	Low	154 Å²	154	148.5 Å²	148.5	82%	0.824	74%	0.742	S	S	*	*			trans	-58.6	89.1	160.1	-90.5	-29.5	0	0	0	107.9	E31 I35	E31-N33 PolarHBondContact O-N 3.28Å; N33-I35 PolarHBondContact O-N 3.17Å
34	V	47.8	Very low	53.5	Low	118 Å²	118	145.3 Å²	145.3	72%	0.715	72%	0.716	S	S	*	*			trans	-67.6	92.5	160.9	179.3	0	0	0	0	104.8	K32 V36	K32-V34 PolarHBondContact O-N 2.86Å; V34-V36 HydrophobicContact CG1-CG2 4.3Å; V34-V36 PolarHBondContact O-N 3.11Å
35	I	54.6	Low	56.3	Low	142 Å²	142	142.9 Å²	142.9	73%	0.728	71%	0.711	S	S	*	*			trans	-61.3	95.2	162.8	-58.5	171.8	0	0	0	104.6	N33 R37	N33-I35 PolarHBondContact O-N 3.17Å; I35-R37 VanDerWaalsContact C-N 3.26Å; I35-R37 PolarHBondContact O-N 3.31Å
36	V	54.4	Low	59.2	Low	122 Å²	122	135.2 Å²	135.2	74%	0.739	69%	0.685	S	S	*	*			trans	-59.9	100.1	164.4	178.1	0	0	0	0	104.4	V34 S38	V34-V36 HydrophobicContact CG1-CG2 4.3Å; V34-V36 PolarHBondContact O-N 3.11Å; V36-S38 PolarHBondContact O-N 3.39Å
37	R	60	Low	62.1	Low	228 Å²	228	131.5 Å²	131.5	86%	0.86	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-54.2	116.9	172.3	-81.6	-177.3	172.7	176.7	-2.3	106	I35	I35-R37 VanDerWaalsContact C-N 3.26Å; I35-R37 PolarHBondContact O-N 3.31Å
38	S	62.2	Low	65.2	Low	98 Å²	98	124.6 Å²	124.6	69%	0.685	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-49	135.9	169.5	52	0	0	0	0	108.1	V36 D40	V36-S38 PolarHBondContact O-N 3.39Å; S38-D40 PolarHBondContact O-N 3.04Å
39	P	70.4	Confident	68.1	Low	89 Å²	89	117.2 Å²	117.2	58%	0.578	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-50.9	127.9	177.7	-22.4	30.5	0	0	0	109.6	W41	P39-W41 PolarHBondContact O-N 3.4Å
40	D	82.5	Confident	71	Confident	100 Å²	100	112 Å²	112	54%	0.535	58%	0.577	S	S	.	*			trans	-78.1	92.2	177.6	-175.4	2.1	0	0	0	109.3	S38 A42 N43	S38-D40 PolarHBondContact O-N 3.04Å; D40-A42 PolarHBondContact O-N 3.2Å; D40-A42 VanDerWaalsContact O-N 3.15Å; D40-A42 WeakPolarHBondContact OD1-CB 3.44Å; D40-A42 PolarHBondContact OD1-N 3.29Å; D40-N43 PolarHBondContact O-N 2.93Å; D40-N43 PolarHBondContact OD2-ND2 3.2Å
41	W	85.6	Confident	73.9	Confident	167 Å²	167	108.7 Å²	108.7	63%	0.633	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-62.4	-14.8	177.8	-60.9	97.7	0	0	0	113.3	P39 N43 L44 W71	P39-W41 PolarHBondContact O-N 3.4Å; W41-N43 VanDerWaalsContact C-N 3.28Å; W41-N43 PolarHBondContact O-N 2.93Å; W41-L44 HydrophobicContact CE3-CD1 4.37Å; W41-W71 PolarHBondContact O-NE1 2.92Å; W41-W71 VanDerWaalsContact O-NE1 3.08Å
42	A	84.4	Confident	76.5	Confident	31 Å²	31	103.3 Å²	103.3	26%	0.256	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-70.6	-26	176.2	0	0	0	0	0	112.4	D40 C68 N70	D40-A42 PolarHBondContact O-N 3.2Å; D40-A42 VanDerWaalsContact O-N 3.15Å; D40-A42 WeakPolarHBondContact OD1-CB 3.44Å; D40-A42 PolarHBondContact OD1-N 3.29Å; A42-C68 HydrophobicContact CB-CB 4.29Å; A42-N70 WeakPolarHBondContact O-CB 3.24Å; A42-N70 PolarHBondContact O-ND2 3.47Å
43	N	84.1	Confident	79.1	Confident	123 Å²	123	94.1 Å²	94.1	66%	0.658	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-97.8	13.7	-179.4	-61.3	-36.6	0	0	0	113.5	D40 W41	D40-N43 PolarHBondContact O-N 2.93Å; D40-N43 PolarHBondContact OD2-ND2 3.2Å; W41-N43 VanDerWaalsContact C-N 3.28Å; W41-N43 PolarHBondContact O-N 2.93Å
44	L	88.9	Confident	81.6	Confident	49 Å²	49	90.6 Å²	90.6	26%	0.257	47%	0.474	S	S	.	.			trans	-58.2	144	174.6	-157	75.6	0	0	0	110.1	W41 Q46 V48 I49 N70	W41-L44 HydrophobicContact CE3-CD1 4.37Å; L44-Q46 PolarHBondContact O-N 2.86Å; L44-V48 HydrophobicContact CD1-CG1 4.42Å; L44-V48 HydrophobicContact CD2-CB 3.88Å; L44-V48 HydrophobicContact CD2-CG1 3.51Å; L44-V48 HydrophobicContact CG-CB 4.01Å; L44-V48 HydrophobicContact CG-CG1 3.99Å; L44-I49 HydrophobicContact CB-CD1 4.14Å; L44-I49 HydrophobicContact CB-CG1 3.95Å; L44-I49 HydrophobicContact CD2-CG1 3.87Å; L44-I49 HydrophobicContact CG-CG1 4.32Å; L44-I49 WeakPolarHBondContact O-CD1 2.94Å; L44-N70 PolarHBondContact O-ND2 2.96Å
45	L	92.5	Very high	83.7	Confident	129 Å²	129	94.2 Å²	94.2	68%	0.675	48%	0.476	S	S	*	.			trans	-58.2	139.1	177.1	-69.7	171.3	0	0	0	110.4	D47 V48 I49	L45-D47 PolarHBondContact O-N 2.99Å; L45-V48 HydrophobicContact CB-CG2 4.07Å; L45-V48 WeakPolarHBondContact O-CB 3.42Å; L45-V48 PolarHBondContact O-N 3.02Å; L45-I49 PolarHBondContact O-N 3.09Å; L45-I49 VanDerWaalsContact O-N 3.12Å
46	Q	91.7	Very high	85.5	Confident	79 Å²	79	89.8 Å²	89.8	37%	0.369	45%	0.454	S	S	.	.	H	α-helix	trans	-56.5	-38.5	-177.5	-70.3	-176	-8.3	0	0	112.2	L44 V48 I49 L50 N70 Q73 V74	L44-Q46 PolarHBondContact O-N 2.86Å; Q46-V48 VanDerWaalsContact C-N 3.3Å; Q46-V48 PolarHBondContact O-N 3.45Å; Q46-I49 PolarHBondContact O-N 2.91Å; Q46-L50 WeakPolarHBondContact O-CB 3.48Å; Q46-L50 PolarHBondContact O-N 3.47Å; Q46-N70 WeakPolarHBondContact CG-OD1 3Å; Q46-N70 PolarHBondContact NE2-OD1 2.69Å; Q46-Q73 VanDerWaalsContact NE2-OE1 3.17Å; Q46-V74 HydrophobicContact CB-CG2 3.75Å; Q46-V74 HydrophobicContact CG-CG2 3.74Å
47	D	93.3	Very high	87	Confident	111 Å²	111	87.5 Å²	87.5	59%	0.594	44%	0.441	S	S	*	.	H	α-helix	trans	-62.4	-35.8	176.9	-63.7	-39.5	0	0	0	112.6	L45 L50 Q51	L45-D47 PolarHBondContact O-N 2.99Å; D47-L50 WeakPolarHBondContact O-CB 3.46Å; D47-L50 PolarHBondContact O-N 2.69Å; D47-Q51 WeakPolarHBondContact O-CG 3.4Å; D47-Q51 PolarHBondContact O-N 3.4Å
48	V	94	Very high	88.3	Confident	65 Å²	65	79.4 Å²	79.4	39%	0.394	41%	0.414	S	S	.	.	H	α-helix	trans	-71.9	-42.3	177.7	-176.1	0	0	0	0	110.2	L44 L45 Q46 L50 Q51 V52	L44-V48 HydrophobicContact CD1-CG1 4.42Å; L44-V48 HydrophobicContact CD2-CB 3.88Å; L44-V48 HydrophobicContact CD2-CG1 3.51Å; L44-V48 HydrophobicContact CG-CB 4.01Å; L44-V48 HydrophobicContact CG-CG1 3.99Å; L45-V48 HydrophobicContact CB-CG2 4.07Å; L45-V48 WeakPolarHBondContact O-CB 3.42Å; L45-V48 PolarHBondContact O-N 3.02Å; Q46-V48 VanDerWaalsContact C-N 3.3Å; Q46-V48 PolarHBondContact O-N 3.45Å; V48-L50 VanDerWaalsContact C-N 3.28Å; V48-L50 PolarHBondContact O-N 3.16Å; V48-Q51 PolarHBondContact O-N 2.85Å; V48-V52 WeakPolarHBondContact O-CG2 3.37Å; V48-V52 PolarHBondContact O-N 3.45Å
49	I	94.2	Very high	89.3	Confident	1 Å²	1	80 Å²	80	1%	0.005	41%	0.41	C	S	.	.	H	α-helix	trans	-63.4	-38.5	174.8	-57	165.4	0	0	0	110	L44 L45 Q46 V52 F53 N70 W71 V74	L44-I49 HydrophobicContact CB-CD1 4.14Å; L44-I49 HydrophobicContact CB-CG1 3.95Å; L44-I49 HydrophobicContact CD2-CG1 3.87Å; L44-I49 HydrophobicContact CG-CG1 4.32Å; L44-I49 WeakPolarHBondContact O-CD1 2.94Å; L45-I49 PolarHBondContact O-N 3.09Å; L45-I49 VanDerWaalsContact O-N 3.12Å; Q46-I49 PolarHBondContact O-N 2.91Å; I49-V52 WeakPolarHBondContact O-CB 3.45Å; I49-V52 PolarHBondContact O-N 2.82Å; I49-F53 HydrophobicContact CG2-CD1 3.65Å; I49-F53 HydrophobicContact CG2-CE1 3.42Å; I49-F53 VanDerWaalsContact CG2-CE1 3.42Å; I49-F53 HydrophobicContact CG2-CG 4.47Å; I49-F53 HydrophobicContact CG2-CZ 4.08Å; I49-F53 WeakPolarHBondContact O-CB 3.17Å; I49-F53 WeakPolarHBondContact O-CD1 3.49Å; I49-F53 PolarHBondContact O-N 3.29Å; I49-N70 WeakPolarHBondContact CD1-ND2 3.17Å; I49-W71 VanDerWaalsContact CD1-CD1 3.42Å; I49-W71 HydrophobicContact CD1-CG 4.15Å; I49-W71 HydrophobicContact CG2-CD2 4.18Å; I49-W71 HydrophobicContact CG2-CG 4.17Å; I49-V74 HydrophobicContact CB-CB 4.32Å; I49-V74 HydrophobicContact CB-CG1 4.02Å; I49-V74 HydrophobicContact CB-CG2 3.99Å; I49-V74 HydrophobicContact CD1-CG2 4.17Å; I49-V74 HydrophobicContact CG2-CB 3.91Å; I49-V74 HydrophobicContact CG2-CG1 3.72Å; I49-V74 HydrophobicContact CG2-CG2 4.05Å
50	L	95	Very high	90.2	Very high	12 Å²	12	79.4 Å²	79.4	6%	0.063	40%	0.401	C	S	.	.	H	α-helix	trans	-60.3	-47	176.5	176.4	66.9	0	0	0	110.7	Q46 D47 V48 V52 F53 Q54 V74 M77 D79 L80	Q46-L50 WeakPolarHBondContact O-CB 3.48Å; Q46-L50 PolarHBondContact O-N 3.47Å; D47-L50 WeakPolarHBondContact O-CB 3.46Å; D47-L50 PolarHBondContact O-N 2.69Å; V48-L50 VanDerWaalsContact C-N 3.28Å; V48-L50 PolarHBondContact O-N 3.16Å; L50-V52 VanDerWaalsContact C-N 3.31Å; L50-V52 PolarHBondContact O-N 3.28Å; L50-F53 PolarHBondContact O-N 3.43Å; L50-F53 VanDerWaalsContact O-N 3.17Å; L50-Q54 WeakPolarHBondContact O-CG 3.34Å; L50-Q54 PolarHBondContact O-N 3.43Å; L50-V74 HydrophobicContact CB-CG1 4.04Å; L50-M77 HydrophobicContact CB-SD 4.28Å; L50-M77 HydrophobicContact CD1-CB 4.32Å; L50-M77 HydrophobicContact CD1-SD 4.28Å; L50-M77 HydrophobicContact CD2-CE 3.8Å; L50-M77 HydrophobicContact CD2-SD 4.33Å; L50-D79 HydrophobicContact CD1-CB 4.1Å; L50-D79 HydrophobicContact CD2-CB 4.2Å; L50-L80 HydrophobicContact CD1-CD1 4.07Å; L50-L80 HydrophobicContact CD1-CD2 3.66Å; L50-L80 HydrophobicContact CD1-CG 3.54Å
51	Q	94.9	Very high	90.7	Very high	95 Å²	95	77 Å²	77	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-58.5	-43.1	174.7	-70.4	-60.7	-54	0	0	111.5	D47 V48 Q54 Y55	D47-Q51 WeakPolarHBondContact O-CG 3.4Å; D47-Q51 PolarHBondContact O-N 3.4Å; V48-Q51 PolarHBondContact O-N 2.85Å; Q51-Q54 PolarHBondContact O-N 3.36Å; Q51-Y55 WeakPolarHBondContact O-CD2 3.31Å
52	V	94.6	Very high	90.7	Very high	64 Å²	64	70.3 Å²	70.3	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-60.6	-47.5	174.2	173.8	0	0	0	0	110.9	V48 I49 L50 Q54 Y55 L56	V48-V52 WeakPolarHBondContact O-CG2 3.37Å; V48-V52 PolarHBondContact O-N 3.45Å; I49-V52 WeakPolarHBondContact O-CB 3.45Å; I49-V52 PolarHBondContact O-N 2.82Å; L50-V52 VanDerWaalsContact C-N 3.31Å; L50-V52 PolarHBondContact O-N 3.28Å; V52-Q54 VanDerWaalsContact C-N 3.26Å; V52-Q54 PolarHBondContact O-N 3.14Å; V52-Y55 PolarHBondContact O-N 2.64Å; V52-Y55 VanDerWaalsContact O-N 3.08Å; V52-L56 HydrophobicContact CG1-CD1 4.45Å
53	F	94.9	Very high	91	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-64.3	-31.1	-178	-84.5	41.3	0	0	0	112.1	I49 L50 Y55 L56 R61 A64 W71 F75 L80	I49-F53 HydrophobicContact CG2-CD1 3.65Å; I49-F53 HydrophobicContact CG2-CE1 3.42Å; I49-F53 VanDerWaalsContact CG2-CE1 3.42Å; I49-F53 HydrophobicContact CG2-CG 4.47Å; I49-F53 HydrophobicContact CG2-CZ 4.08Å; I49-F53 WeakPolarHBondContact O-CB 3.17Å; I49-F53 WeakPolarHBondContact O-CD1 3.49Å; I49-F53 PolarHBondContact O-N 3.29Å; L50-F53 PolarHBondContact O-N 3.43Å; L50-F53 VanDerWaalsContact O-N 3.17Å; F53-Y55 PolarHBondContact O-N 3.14Å; F53-L56 HydrophobicContact CD1-CD1 4.31Å; F53-L56 PolarHBondContact O-N 2.88Å; F53-R61 HydrophobicContact CB-CG 4.36Å; F53-R61 HydrophobicContact CD2-CB 4.13Å; F53-R61 HydrophobicContact CD2-CG 4.12Å; F53-R61 HydrophobicContact CE2-CB 4.42Å; F53-R61 HydrophobicContact CG-CG 4.4Å; F53-R61 PolarHBondContact O-NE 3Å; F53-R61 PolarHBondContact O-NH2 2.96Å; F53-A64 HydrophobicContact CE1-CB 3.73Å; F53-A64 HydrophobicContact CE2-CB 4.4Å; F53-A64 HydrophobicContact CZ-CB 3.57Å; F53-W71 HydrophobicContact CE1-CD2 4.41Å; F53-W71 AromaticContact CE1-CE3 3.74Å; F53-W71 HydrophobicContact CE1-CE3 3.74Å; F53-W71 HydrophobicContact CE1-CZ3 4.18Å; F53-W71 HydrophobicContact CZ-CB 4.35Å; F53-W71 HydrophobicContact CZ-CE3 4.08Å; F53-F75 HydrophobicContact CD2-CD2 4.41Å; F53-F75 HydrophobicContact CE2-CB 3.96Å; F53-F75 HydrophobicContact CE2-CD2 4.1Å; F53-L80 HydrophobicContact CB-CD1 3.82Å; F53-L80 HydrophobicContact CB-CD2 3.82Å; F53-L80 HydrophobicContact CB-CG 4.49Å; F53-L80 HydrophobicContact CD2-CD1 3.67Å; F53-L80 HydrophobicContact CG-CD1 4.2Å
54	Q	92.6	Very high	91.4	Very high	80 Å²	80	68.4 Å²	68.4	37%	0.374	35%	0.349	S	S	.	.	H	α-helix	trans	-59.7	-26.5	175.1	-75.5	174.3	-1.9	0	0	112.7	L50 Q51 V52 R61 L80	L50-Q54 WeakPolarHBondContact O-CG 3.34Å; L50-Q54 PolarHBondContact O-N 3.43Å; Q51-Q54 PolarHBondContact O-N 3.36Å; V52-Q54 VanDerWaalsContact C-N 3.26Å; V52-Q54 PolarHBondContact O-N 3.14Å; Q54-R61 PolarHBondContact O-NH2 3.23Å; Q54-L80 HydrophobicContact CG-CD2 4.02Å
55	Y	93.6	Very high	91.6	Very high	194 Å²	194	66.5 Å²	66.5	76%	0.761	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-10.1	175.4	-65.2	-69.5	0	0	0	114.7	Q51 V52 F53	Q51-Y55 WeakPolarHBondContact O-CD2 3.31Å; V52-Y55 PolarHBondContact O-N 2.64Å; V52-Y55 VanDerWaalsContact O-N 3.08Å; F53-Y55 PolarHBondContact O-N 3.14Å
56	L	91.1	Very high	91.6	Very high	49 Å²	49	67.4 Å²	67.4	26%	0.257	34%	0.341	S	S	.	.	S	Bend	trans	-94.1	145.6	-177.6	-62.1	-179.7	0	0	0	111.5	V52 F53 D60 R61 A64	V52-L56 HydrophobicContact CG1-CD1 4.45Å; F53-L56 HydrophobicContact CD1-CD1 4.31Å; F53-L56 PolarHBondContact O-N 2.88Å; L56-D60 HydrophobicContact CB-CB 4.14Å; L56-D60 HydrophobicContact CD2-CB 4.4Å; L56-R61 HydrophobicContact CB-CG 3.72Å; L56-R61 PolarHBondContact O-NE 2.95Å; L56-R61 PolarHBondContact O-NH2 2.85Å; L56-A64 HydrophobicContact CD1-CB 4.24Å
57	P	87.2	Confident	91.7	Very high	74 Å²	74	68.5 Å²	68.5	48%	0.481	35%	0.352	S	S	.	.			trans	-70.3	164.2	166.2	31	-35.5	0	0	0	111.2	L59 D60 R61	P57-L59 VanDerWaalsContact C-N 3.3Å; P57-L59 PolarHBondContact O-N 3.18Å; P57-D60 VanDerWaalsContact CD-OD2 3.29Å; P57-D60 WeakPolarHBondContact CD-OD2 3.08Å; P57-D60 HydrophobicContact CG-CB 3.93Å; P57-D60 WeakPolarHBondContact CG-OD2 3.44Å; P57-D60 PolarHBondContact O-N 2.88Å; P57-D60 VanDerWaalsContact O-N 3.13Å; P57-R61 WeakPolarHBondContact O-CG 3.28Å; P57-R61 PolarHBondContact O-N 3.37Å
58	L	85.9	Confident	91.6	Very high	57 Å²	57	64.8 Å²	64.8	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-55	-41.8	-173.5	179.9	64.5	0	0	0	113.8	R61 A62 F75 W81 F84 L103	L58-R61 WeakPolarHBondContact O-CB 3.32Å; L58-R61 PolarHBondContact O-N 3.13Å; L58-A62 WeakPolarHBondContact O-CB 3.3Å; L58-A62 PolarHBondContact O-N 2.83Å; L58-F75 HydrophobicContact CD1-CE2 4.4Å; L58-F75 HydrophobicContact CD1-CZ 4.4Å; L58-W81 HydrophobicContact CD1-CH2 3.93Å; L58-W81 HydrophobicContact CD1-CZ3 4.23Å; L58-F84 HydrophobicContact CD2-CE2 3.55Å; L58-F84 HydrophobicContact CD2-CZ 3.91Å; L58-L103 HydrophobicContact CD2-CD2 3.89Å
59	L	84.3	Confident	91.6	Very high	112 Å²	112	72.3 Å²	72.3	59%	0.586	36%	0.356	S	S	*	.	H	α-helix	trans	-65.1	-43.8	-179.4	-174.5	61.1	0	0	0	111.2	P57 A62 H63	P57-L59 VanDerWaalsContact C-N 3.3Å; P57-L59 PolarHBondContact O-N 3.18Å; L59-A62 WeakPolarHBondContact O-CB 3.31Å; L59-A62 PolarHBondContact O-N 3.37Å; L59-A62 VanDerWaalsContact O-N 3.15Å; L59-H63 PolarHBondContact O-CD2 3.49Å; L59-H63 PolarHBondContact O-N 2.98Å
60	D	89.5	Confident	91.5	Very high	75 Å²	75	73.8 Å²	73.8	40%	0.401	36%	0.364	S	S	.	.	H	α-helix	trans	-68.1	-37.3	177.3	-66.3	-15.2	0	0	0	111.5	L56 P57 A62 H63 A64	L56-D60 HydrophobicContact CB-CB 4.14Å; L56-D60 HydrophobicContact CD2-CB 4.4Å; P57-D60 VanDerWaalsContact CD-OD2 3.29Å; P57-D60 WeakPolarHBondContact CD-OD2 3.08Å; P57-D60 HydrophobicContact CG-CB 3.93Å; P57-D60 WeakPolarHBondContact CG-OD2 3.44Å; P57-D60 PolarHBondContact O-N 2.88Å; P57-D60 VanDerWaalsContact O-N 3.13Å; D60-A62 VanDerWaalsContact C-N 3.29Å; D60-A62 PolarHBondContact O-N 3.13Å; D60-H63 PolarHBondContact O-N 2.86Å; D60-A64 WeakPolarHBondContact O-CB 3.37Å; D60-A64 PolarHBondContact O-N 3.42Å
61	R	91.9	Very high	91.5	Very high	49 Å²	49	75.4 Å²	75.4	19%	0.185	37%	0.369	C	S	.	.	H	α-helix	trans	-58.7	-42.6	170.1	-67.1	174.6	-170.9	163.4	8.7	111.1	F53 Q54 L56 P57 L58 A64 S65 F75	F53-R61 HydrophobicContact CB-CG 4.36Å; F53-R61 HydrophobicContact CD2-CB 4.13Å; F53-R61 HydrophobicContact CD2-CG 4.12Å; F53-R61 HydrophobicContact CE2-CB 4.42Å; F53-R61 HydrophobicContact CG-CG 4.4Å; F53-R61 PolarHBondContact O-NE 3Å; F53-R61 PolarHBondContact O-NH2 2.96Å; Q54-R61 PolarHBondContact O-NH2 3.23Å; L56-R61 HydrophobicContact CB-CG 3.72Å; L56-R61 PolarHBondContact O-NE 2.95Å; L56-R61 PolarHBondContact O-NH2 2.85Å; P57-R61 WeakPolarHBondContact O-CG 3.28Å; P57-R61 PolarHBondContact O-N 3.37Å; L58-R61 WeakPolarHBondContact O-CB 3.32Å; L58-R61 PolarHBondContact O-N 3.13Å; R61-A64 PolarHBondContact O-N 3.35Å; R61-S65 WeakPolarHBondContact O-CB 3.04Å; R61-S65 PolarHBondContact O-N 3.35Å; R61-F75 HydrophobicContact CB-CD2 3.85Å; R61-F75 HydrophobicContact CB-CE2 3.68Å
62	A	87.1	Confident	91.5	Very high	27 Å²	27	74 Å²	74	22%	0.223	37%	0.365	C	S	.	.	H	α-helix	trans	-65.1	-44.1	178.7	0	0	0	0	0	111.3	L58 L59 D60 S65 Q66 F75	L58-A62 WeakPolarHBondContact O-CB 3.3Å; L58-A62 PolarHBondContact O-N 2.83Å; L59-A62 WeakPolarHBondContact O-CB 3.31Å; L59-A62 PolarHBondContact O-N 3.37Å; L59-A62 VanDerWaalsContact O-N 3.15Å; D60-A62 VanDerWaalsContact C-N 3.29Å; D60-A62 PolarHBondContact O-N 3.13Å; A62-S65 WeakPolarHBondContact O-CB 3.47Å; A62-S65 PolarHBondContact O-N 2.87Å; A62-S65 PolarHBondContact O-OG 2.89Å; A62-Q66 WeakPolarHBondContact O-CG 3.3Å; A62-F75 HydrophobicContact CB-CE2 4.28Å; A62-F75 HydrophobicContact CB-CZ 4.22Å
63	H	90.3	Very high	91.4	Very high	102 Å²	102	76.3 Å²	76.3	47%	0.472	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-45.6	173.7	-69.4	-52.6	0	0	0	112.2	L59 D60 S65 Q66	L59-H63 PolarHBondContact O-CD2 3.49Å; L59-H63 PolarHBondContact O-N 2.98Å; D60-H63 PolarHBondContact O-N 2.86Å; H63-S65 VanDerWaalsContact C-N 3.26Å; H63-S65 PolarHBondContact O-N 3.27Å; H63-Q66 WeakPolarHBondContact O-CB 3.5Å; H63-Q66 PolarHBondContact O-N 3.4Å
64	A	92.7	Very high	91.4	Very high	12 Å²	12	76.3 Å²	76.3	10%	0.099	37%	0.371	C	S	.	.	H	α-helix	trans	-59.9	-37.2	176.2	0	0	0	0	0	111.8	F53 L56 D60 R61 Q66 V67 W71	F53-A64 HydrophobicContact CE1-CB 3.73Å; F53-A64 HydrophobicContact CE2-CB 4.4Å; F53-A64 HydrophobicContact CZ-CB 3.57Å; L56-A64 HydrophobicContact CD1-CB 4.24Å; D60-A64 WeakPolarHBondContact O-CB 3.37Å; D60-A64 PolarHBondContact O-N 3.42Å; R61-A64 PolarHBondContact O-N 3.35Å; A64-Q66 PolarHBondContact O-N 2.91Å; A64-Q66 VanDerWaalsContact O-N 3.14Å; A64-V67 WeakPolarHBondContact O-CB 3.14Å; A64-V67 VanDerWaalsContact O-CG2 3.31Å; A64-V67 WeakPolarHBondContact O-CG2 3.46Å; A64-V67 PolarHBondContact O-N 3.08Å; A64-V67 VanDerWaalsContact O-N 3.14Å; A64-W71 HydrophobicContact CB-CE3 3.98Å; A64-W71 HydrophobicContact CB-CZ3 4.08Å
65	S	92.4	Very high	91.4	Very high	9 Å²	9	73.1 Å²	73.1	6%	0.063	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.7	176.7	84.8	0	0	0	0	114	R61 A62 H63 N72 F75	R61-S65 WeakPolarHBondContact O-CB 3.04Å; R61-S65 PolarHBondContact O-N 3.35Å; A62-S65 WeakPolarHBondContact O-CB 3.47Å; A62-S65 PolarHBondContact O-N 2.87Å; A62-S65 PolarHBondContact O-OG 2.89Å; H63-S65 VanDerWaalsContact C-N 3.26Å; H63-S65 PolarHBondContact O-N 3.27Å; S65-N72 WeakPolarHBondContact O-CA 3.32Å; S65-N72 VanDerWaalsContact O-CB 3.23Å; S65-N72 WeakPolarHBondContact O-CB 3.5Å; S65-N72 PolarHBondContact O-ND2 3.46Å; S65-N72 VanDerWaalsContact O-ND2 3.14Å; S65-F75 VanDerWaalsContact CB-CB 3.48Å
66	Q	92.4	Very high	91.4	Very high	149 Å²	149	66 Å²	66	70%	0.696	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-9.7	178.5	-64.3	175.3	13.1	0	0	112.9	A62 H63 A64	A62-Q66 WeakPolarHBondContact O-CG 3.3Å; H63-Q66 WeakPolarHBondContact O-CB 3.5Å; H63-Q66 PolarHBondContact O-N 3.4Å; A64-Q66 PolarHBondContact O-N 2.91Å; A64-Q66 VanDerWaalsContact O-N 3.14Å
67	V	93.6	Very high	91.5	Very high	101 Å²	101	65.5 Å²	65.5	61%	0.612	33%	0.327	S	S	*	.	S	Bend	trans	-64.1	-47	-177.5	174.7	0	0	0	0	111.5	A64 W71	A64-V67 WeakPolarHBondContact O-CB 3.14Å; A64-V67 VanDerWaalsContact O-CG2 3.31Å; A64-V67 WeakPolarHBondContact O-CG2 3.46Å; A64-V67 PolarHBondContact O-N 3.08Å; A64-V67 VanDerWaalsContact O-N 3.14Å; V67-W71 HydrophobicContact CB-CE3 4.39Å; V67-W71 HydrophobicContact CG2-CE3 4.45Å
68	C	92.4	Very high	91.8	Very high	34 Å²	34	64.5 Å²	64.5	23%	0.23	32%	0.32	C	S	.	.			trans	-158.8	168.8	177.2	72.7	0	0	0	0	112.2	A42 N70 W71 N72	A42-C68 HydrophobicContact CB-CB 4.29Å; C68-N70 VanDerWaalsContact C-N 3.32Å; C68-N70 PolarHBondContact O-N 3.47Å; C68-W71 PolarHBondContact O-N 2.68Å; C68-N72 PolarHBondContact O-N 2.77Å
69	R	92.6	Very high	92.1	Very high	223 Å²	223	64.7 Å²	64.7	84%	0.842	32%	0.321	S	S	*	.	H	α-helix	trans	-59.6	-37.8	-179.6	-68.5	-177.1	-176.9	172.4	1.3	113.4	N72 Q73	R69-N72 WeakPolarHBondContact O-CB 3.15Å; R69-N72 PolarHBondContact O-N 3.26Å; R69-Q73 WeakPolarHBondContact O-CG 3.22Å; R69-Q73 PolarHBondContact O-N 2.87Å
70	N	93.6	Very high	92.6	Very high	32 Å²	32	60 Å²	60	17%	0.171	30%	0.297	C	S	.	.	H	α-helix	trans	-65.5	-46.5	-179.4	-175	32.7	0	0	0	111.1	A42 L44 Q46 I49 C68 N72 Q73 V74	A42-N70 WeakPolarHBondContact O-CB 3.24Å; A42-N70 PolarHBondContact O-ND2 3.47Å; L44-N70 PolarHBondContact O-ND2 2.96Å; Q46-N70 WeakPolarHBondContact CG-OD1 3Å; Q46-N70 PolarHBondContact NE2-OD1 2.69Å; I49-N70 WeakPolarHBondContact CD1-ND2 3.17Å; C68-N70 VanDerWaalsContact C-N 3.32Å; C68-N70 PolarHBondContact O-N 3.47Å; N70-N72 VanDerWaalsContact C-N 3.29Å; N70-N72 PolarHBondContact O-N 3Å; N70-Q73 WeakPolarHBondContact O-CB 3.21Å; N70-Q73 PolarHBondContact O-N 3.3Å; N70-V74 PolarHBondContact O-N 3.5Å
71	W	94.6	Very high	92.8	Very high	46 Å²	46	56.5 Å²	56.5	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-33.9	176.1	-70.7	40.6	0	0	0	111.9	W41 I49 F53 A64 V67 C68 V74 F75	W41-W71 PolarHBondContact O-NE1 2.92Å; W41-W71 VanDerWaalsContact O-NE1 3.08Å; I49-W71 VanDerWaalsContact CD1-CD1 3.42Å; I49-W71 HydrophobicContact CD1-CG 4.15Å; I49-W71 HydrophobicContact CG2-CD2 4.18Å; I49-W71 HydrophobicContact CG2-CG 4.17Å; F53-W71 HydrophobicContact CE1-CD2 4.41Å; F53-W71 AromaticContact CE1-CE3 3.74Å; F53-W71 HydrophobicContact CE1-CE3 3.74Å; F53-W71 HydrophobicContact CE1-CZ3 4.18Å; F53-W71 HydrophobicContact CZ-CB 4.35Å; F53-W71 HydrophobicContact CZ-CE3 4.08Å; A64-W71 HydrophobicContact CB-CE3 3.98Å; A64-W71 HydrophobicContact CB-CZ3 4.08Å; V67-W71 HydrophobicContact CB-CE3 4.39Å; V67-W71 HydrophobicContact CG2-CE3 4.45Å; C68-W71 PolarHBondContact O-N 2.68Å; W71-V74 PolarHBondContact O-N 2.93Å; W71-F75 PolarHBondContact O-N 2.67Å; W71-F75 VanDerWaalsContact O-N 3.07Å
72	N	93.9	Very high	93	Very high	65 Å²	65	59.4 Å²	59.4	35%	0.348	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-39	173.5	-167.6	-103.4	0	0	0	113.2	S65 C68 R69 N70 V74 F75	S65-N72 WeakPolarHBondContact O-CA 3.32Å; S65-N72 VanDerWaalsContact O-CB 3.23Å; S65-N72 WeakPolarHBondContact O-CB 3.5Å; S65-N72 PolarHBondContact O-ND2 3.46Å; S65-N72 VanDerWaalsContact O-ND2 3.14Å; C68-N72 PolarHBondContact O-N 2.77Å; R69-N72 WeakPolarHBondContact O-CB 3.15Å; R69-N72 PolarHBondContact O-N 3.26Å; N70-N72 VanDerWaalsContact C-N 3.29Å; N70-N72 PolarHBondContact O-N 3Å; N72-V74 VanDerWaalsContact C-N 3.34Å; N72-F75 WeakPolarHBondContact O-CB 3.33Å; N72-F75 PolarHBondContact O-N 2.94Å
73	Q	92.6	Very high	93.3	Very high	113 Å²	113	62.3 Å²	62.3	53%	0.528	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-42.9	175.9	-71.8	170.8	-6.7	0	0	111.1	Q46 R69 N70 F75 H76	Q46-Q73 VanDerWaalsContact NE2-OE1 3.17Å; R69-Q73 WeakPolarHBondContact O-CG 3.22Å; R69-Q73 PolarHBondContact O-N 2.87Å; N70-Q73 WeakPolarHBondContact O-CB 3.21Å; N70-Q73 PolarHBondContact O-N 3.3Å; Q73-F75 VanDerWaalsContact C-N 3.3Å; Q73-F75 PolarHBondContact O-N 3.19Å; Q73-H76 PolarHBondContact O-N 3.41Å; Q73-H76 VanDerWaalsContact O-N 3.09Å
74	V	94.8	Very high	93.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-37.6	178.3	176.6	0	0	0	0	111.7	Q46 I49 L50 N70 W71 N72 H76 M77 L80	Q46-V74 HydrophobicContact CB-CG2 3.75Å; Q46-V74 HydrophobicContact CG-CG2 3.74Å; I49-V74 HydrophobicContact CB-CB 4.32Å; I49-V74 HydrophobicContact CB-CG1 4.02Å; I49-V74 HydrophobicContact CB-CG2 3.99Å; I49-V74 HydrophobicContact CD1-CG2 4.17Å; I49-V74 HydrophobicContact CG2-CB 3.91Å; I49-V74 HydrophobicContact CG2-CG1 3.72Å; I49-V74 HydrophobicContact CG2-CG2 4.05Å; L50-V74 HydrophobicContact CB-CG1 4.04Å; N70-V74 PolarHBondContact O-N 3.5Å; W71-V74 PolarHBondContact O-N 2.93Å; N72-V74 VanDerWaalsContact C-N 3.34Å; V74-H76 PolarHBondContact O-N 3.34Å; V74-M77 HydrophobicContact CB-SD 4.31Å; V74-M77 HydrophobicContact CG1-SD 3.96Å; V74-M77 HydrophobicContact CG2-SD 4.28Å; V74-M77 WeakPolarHBondContact O-CB 3.21Å; V74-M77 WeakPolarHBondContact O-CG 3.26Å; V74-M77 PolarHBondContact O-N 3.29Å; V74-L80 WeakPolarHBondContact O-CD1 3.22Å
75	F	93.6	Very high	93.6	Very high	13 Å²	13	61.2 Å²	61.2	6%	0.057	30%	0.3	C	S	.	.	H	α-helix	trans	-54.5	-26.7	175.1	-176.5	-109.1	0	0	0	113.3	F53 L58 R61 A62 S65 W71 N72 Q73 W81	F53-F75 HydrophobicContact CD2-CD2 4.41Å; F53-F75 HydrophobicContact CE2-CB 3.96Å; F53-F75 HydrophobicContact CE2-CD2 4.1Å; L58-F75 HydrophobicContact CD1-CE2 4.4Å; L58-F75 HydrophobicContact CD1-CZ 4.4Å; R61-F75 HydrophobicContact CB-CD2 3.85Å; R61-F75 HydrophobicContact CB-CE2 3.68Å; A62-F75 HydrophobicContact CB-CE2 4.28Å; A62-F75 HydrophobicContact CB-CZ 4.22Å; S65-F75 VanDerWaalsContact CB-CB 3.48Å; W71-F75 PolarHBondContact O-N 2.67Å; W71-F75 VanDerWaalsContact O-N 3.07Å; N72-F75 WeakPolarHBondContact O-CB 3.33Å; N72-F75 PolarHBondContact O-N 2.94Å; Q73-F75 VanDerWaalsContact C-N 3.3Å; Q73-F75 PolarHBondContact O-N 3.19Å; F75-W81 HydrophobicContact CD1-CZ2 4.19Å; F75-W81 HydrophobicContact CE1-CH2 4.15Å; F75-W81 AromaticContact CE1-CZ2 3.56Å; F75-W81 HydrophobicContact CE1-CZ2 3.56Å; F75-W81 HydrophobicContact CE2-CZ2 4.09Å; F75-W81 AromaticContact CZ-CH2 3.85Å; F75-W81 HydrophobicContact CZ-CH2 3.85Å; F75-W81 AromaticContact CZ-CZ2 3.5Å; F75-W81 HydrophobicContact CZ-CZ2 3.5Å; F75-W81 PolarHBondContact O-NE1 2.78Å
76	H	92.6	Very high	93.8	Very high	44 Å²	44	60.8 Å²	60.8	20%	0.204	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	9.6	179.9	-68.8	-41.9	0	0	0	114.5	Q73 V74 Q106 R110 H111	Q73-H76 PolarHBondContact O-N 3.41Å; Q73-H76 VanDerWaalsContact O-N 3.09Å; V74-H76 PolarHBondContact O-N 3.34Å; H76-Q106 PolarHBondContact CE1-NE2 3.18Å; H76-R110 PolarHBondContact NE2-NH1 3.05Å; H76-H111 AromaticContact ND1-CE1 3.78Å; H76-H111 AromaticContact ND1-NE2 3.54Å
77	M	94.1	Very high	93.9	Very high	38 Å²	38	55.6 Å²	55.6	19%	0.187	27%	0.272	C	S	.	.			trans	-69	138.7	176.4	-71.9	-179.8	74.5	0	0	111.8	L50 V74 D79 L80	L50-M77 HydrophobicContact CB-SD 4.28Å; L50-M77 HydrophobicContact CD1-CB 4.32Å; L50-M77 HydrophobicContact CD1-SD 4.28Å; L50-M77 HydrophobicContact CD2-CE 3.8Å; L50-M77 HydrophobicContact CD2-SD 4.33Å; V74-M77 HydrophobicContact CB-SD 4.31Å; V74-M77 HydrophobicContact CG1-SD 3.96Å; V74-M77 HydrophobicContact CG2-SD 4.28Å; V74-M77 WeakPolarHBondContact O-CB 3.21Å; V74-M77 WeakPolarHBondContact O-CG 3.26Å; V74-M77 PolarHBondContact O-N 3.29Å; M77-D79 PolarHBondContact O-N 3.12Å; M77-D79 VanDerWaalsContact O-N 3.1Å; M77-L80 PolarHBondContact O-N 3.48Å; M77-L80 VanDerWaalsContact O-N 3.1Å
78	P	93	Very high	93.9	Very high	53 Å²	53	51.4 Å²	51.4	34%	0.344	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-51.6	-37.4	-177	-28.2	34.6	0	0	0	114.4	L80 W81 R82 H114	P78-L80 PolarHBondContact O-N 3.3Å; P78-W81 PolarHBondContact O-N 3.02Å; P78-R82 WeakPolarHBondContact O-CG 3.16Å; P78-R82 PolarHBondContact O-N 3.31Å; P78-H114 HydrophobicContact CB-CB 4.16Å
79	D	92.6	Very high	93.7	Very high	61 Å²	61	50.1 Å²	50.1	33%	0.326	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-59.3	-27.9	-177.6	-61.4	-83.9	0	0	0	113.8	L50 M77 R82	L50-D79 HydrophobicContact CD1-CB 4.1Å; L50-D79 HydrophobicContact CD2-CB 4.2Å; M77-D79 PolarHBondContact O-N 3.12Å; M77-D79 VanDerWaalsContact O-N 3.1Å; D79-R82 IonicContact OD1-CZ 3.68Å; D79-R82 IonicContact OD1-NE 2.7Å; D79-R82 IonicContact OD1-NH2 3.96Å; D79-R82 PolarHBondContact OD1-NH2 3.02Å
80	L	93.9	Very high	93.4	Very high	13 Å²	13	43.1 Å²	43.1	7%	0.068	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-83.1	-13.6	177.6	-63.3	179.8	0	0	0	113.8	L50 F53 Q54 V74 M77 P78	L50-L80 HydrophobicContact CD1-CD1 4.07Å; L50-L80 HydrophobicContact CD1-CD2 3.66Å; L50-L80 HydrophobicContact CD1-CG 3.54Å; F53-L80 HydrophobicContact CB-CD1 3.82Å; F53-L80 HydrophobicContact CB-CD2 3.82Å; F53-L80 HydrophobicContact CB-CG 4.49Å; F53-L80 HydrophobicContact CD2-CD1 3.67Å; F53-L80 HydrophobicContact CG-CD1 4.2Å; Q54-L80 HydrophobicContact CG-CD2 4.02Å; V74-L80 WeakPolarHBondContact O-CD1 3.22Å; M77-L80 PolarHBondContact O-N 3.48Å; M77-L80 VanDerWaalsContact O-N 3.1Å; P78-L80 PolarHBondContact O-N 3.3Å
81	W	94.5	Very high	92.9	Very high	3 Å²	3	47.3 Å²	47.3	1%	0.011	24%	0.243	C	C	.	.	S	Bend	trans	-117.1	11.1	-173.1	-62.3	95	0	0	0	113.5	L58 F75 P78 C83 F84 L103 I107 H111 H114 L115	L58-W81 HydrophobicContact CD1-CH2 3.93Å; L58-W81 HydrophobicContact CD1-CZ3 4.23Å; F75-W81 HydrophobicContact CD1-CZ2 4.19Å; F75-W81 HydrophobicContact CE1-CH2 4.15Å; F75-W81 AromaticContact CE1-CZ2 3.56Å; F75-W81 HydrophobicContact CE1-CZ2 3.56Å; F75-W81 HydrophobicContact CE2-CZ2 4.09Å; F75-W81 AromaticContact CZ-CH2 3.85Å; F75-W81 HydrophobicContact CZ-CH2 3.85Å; F75-W81 AromaticContact CZ-CZ2 3.5Å; F75-W81 HydrophobicContact CZ-CZ2 3.5Å; F75-W81 PolarHBondContact O-NE1 2.78Å; P78-W81 PolarHBondContact O-N 3.02Å; W81-C83 PolarHBondContact O-N 2.98Å; W81-F84 HydrophobicContact CE3-CD2 4.18Å; W81-F84 HydrophobicContact CZ3-CD2 4.04Å; W81-F84 AromaticContact CZ3-CE2 3.91Å; W81-F84 HydrophobicContact CZ3-CE2 3.91Å; W81-L103 HydrophobicContact CH2-CD1 4.04Å; W81-L103 HydrophobicContact CZ3-CD1 4.3Å; W81-I107 HydrophobicContact CE3-CG1 4.06Å; W81-I107 HydrophobicContact CH2-CG1 4.49Å; W81-I107 HydrophobicContact CZ3-CD1 4.02Å; W81-I107 HydrophobicContact CZ3-CG1 3.62Å; W81-H111 HydrophobicContact CB-CB 3.98Å; W81-H111 AromaticContact CD1-CD2 3.99Å; W81-H111 AromaticContact CD1-CE1 3.41Å; W81-H111 VanDerWaalsContact CD1-CE1 3.41Å; W81-H111 AromaticContact CD1-CG 3.97Å; W81-H111 AromaticContact CD1-ND1 3.64Å; W81-H111 AromaticContact CD1-NE2 3.64Å; W81-H111 HydrophobicContact CD2-CB 4.47Å; W81-H111 AromaticContact CD2-CD2 3.39Å; W81-H111 AromaticContact CD2-CG 3.84Å; W81-H111 AromaticContact CD2-NE2 3.59Å; W81-H111 AromaticContact CE2-CD2 3.6Å; W81-H111 AromaticContact CE2-CE1 3.87Å; W81-H111 AromaticContact CE2-NE2 3.27Å; W81-H111 VanDerWaalsContact CE2-NE2 3.27Å; W81-H111 AromaticContact CE3-CD2 3.75Å; W81-H111 HydrophobicContact CG-CB 4.17Å; W81-H111 AromaticContact CG-CD2 3.69Å; W81-H111 AromaticContact CG-CE1 3.85Å; W81-H111 AromaticContact CG-CG 3.63Å; W81-H111 AromaticContact CG-ND1 3.75Å; W81-H111 AromaticContact CG-NE2 3.82Å; W81-H111 AromaticContact CZ2-NE2 3.74Å; W81-H111 AromaticContact NE1-CD2 3.96Å; W81-H111 AromaticContact NE1-CE1 3.45Å; W81-H111 PolarHBondContact NE1-CE1 3.01Å; W81-H111 AromaticContact NE1-NE2 3.34Å; W81-H111 PolarHBondContact NE1-NE2 2.78Å; W81-H114 HydrophobicContact CB-CB 4.43Å; W81-L115 WeakPolarHBondContact O-CD2 3.16Å
82	R	94.6	Very high	92.1	Very high	109 Å²	109	49.8 Å²	49.8	41%	0.411	27%	0.274	S	S	.	.	S	Bend	trans	-65.5	-26.6	175.6	-61.8	-173.3	-174.2	-178.5	4	112.8	P78 D79 H114 Q116 Y117	P78-R82 WeakPolarHBondContact O-CG 3.16Å; P78-R82 PolarHBondContact O-N 3.31Å; D79-R82 IonicContact OD1-CZ 3.68Å; D79-R82 IonicContact OD1-NE 2.7Å; D79-R82 IonicContact OD1-NH2 3.96Å; D79-R82 PolarHBondContact OD1-NH2 3.02Å; R82-H114 WeakPolarHBondContact CA-O 3.26Å; R82-Q116 PolarHBondContact O-N 3.1Å; R82-Y117 PolarHBondContact O-N 2.76Å
83	C	94.5	Very high	91.1	Very high	89 Å²	89	49.6 Å²	49.6	60%	0.601	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	130.1	-178	-173.8	0	0	0	0	110.1	W81 Y117	W81-C83 PolarHBondContact O-N 2.98Å; C83-Y117 VanDerWaalsContact CA-O 3.3Å; C83-Y117 WeakPolarHBondContact CA-O 3.42Å
84	F	94.8	Very high	90.3	Very high	16 Å²	16	45.2 Å²	45.2	7%	0.07	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	137.4	174.1	-158.6	-87.9	0	0	0	111.7	L58 W81 F86 T99 L103 I107 L115 Y117 V118 S119	L58-F84 HydrophobicContact CD2-CE2 3.55Å; L58-F84 HydrophobicContact CD2-CZ 3.91Å; W81-F84 HydrophobicContact CE3-CD2 4.18Å; W81-F84 HydrophobicContact CZ3-CD2 4.04Å; W81-F84 AromaticContact CZ3-CE2 3.91Å; W81-F84 HydrophobicContact CZ3-CE2 3.91Å; F84-F86 AromaticContact CD1-CD1 3.96Å; F84-F86 HydrophobicContact CD1-CD1 3.96Å; F84-F86 AromaticContact CD1-CD2 3.98Å; F84-F86 HydrophobicContact CD1-CD2 3.98Å; F84-F86 AromaticContact CD1-CE1 3.88Å; F84-F86 HydrophobicContact CD1-CE1 3.88Å; F84-F86 AromaticContact CD1-CE2 3.9Å; F84-F86 HydrophobicContact CD1-CE2 3.9Å; F84-F86 HydrophobicContact CD1-CG 4.02Å; F84-F86 AromaticContact CD1-CZ 3.84Å; F84-F86 HydrophobicContact CD1-CZ 3.84Å; F84-F86 AromaticContact CE1-CD1 3.78Å; F84-F86 HydrophobicContact CE1-CD1 3.78Å; F84-F86 AromaticContact CE1-CE1 3.87Å; F84-F86 HydrophobicContact CE1-CE1 3.87Å; F84-F86 HydrophobicContact CE1-CG 4.16Å; F84-F86 HydrophobicContact CE1-CZ 4.32Å; F84-T99 HydrophobicContact CE1-CG2 4.11Å; F84-T99 HydrophobicContact CZ-CG2 4.12Å; F84-L103 HydrophobicContact CZ-CD2 4.07Å; F84-L103 HydrophobicContact CZ-CG 4.47Å; F84-I107 HydrophobicContact CD1-CD1 3.9Å; F84-I107 HydrophobicContact CD2-CD1 3.76Å; F84-I107 HydrophobicContact CE1-CD1 3.54Å; F84-I107 HydrophobicContact CE2-CD1 3.36Å; F84-I107 HydrophobicContact CE2-CG1 4.42Å; F84-I107 HydrophobicContact CG-CD1 4.02Å; F84-I107 HydrophobicContact CZ-CD1 3.26Å; F84-L115 HydrophobicContact CB-CD2 3.8Å; F84-Y117 PolarHBondContact N-O 3.12Å; F84-V118 WeakPolarHBondContact O-CA 3.4Å; F84-S119 PolarHBondContact O-N 2.99Å; F84-S119 VanDerWaalsContact O-N 3.15Å
85	E	95.1	Very high	89.4	Confident	74 Å²	74	56.9 Å²	56.9	35%	0.346	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.7	173.7	178.6	157.9	76.4	0	0	109.2	E87 S119 K121	E85-E87 PolarHBondContact O-N 3.21Å; E85-S119 CarbonylContact C-O 3.51Å; E85-S119 WeakPolarHBondContact CA-O 3.45Å; E85-S119 VanDerWaalsContact CB-OG 3.3Å; E85-S119 WeakPolarHBondContact CB-OG 3.35Å; E85-S119 VanDerWaalsContact CD-OG 3.31Å; E85-S119 WeakPolarHBondContact CG-OG 3.24Å; E85-S119 PolarHBondContact OE2-OG 2.95Å; E85-K121 HydrophobicContact CG-CD 4.08Å; E85-K121 HydrophobicContact CG-CG 4.41Å; E85-K121 WeakPolarHBondContact OE1-CE 3.47Å; E85-K121 IonicContact OE1-NZ 3.33Å; E85-K121 PolarHBondContact OE1-NZ 3.14Å; E85-K121 VanDerWaalsContact OE2-CE 3.29Å; E85-K121 WeakPolarHBondContact OE2-CE 3.49Å; E85-K121 IonicContact OE2-NZ 2.91Å
86	F	94.9	Very high	88.8	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	109.6	175.1	-66.1	-83.8	0	0	0	109.4	F84 L88 I104 I107 V118 S119 F120 K121 I135	F84-F86 AromaticContact CD1-CD1 3.96Å; F84-F86 HydrophobicContact CD1-CD1 3.96Å; F84-F86 AromaticContact CD1-CD2 3.98Å; F84-F86 HydrophobicContact CD1-CD2 3.98Å; F84-F86 AromaticContact CD1-CE1 3.88Å; F84-F86 HydrophobicContact CD1-CE1 3.88Å; F84-F86 AromaticContact CD1-CE2 3.9Å; F84-F86 HydrophobicContact CD1-CE2 3.9Å; F84-F86 HydrophobicContact CD1-CG 4.02Å; F84-F86 AromaticContact CD1-CZ 3.84Å; F84-F86 HydrophobicContact CD1-CZ 3.84Å; F84-F86 AromaticContact CE1-CD1 3.78Å; F84-F86 HydrophobicContact CE1-CD1 3.78Å; F84-F86 AromaticContact CE1-CE1 3.87Å; F84-F86 HydrophobicContact CE1-CE1 3.87Å; F84-F86 HydrophobicContact CE1-CG 4.16Å; F84-F86 HydrophobicContact CE1-CZ 4.32Å; F86-L88 HydrophobicContact CB-CD2 4.47Å; F86-L88 HydrophobicContact CB-CG 4.28Å; F86-I104 HydrophobicContact CD1-CG1 4.16Å; F86-I104 HydrophobicContact CE1-CG1 4.22Å; F86-I104 HydrophobicContact CE1-CG2 4.21Å; F86-I107 HydrophobicContact CE1-CD1 4.17Å; F86-I107 HydrophobicContact CZ-CD1 4.5Å; F86-I107 HydrophobicContact CZ-CG2 4.05Å; F86-V118 HydrophobicContact CD2-CG1 3.91Å; F86-V118 HydrophobicContact CE2-CG1 3.8Å; F86-S119 PolarHBondContact N-O 3.22Å; F86-F120 HydrophobicContact CB-CD1 3.64Å; F86-F120 HydrophobicContact CB-CE1 3.93Å; F86-F120 HydrophobicContact CB-CG 4.33Å; F86-F120 AromaticContact CD2-CD1 3.97Å; F86-F120 HydrophobicContact CD2-CD1 3.97Å; F86-F120 AromaticContact CD2-CE1 3.53Å; F86-F120 HydrophobicContact CD2-CE1 3.53Å; F86-F120 HydrophobicContact CD2-CE2 4.22Å; F86-F120 HydrophobicContact CD2-CG 4.48Å; F86-F120 AromaticContact CD2-CZ 3.67Å; F86-F120 HydrophobicContact CD2-CZ 3.67Å; F86-F120 HydrophobicContact CE2-CE1 4.18Å; F86-F120 AromaticContact CE2-CZ 3.99Å; F86-F120 HydrophobicContact CE2-CZ 3.99Å; F86-F120 HydrophobicContact CG-CD1 4.03Å; F86-F120 AromaticContact CG-CE1 3.78Å; F86-F120 HydrophobicContact CG-CE1 3.78Å; F86-F120 HydrophobicContact CG-CZ 4.39Å; F86-F120 WeakPolarHBondContact O-CA 3.34Å; F86-K121 PolarHBondContact O-N 3.31Å; F86-I135 HydrophobicContact CD1-CD1 4.23Å; F86-I135 HydrophobicContact CE1-CG2 4.46Å; F86-I135 HydrophobicContact CE2-CG2 4.4Å; F86-I135 HydrophobicContact CZ-CG2 4.21Å
87	E	94.6	Very high	88.3	Confident	41 Å²	41	70.3 Å²	70.3	19%	0.192	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	108.4	167.6	-65.4	-76.8	-177.8	0	0	108.5	E85 N89 A98 T99 K121	E85-E87 PolarHBondContact O-N 3.21Å; E87-N89 PolarHBondContact OE2-ND2 3.14Å; E87-A98 CarbonylContact O-C 3.58Å; E87-A98 WeakPolarHBondContact O-CA 3.31Å; E87-T99 PolarHBondContact N-OG1 3.19Å; E87-T99 PolarHBondContact O-N 2.86Å; E87-T99 PolarHBondContact O-OG1 2.79Å; E87-T99 VanDerWaalsContact O-OG1 3.12Å; E87-K121 WeakPolarHBondContact OE1-CD 3.37Å; E87-K121 IonicContact OE1-NZ 2.87Å; E87-K121 PolarHBondContact OE1-NZ 3.27Å; E87-K121 WeakPolarHBondContact OE2-CB 3.41Å; E87-K121 WeakPolarHBondContact OE2-CD 3.49Å
88	L	93.4	Very high	88	Confident	12 Å²	12	70.9 Å²	70.9	6%	0.063	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	96	-178.2	-59.1	179.9	0	0	0	109	F86 I104 F120 K121 V122 D123 S128 A131 A132 I135	F86-L88 HydrophobicContact CB-CD2 4.47Å; F86-L88 HydrophobicContact CB-CG 4.28Å; L88-I104 HydrophobicContact CD2-CD1 4.05Å; L88-F120 HydrophobicContact CD1-CD1 3.83Å; L88-F120 HydrophobicContact CD1-CE1 4.47Å; L88-K121 PolarHBondContact N-O 2.98Å; L88-V122 HydrophobicContact CB-CG2 4.44Å; L88-V122 HydrophobicContact CD1-CG2 4.38Å; L88-V122 WeakPolarHBondContact O-CA 3.39Å; L88-D123 PolarHBondContact O-N 2.85Å; L88-S128 VanDerWaalsContact O-CB 3.29Å; L88-S128 WeakPolarHBondContact O-CB 3.26Å; L88-S128 PolarHBondContact O-OG 3.08Å; L88-A131 HydrophobicContact CD1-CB 4.42Å; L88-A132 HydrophobicContact CD1-CB 3.59Å; L88-I135 HydrophobicContact CD1-CD1 4.19Å; L88-I135 HydrophobicContact CD2-CD1 4.11Å
89	N	90.3	Very high	87.8	Confident	7 Å²	7	69.3 Å²	69.3	4%	0.037	36%	0.358	C	S	.	.			trans	-136.1	140.8	-169.4	-61.4	-38.4	0	0	0	109.6	E87 A98 D123	E87-N89 PolarHBondContact OE2-ND2 3.14Å; N89-A98 HydrophobicContact CB-CB 4.33Å; N89-A98 WeakPolarHBondContact O-CB 3.24Å; N89-D123 WeakPolarHBondContact CA-OD2 3.39Å
90	Q	85.6	Confident	87.6	Confident	76 Å²	76	72.1 Å²	72.1	36%	0.355	37%	0.369	S	S	.	.			trans	-99.3	143.1	170.6	-61.4	-61.7	-30.5	0	0	110.4	A92 T93 S94 D123 S125	Q90-A92 PolarHBondContact O-N 2.91Å; Q90-T93 PolarHBondContact O-N 3.46Å; Q90-T93 PolarHBondContact O-OG1 3.45Å; Q90-S94 PolarHBondContact O-N 3.24Å; Q90-D123 PolarHBondContact N-OD2 3.39Å; Q90-S125 VanDerWaalsContact CG-OG 3.24Å; Q90-S125 WeakPolarHBondContact CG-OG 3.44Å
91	P	83.7	Confident	87.4	Confident	121 Å²	121	75.2 Å²	75.2	79%	0.786	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-23.4	175.8	-24.3	33.5	0	0	0	113.9
92	A	77.3	Confident	87.1	Confident	98 Å²	98	80.1 Å²	80.1	81%	0.81	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-24.7	178.5	0	0	0	0	0	113.5	Q90	Q90-A92 PolarHBondContact O-N 2.91Å
93	T	71.8	Confident	86.9	Confident	61 Å²	61	76.6 Å²	76.6	37%	0.374	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	-5.9	-169.2	39.7	0	0	0	0	113.4	Q90 D123	Q90-T93 PolarHBondContact O-N 3.46Å; Q90-T93 PolarHBondContact O-OG1 3.45Å; T93-D123 WeakPolarHBondContact CB-OD2 3.39Å; T93-D123 VanDerWaalsContact OG1-CG 3.27Å; T93-D123 PolarHBondContact OG1-OD2 3.02Å
94	S	77	Confident	86.8	Confident	21 Å²	21	73.4 Å²	73.4	15%	0.147	38%	0.379	C	S	.	.			trans	-149.4	144.4	-179.3	-175.3	0	0	0	0	112.7	Q90 L96	Q90-S94 PolarHBondContact O-N 3.24Å; S94-L96 VanDerWaalsContact C-N 3.34Å; S94-L96 PolarHBondContact OG-N 2.8Å; S94-L96 VanDerWaalsContact OG-N 3.15Å
95	Y	76.4	Confident	86.7	Confident	244 Å²	244	78.5 Å²	78.5	96%	0.957	40%	0.402	S	S	*	.	S	Bend	trans	-86.1	-7.5	171.6	-58.1	-77.9	0	0	0	112.8
96	L	79.3	Confident	86.5	Confident	109 Å²	109	77.7 Å²	77.7	57%	0.571	40%	0.398	S	S	*	.	S	Bend	trans	-85	150.7	-177.8	-60.7	177.2	0	0	0	111.3	S94	S94-L96 VanDerWaalsContact C-N 3.34Å; S94-L96 PolarHBondContact OG-N 2.8Å; S94-L96 VanDerWaalsContact OG-N 3.15Å
97	R	81.8	Confident	86.4	Confident	231 Å²	231	77.7 Å²	77.7	87%	0.872	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-78.7	126.2	176.9	-68.4	-174.3	179.5	-179.5	0.8	110.3
98	A	88.8	Confident	86.3	Confident	49 Å²	49	76.8 Å²	76.8	41%	0.405	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-70.9	158.1	171.9	0	0	0	0	0	112.1	E87 N89 H100	E87-A98 CarbonylContact O-C 3.58Å; E87-A98 WeakPolarHBondContact O-CA 3.31Å; N89-A98 HydrophobicContact CB-CB 4.33Å; N89-A98 WeakPolarHBondContact O-CB 3.24Å; A98-H100 PolarHBondContact O-N 2.82Å
99	T	89.5	Confident	86.3	Confident	20 Å²	20	84.9 Å²	84.9	12%	0.123	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-63.6	128.4	170.5	-51.4	0	0	0	0	109.2	F84 E87 L103 I104	F84-T99 HydrophobicContact CE1-CG2 4.11Å; F84-T99 HydrophobicContact CZ-CG2 4.12Å; E87-T99 PolarHBondContact N-OG1 3.19Å; E87-T99 PolarHBondContact O-N 2.86Å; E87-T99 PolarHBondContact O-OG1 2.79Å; E87-T99 VanDerWaalsContact O-OG1 3.12Å; T99-L103 HydrophobicContact CG2-CD2 3.93Å; T99-L103 HydrophobicContact CG2-CG 4.34Å; T99-I104 HydrophobicContact CG2-CD1 4.3Å; T99-I104 HydrophobicContact CG2-CG1 3.72Å
100	H	88.8	Confident	86.4	Confident	120 Å²	120	90.9 Å²	90.9	56%	0.556	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-61.8	133.5	-177	-168.9	-85.5	0	0	0	111.4	A98 E102 L103 I104	A98-H100 PolarHBondContact O-N 2.82Å; H100-E102 VanDerWaalsContact C-N 3.3Å; H100-E102 PolarHBondContact ND1-N 3.42Å; H100-E102 PolarHBondContact O-N 3.23Å; H100-L103 HydrophobicContact CB-CB 4.33Å; H100-L103 WeakPolarHBondContact O-CA 3.4Å; H100-L103 WeakPolarHBondContact O-CB 3.19Å; H100-L103 PolarHBondContact O-N 2.87Å; H100-I104 PolarHBondContact O-N 3.31Å
101	P	89.5	Confident	86.8	Confident	79 Å²	79	87.4 Å²	87.4	51%	0.513	43%	0.434	S	S	.	.	H	α-helix	trans	-56.1	-38.2	-175.3	-29.3	35.5	0	0	0	114.8	L103 I104 K105	P101-L103 VanDerWaalsContact C-N 3.3Å; P101-L103 PolarHBondContact O-N 3.01Å; P101-I104 WeakPolarHBondContact O-CB 3.25Å; P101-I104 PolarHBondContact O-N 2.74Å; P101-K105 WeakPolarHBondContact O-CG 3.33Å; P101-K105 PolarHBondContact O-N 2.59Å
102	E	87.9	Confident	87.2	Confident	105 Å²	105	82.3 Å²	82.3	49%	0.491	40%	0.401	S	S	.	.	H	α-helix	trans	-67.7	-30.2	177.3	-64.2	-54.8	114.3	0	0	113	H100 K105 Q106	H100-E102 VanDerWaalsContact C-N 3.3Å; H100-E102 PolarHBondContact ND1-N 3.42Å; H100-E102 PolarHBondContact O-N 3.23Å; E102-K105 IonicContact OE1-NZ 3.9Å; E102-K105 PolarHBondContact OE1-NZ 3.2Å; E102-Q106 WeakPolarHBondContact O-CB 3.38Å; E102-Q106 PolarHBondContact O-N 3.47Å
103	L	89.9	Confident	88	Confident	36 Å²	36	82.2 Å²	82.2	19%	0.188	39%	0.388	C	S	.	.	H	α-helix	trans	-69.6	-41.5	174.3	174.6	62.1	0	0	0	110.3	L58 W81 F84 T99 H100 P101 K105 Q106 I107	L58-L103 HydrophobicContact CD2-CD2 3.89Å; W81-L103 HydrophobicContact CH2-CD1 4.04Å; W81-L103 HydrophobicContact CZ3-CD1 4.3Å; F84-L103 HydrophobicContact CZ-CD2 4.07Å; F84-L103 HydrophobicContact CZ-CG 4.47Å; T99-L103 HydrophobicContact CG2-CD2 3.93Å; T99-L103 HydrophobicContact CG2-CG 4.34Å; H100-L103 HydrophobicContact CB-CB 4.33Å; H100-L103 WeakPolarHBondContact O-CA 3.4Å; H100-L103 WeakPolarHBondContact O-CB 3.19Å; H100-L103 PolarHBondContact O-N 2.87Å; P101-L103 VanDerWaalsContact C-N 3.3Å; P101-L103 PolarHBondContact O-N 3.01Å; L103-K105 PolarHBondContact O-N 3.11Å; L103-Q106 WeakPolarHBondContact O-CB 3.36Å; L103-Q106 PolarHBondContact O-N 3.14Å; L103-Q106 VanDerWaalsContact O-N 3.15Å; L103-I107 HydrophobicContact CD1-CD1 3.98Å; L103-I107 HydrophobicContact CD1-CG1 4.15Å; L103-I107 HydrophobicContact CG-CD1 3.84Å; L103-I107 HydrophobicContact CG-CG1 4.46Å; L103-I107 WeakPolarHBondContact O-CD1 3.48Å; L103-I107 VanDerWaalsContact O-CG1 3.26Å; L103-I107 WeakPolarHBondContact O-CG1 3.29Å; L103-I107 PolarHBondContact O-N 3.44Å
104	I	92.5	Very high	89.1	Confident	22 Å²	22	81.2 Å²	81.2	11%	0.113	38%	0.378	C	S	.	.	H	α-helix	trans	-57.1	-50.7	174.6	-60.9	174.5	0	0	0	110	F86 L88 T99 H100 P101 Q106 I107 I108 I135	F86-I104 HydrophobicContact CD1-CG1 4.16Å; F86-I104 HydrophobicContact CE1-CG1 4.22Å; F86-I104 HydrophobicContact CE1-CG2 4.21Å; L88-I104 HydrophobicContact CD2-CD1 4.05Å; T99-I104 HydrophobicContact CG2-CD1 4.3Å; T99-I104 HydrophobicContact CG2-CG1 3.72Å; H100-I104 PolarHBondContact O-N 3.31Å; P101-I104 WeakPolarHBondContact O-CB 3.25Å; P101-I104 PolarHBondContact O-N 2.74Å; I104-Q106 VanDerWaalsContact C-N 3.28Å; I104-Q106 PolarHBondContact O-N 3.47Å; I104-I107 PolarHBondContact O-N 3.11Å; I104-I108 HydrophobicContact CG2-CD1 3.83Å; I104-I108 WeakPolarHBondContact O-CG1 3.14Å; I104-I108 PolarHBondContact O-N 3.07Å; I104-I135 HydrophobicContact CD1-CD1 4.16Å; I104-I135 HydrophobicContact CG2-CD1 3.68Å; I104-I135 HydrophobicContact CG2-CG1 3.78Å
105	K	91.9	Very high	90	Very high	123 Å²	123	80.2 Å²	80.2	54%	0.535	37%	0.372	S	S	.	.	H	α-helix	trans	-57.6	-41.7	176	-69.2	176	-171.9	165.7	0	112.1	P101 E102 L103 K109	P101-K105 WeakPolarHBondContact O-CG 3.33Å; P101-K105 PolarHBondContact O-N 2.59Å; E102-K105 IonicContact OE1-NZ 3.9Å; E102-K105 PolarHBondContact OE1-NZ 3.2Å; L103-K105 PolarHBondContact O-N 3.11Å; K105-K109 WeakPolarHBondContact O-CB 3.36Å; K105-K109 PolarHBondContact O-N 2.93Å
106	Q	91.3	Very high	91	Very high	57 Å²	57	70.7 Å²	70.7	27%	0.266	34%	0.336	S	S	.	.	H	α-helix	trans	-64.4	-42.8	178.8	-174.7	177.8	24	0	0	112	H76 E102 L103 I104 K109 R110	H76-Q106 PolarHBondContact CE1-NE2 3.18Å; E102-Q106 WeakPolarHBondContact O-CB 3.38Å; E102-Q106 PolarHBondContact O-N 3.47Å; L103-Q106 WeakPolarHBondContact O-CB 3.36Å; L103-Q106 PolarHBondContact O-N 3.14Å; L103-Q106 VanDerWaalsContact O-N 3.15Å; I104-Q106 VanDerWaalsContact C-N 3.28Å; I104-Q106 PolarHBondContact O-N 3.47Å; Q106-K109 PolarHBondContact O-N 2.97Å; Q106-R110 WeakPolarHBondContact O-CB 3.32Å; Q106-R110 PolarHBondContact O-N 2.65Å
107	I	92.4	Very high	91.8	Very high	0 Å²	0	70 Å²	70	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.9	-51.9	178.7	-69.2	161.3	0	0	0	110.2	W81 F84 F86 L103 I104 K109 R110 H111 S112 L115	W81-I107 HydrophobicContact CE3-CG1 4.06Å; W81-I107 HydrophobicContact CH2-CG1 4.49Å; W81-I107 HydrophobicContact CZ3-CD1 4.02Å; W81-I107 HydrophobicContact CZ3-CG1 3.62Å; F84-I107 HydrophobicContact CD1-CD1 3.9Å; F84-I107 HydrophobicContact CD2-CD1 3.76Å; F84-I107 HydrophobicContact CE1-CD1 3.54Å; F84-I107 HydrophobicContact CE2-CD1 3.36Å; F84-I107 HydrophobicContact CE2-CG1 4.42Å; F84-I107 HydrophobicContact CG-CD1 4.02Å; F84-I107 HydrophobicContact CZ-CD1 3.26Å; F86-I107 HydrophobicContact CE1-CD1 4.17Å; F86-I107 HydrophobicContact CZ-CD1 4.5Å; F86-I107 HydrophobicContact CZ-CG2 4.05Å; L103-I107 HydrophobicContact CD1-CD1 3.98Å; L103-I107 HydrophobicContact CD1-CG1 4.15Å; L103-I107 HydrophobicContact CG-CD1 3.84Å; L103-I107 HydrophobicContact CG-CG1 4.46Å; L103-I107 WeakPolarHBondContact O-CD1 3.48Å; L103-I107 VanDerWaalsContact O-CG1 3.26Å; L103-I107 WeakPolarHBondContact O-CG1 3.29Å; L103-I107 PolarHBondContact O-N 3.44Å; I104-I107 PolarHBondContact O-N 3.11Å; I107-K109 VanDerWaalsContact C-N 3.27Å; I107-K109 PolarHBondContact O-N 3.33Å; I107-R110 PolarHBondContact O-N 2.74Å; I107-H111 CarbonylContact O-C 3.45Å; I107-H111 WeakPolarHBondContact O-CA 3.46Å; I107-H111 WeakPolarHBondContact O-CB 3.43Å; I107-H111 PolarHBondContact O-N 2.93Å; I107-S112 PolarHBondContact O-N 3.18Å; I107-S112 VanDerWaalsContact O-N 3.17Å; I107-L115 HydrophobicContact CG2-CD1 3.89Å; I107-L115 HydrophobicContact CG2-CD2 4.31Å; I107-L115 HydrophobicContact CG2-CG 4.47Å
108	I	93.2	Very high	92.6	Very high	21 Å²	21	59.2 Å²	59.2	11%	0.108	29%	0.286	C	S	.	.	H	α-helix	trans	-58.4	-43.9	180	-64.4	169.1	0	0	0	110.2	I104 S112 I135 Q138	I104-I108 HydrophobicContact CG2-CD1 3.83Å; I104-I108 WeakPolarHBondContact O-CG1 3.14Å; I104-I108 PolarHBondContact O-N 3.07Å; I108-S112 VanDerWaalsContact O-CB 3.24Å; I108-S112 WeakPolarHBondContact O-CB 3.34Å; I108-S112 PolarHBondContact O-OG 2.98Å; I108-I135 HydrophobicContact CD1-CG1 4.35Å; I108-I135 HydrophobicContact CD1-CG2 4.14Å; I108-Q138 HydrophobicContact CD1-CB 4.4Å; I108-Q138 HydrophobicContact CG2-CB 3.88Å
109	K	93.3	Very high	93	Very high	182 Å²	182	58 Å²	58	79%	0.791	27%	0.274	S	S	*	.	H	α-helix	trans	-73.7	-38.8	-176.4	-174.7	173	-178.8	174.4	0	114.2	K105 Q106 I107	K105-K109 WeakPolarHBondContact O-CB 3.36Å; K105-K109 PolarHBondContact O-N 2.93Å; Q106-K109 PolarHBondContact O-N 2.97Å; I107-K109 VanDerWaalsContact C-N 3.27Å; I107-K109 PolarHBondContact O-N 3.33Å
110	R	92.8	Very high	93.4	Very high	134 Å²	134	57 Å²	57	51%	0.506	27%	0.268	S	S	.	.	H	α-helix	trans	-106.8	-24.3	-170.6	-65.7	-168.6	174.9	-176.5	-0.6	114.4	H76 Q106 I107	H76-R110 PolarHBondContact NE2-NH1 3.05Å; Q106-R110 WeakPolarHBondContact O-CB 3.32Å; Q106-R110 PolarHBondContact O-N 2.65Å; I107-R110 PolarHBondContact O-N 2.74Å
111	H	94	Very high	93.8	Very high	3 Å²	3	53.8 Å²	53.8	1%	0.014	25%	0.253	C	S	.	.	H	α-helix	trans	-130.1	3.8	-165.5	-55.9	-53.8	0	0	0	114.2	H76 W81 I107 N113 H114 L115	H76-H111 AromaticContact ND1-CE1 3.78Å; H76-H111 AromaticContact ND1-NE2 3.54Å; W81-H111 HydrophobicContact CB-CB 3.98Å; W81-H111 AromaticContact CD1-CD2 3.99Å; W81-H111 AromaticContact CD1-CE1 3.41Å; W81-H111 VanDerWaalsContact CD1-CE1 3.41Å; W81-H111 AromaticContact CD1-CG 3.97Å; W81-H111 AromaticContact CD1-ND1 3.64Å; W81-H111 AromaticContact CD1-NE2 3.64Å; W81-H111 HydrophobicContact CD2-CB 4.47Å; W81-H111 AromaticContact CD2-CD2 3.39Å; W81-H111 AromaticContact CD2-CG 3.84Å; W81-H111 AromaticContact CD2-NE2 3.59Å; W81-H111 AromaticContact CE2-CD2 3.6Å; W81-H111 AromaticContact CE2-CE1 3.87Å; W81-H111 AromaticContact CE2-NE2 3.27Å; W81-H111 VanDerWaalsContact CE2-NE2 3.27Å; W81-H111 AromaticContact CE3-CD2 3.75Å; W81-H111 HydrophobicContact CG-CB 4.17Å; W81-H111 AromaticContact CG-CD2 3.69Å; W81-H111 AromaticContact CG-CE1 3.85Å; W81-H111 AromaticContact CG-CG 3.63Å; W81-H111 AromaticContact CG-ND1 3.75Å; W81-H111 AromaticContact CG-NE2 3.82Å; W81-H111 AromaticContact CZ2-NE2 3.74Å; W81-H111 AromaticContact NE1-CD2 3.96Å; W81-H111 AromaticContact NE1-CE1 3.45Å; W81-H111 PolarHBondContact NE1-CE1 3.01Å; W81-H111 AromaticContact NE1-NE2 3.34Å; W81-H111 PolarHBondContact NE1-NE2 2.78Å; I107-H111 CarbonylContact O-C 3.45Å; I107-H111 WeakPolarHBondContact O-CA 3.46Å; I107-H111 WeakPolarHBondContact O-CB 3.43Å; I107-H111 PolarHBondContact O-N 2.93Å; H111-N113 VanDerWaalsContact C-N 3.26Å; H111-N113 PolarHBondContact O-N 3.14Å; H111-H114 AromaticContact ND1-ND1 3.4Å; H111-H114 PolarHBondContact ND1-ND1 3.44Å; H111-H114 WeakPolarHBondContact O-CA 3.34Å; H111-H114 WeakPolarHBondContact O-CB 3.11Å; H111-H114 PolarHBondContact O-N 3.06Å; H111-L115 WeakPolarHBondContact O-CG 3.49Å; H111-L115 PolarHBondContact O-N 3.42Å; H111-L115 VanDerWaalsContact O-N 3.11Å
112	S	91.8	Very high	94.1	Very high	13 Å²	13	50 Å²	50	9%	0.091	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-42.6	179.5	42.8	0	0	0	0	112.7	I107 I108 H114 L115 C142	I107-S112 PolarHBondContact O-N 3.18Å; I107-S112 VanDerWaalsContact O-N 3.17Å; I108-S112 VanDerWaalsContact O-CB 3.24Å; I108-S112 WeakPolarHBondContact O-CB 3.34Å; I108-S112 PolarHBondContact O-OG 2.98Å; S112-H114 VanDerWaalsContact C-N 3.26Å; S112-H114 PolarHBondContact O-N 3.31Å; S112-L115 PolarHBondContact O-N 3.01Å; S112-C142 WeakPolarHBondContact O-CA 3.37Å; S112-C142 PolarHBondContact O-SG 2.86Å
113	N	93.9	Very high	94.4	Very high	97 Å²	97	45.1 Å²	45.1	52%	0.519	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.4	175.6	64.3	-30.5	0	0	0	114.8	H111 N141	H111-N113 VanDerWaalsContact C-N 3.26Å; H111-N113 PolarHBondContact O-N 3.14Å; N113-N141 WeakPolarHBondContact CA-O 3.5Å
114	H	95.1	Very high	94.6	Very high	39 Å²	39	44.6 Å²	44.6	18%	0.181	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-24.8	178.6	-52.8	145.8	0	0	0	112.4	P78 W81 R82 H111 S112 Q116	P78-H114 HydrophobicContact CB-CB 4.16Å; W81-H114 HydrophobicContact CB-CB 4.43Å; R82-H114 WeakPolarHBondContact CA-O 3.26Å; H111-H114 AromaticContact ND1-ND1 3.4Å; H111-H114 PolarHBondContact ND1-ND1 3.44Å; H111-H114 WeakPolarHBondContact O-CA 3.34Å; H111-H114 WeakPolarHBondContact O-CB 3.11Å; H111-H114 PolarHBondContact O-N 3.06Å; S112-H114 VanDerWaalsContact C-N 3.26Å; S112-H114 PolarHBondContact O-N 3.31Å; H114-Q116 PolarHBondContact O-N 3.5Å
115	L	95.6	Very high	94.7	Very high	1 Å²	1	44 Å²	44	1%	0.005	20%	0.202	C	C	.	.			trans	-62.2	131.7	-179.4	-69.2	170.5	0	0	0	111.2	W81 F84 I107 H111 S112 V118 L144	W81-L115 WeakPolarHBondContact O-CD2 3.16Å; F84-L115 HydrophobicContact CB-CD2 3.8Å; I107-L115 HydrophobicContact CG2-CD1 3.89Å; I107-L115 HydrophobicContact CG2-CD2 4.31Å; I107-L115 HydrophobicContact CG2-CG 4.47Å; H111-L115 WeakPolarHBondContact O-CG 3.49Å; H111-L115 PolarHBondContact O-N 3.42Å; H111-L115 VanDerWaalsContact O-N 3.11Å; S112-L115 PolarHBondContact O-N 3.01Å; L115-V118 HydrophobicContact CB-CG2 4.01Å; L115-V118 HydrophobicContact CD1-CG2 4.22Å; L115-V118 HydrophobicContact CD2-CG2 4.07Å; L115-V118 HydrophobicContact CG-CG2 4.33Å; L115-L144 HydrophobicContact CB-CD2 4.02Å
116	Q	96.9	Very high	94.9	Very high	44 Å²	44	41.9 Å²	41.9	21%	0.206	19%	0.193	C	C	.	.			trans	-130	-33.9	176.4	-67.1	-179.4	14.2	0	0	112	R82 H114 K145 T146	R82-Q116 PolarHBondContact O-N 3.1Å; H114-Q116 PolarHBondContact O-N 3.5Å; Q116-K145 HydrophobicContact CB-CD 4.37Å; Q116-K145 HydrophobicContact CB-CG 4.48Å; Q116-K145 PolarHBondContact O-N 2.88Å; Q116-T146 PolarHBondContact O-N 3.39Å
117	Y	97.6	Very high	95.1	Very high	95 Å²	95	44.6 Å²	44.6	37%	0.373	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	105.2	-177.1	-52.8	-88.7	0	0	0	108.2	R82 C83 F84 K145 T146	R82-Y117 PolarHBondContact O-N 2.76Å; C83-Y117 VanDerWaalsContact CA-O 3.3Å; C83-Y117 WeakPolarHBondContact CA-O 3.42Å; F84-Y117 PolarHBondContact N-O 3.12Å; Y117-K145 HydrophobicContact CE1-CB 4.11Å; Y117-K145 HydrophobicContact CE1-CD 4.39Å; Y117-K145 HydrophobicContact CE2-CD 4.49Å; Y117-T146 WeakPolarHBondContact CD1-OG1 3.31Å
118	V	97.9	Very high	95.3	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.018	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132	-175.6	176.9	0	0	0	0	110	F84 F86 L115 F120 L144 T146 L147 G148	F84-V118 WeakPolarHBondContact O-CA 3.4Å; F86-V118 HydrophobicContact CD2-CG1 3.91Å; F86-V118 HydrophobicContact CE2-CG1 3.8Å; L115-V118 HydrophobicContact CB-CG2 4.01Å; L115-V118 HydrophobicContact CD1-CG2 4.22Å; L115-V118 HydrophobicContact CD2-CG2 4.07Å; L115-V118 HydrophobicContact CG-CG2 4.33Å; V118-F120 HydrophobicContact CG1-CD2 4.01Å; V118-F120 HydrophobicContact CG1-CE2 3.43Å; V118-F120 VanDerWaalsContact CG1-CE2 3.43Å; V118-F120 HydrophobicContact CG1-CZ 4.04Å; V118-L144 HydrophobicContact CB-CD1 4.25Å; V118-L144 HydrophobicContact CB-CD2 4.32Å; V118-L144 HydrophobicContact CG2-CD1 4.33Å; V118-L144 HydrophobicContact CG2-CD2 3.62Å; V118-T146 PolarHBondContact N-O 3.39Å; V118-L147 HydrophobicContact CG1-CD1 4.48Å; V118-L147 CarbonylContact O-C 3.52Å; V118-L147 VanDerWaalsContact O-CA 3.3Å; V118-L147 WeakPolarHBondContact O-CA 3.46Å; V118-G148 PolarHBondContact O-N 3.09Å
119	S	97.9	Very high	95.5	Very high	23 Å²	23	43.6 Å²	43.6	16%	0.161	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.5	166.2	52.3	0	0	0	0	111.3	F84 E85 F86 G148	F84-S119 PolarHBondContact O-N 2.99Å; F84-S119 VanDerWaalsContact O-N 3.15Å; E85-S119 CarbonylContact C-O 3.51Å; E85-S119 WeakPolarHBondContact CA-O 3.45Å; E85-S119 VanDerWaalsContact CB-OG 3.3Å; E85-S119 WeakPolarHBondContact CB-OG 3.35Å; E85-S119 VanDerWaalsContact CD-OG 3.31Å; E85-S119 WeakPolarHBondContact CG-OG 3.24Å; E85-S119 PolarHBondContact OE2-OG 2.95Å; F86-S119 PolarHBondContact N-O 3.22Å; S119-G148 CarbonylContact C-O 3.43Å; S119-G148 WeakPolarHBondContact CA-O 3.21Å
120	F	97.9	Very high	95.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.5	171.6	-67.4	-96.4	0	0	0	107.6	F86 L88 V118 V122 A132 I135 L136 L139 L147 G148 L149 I150	F86-F120 HydrophobicContact CB-CD1 3.64Å; F86-F120 HydrophobicContact CB-CE1 3.93Å; F86-F120 HydrophobicContact CB-CG 4.33Å; F86-F120 AromaticContact CD2-CD1 3.97Å; F86-F120 HydrophobicContact CD2-CD1 3.97Å; F86-F120 AromaticContact CD2-CE1 3.53Å; F86-F120 HydrophobicContact CD2-CE1 3.53Å; F86-F120 HydrophobicContact CD2-CE2 4.22Å; F86-F120 HydrophobicContact CD2-CG 4.48Å; F86-F120 AromaticContact CD2-CZ 3.67Å; F86-F120 HydrophobicContact CD2-CZ 3.67Å; F86-F120 HydrophobicContact CE2-CE1 4.18Å; F86-F120 AromaticContact CE2-CZ 3.99Å; F86-F120 HydrophobicContact CE2-CZ 3.99Å; F86-F120 HydrophobicContact CG-CD1 4.03Å; F86-F120 AromaticContact CG-CE1 3.78Å; F86-F120 HydrophobicContact CG-CE1 3.78Å; F86-F120 HydrophobicContact CG-CZ 4.39Å; F86-F120 WeakPolarHBondContact O-CA 3.34Å; L88-F120 HydrophobicContact CD1-CD1 3.83Å; L88-F120 HydrophobicContact CD1-CE1 4.47Å; V118-F120 HydrophobicContact CG1-CD2 4.01Å; V118-F120 HydrophobicContact CG1-CE2 3.43Å; V118-F120 VanDerWaalsContact CG1-CE2 3.43Å; V118-F120 HydrophobicContact CG1-CZ 4.04Å; F120-V122 HydrophobicContact CB-CG2 4.17Å; F120-A132 HydrophobicContact CD1-CB 4.04Å; F120-I135 HydrophobicContact CE1-CB 3.85Å; F120-I135 HydrophobicContact CE1-CD1 4.02Å; F120-I135 HydrophobicContact CE1-CG2 3.67Å; F120-I135 HydrophobicContact CZ-CB 4.18Å; F120-I135 HydrophobicContact CZ-CG2 3.67Å; F120-L136 HydrophobicContact CD2-CD2 4.36Å; F120-L136 HydrophobicContact CE2-CD2 3.6Å; F120-L136 HydrophobicContact CE2-CG 4.14Å; F120-L136 HydrophobicContact CZ-CD2 3.98Å; F120-L136 HydrophobicContact CZ-CG 4.15Å; F120-L139 HydrophobicContact CZ-CD1 4.48Å; F120-L147 HydrophobicContact CD2-CD1 4.12Å; F120-L147 HydrophobicContact CE2-CD1 4Å; F120-G148 PolarHBondContact N-O 3.29Å; F120-L149 HydrophobicContact CB-CD2 3.94Å; F120-L149 HydrophobicContact CD2-CD2 3.57Å; F120-L149 HydrophobicContact CE2-CD2 4.4Å; F120-L149 HydrophobicContact CG-CD2 4.02Å; F120-I150 PolarHBondContact O-N 3.2Å
121	K	96.6	Very high	95.9	Very high	53 Å²	53	33 Å²	33	23%	0.23	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.8	167.1	-79.3	170.5	172	168.4	0	107.8	E85 F86 E87 L88 I150 T152	E85-K121 HydrophobicContact CG-CD 4.08Å; E85-K121 HydrophobicContact CG-CG 4.41Å; E85-K121 WeakPolarHBondContact OE1-CE 3.47Å; E85-K121 IonicContact OE1-NZ 3.33Å; E85-K121 PolarHBondContact OE1-NZ 3.14Å; E85-K121 VanDerWaalsContact OE2-CE 3.29Å; E85-K121 WeakPolarHBondContact OE2-CE 3.49Å; E85-K121 IonicContact OE2-NZ 2.91Å; F86-K121 PolarHBondContact O-N 3.31Å; E87-K121 WeakPolarHBondContact OE1-CD 3.37Å; E87-K121 IonicContact OE1-NZ 2.87Å; E87-K121 PolarHBondContact OE1-NZ 3.27Å; E87-K121 WeakPolarHBondContact OE2-CB 3.41Å; E87-K121 WeakPolarHBondContact OE2-CD 3.49Å; L88-K121 PolarHBondContact N-O 2.98Å; K121-I150 WeakPolarHBondContact CA-O 3.42Å; K121-I150 HydrophobicContact CG-CB 4.25Å; K121-I150 HydrophobicContact CG-CD1 4.34Å; K121-I150 HydrophobicContact CG-CG2 4.43Å; K121-T152 HydrophobicContact CB-CG2 3.77Å; K121-T152 HydrophobicContact CG-CG2 4.13Å
122	V	96.3	Very high	96.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128	-172.6	-172.8	0	0	0	0	108.7	L88 F120 A129 A132 I150 S151 T152 S156 F157	L88-V122 HydrophobicContact CB-CG2 4.44Å; L88-V122 HydrophobicContact CD1-CG2 4.38Å; L88-V122 WeakPolarHBondContact O-CA 3.39Å; F120-V122 HydrophobicContact CB-CG2 4.17Å; V122-A129 HydrophobicContact CG1-CB 4.13Å; V122-A132 HydrophobicContact CG2-CB 4.06Å; V122-I150 PolarHBondContact N-O 3.22Å; V122-S151 WeakPolarHBondContact O-CA 3.42Å; V122-T152 PolarHBondContact O-N 3.46Å; V122-T152 PolarHBondContact O-OG1 2.99Å; V122-S156 WeakPolarHBondContact CG1-OG 3.39Å; V122-F157 HydrophobicContact CB-CE2 4.11Å; V122-F157 HydrophobicContact CB-CZ 4.15Å; V122-F157 HydrophobicContact CG2-CE1 4.38Å; V122-F157 HydrophobicContact CG2-CE2 3.87Å; V122-F157 HydrophobicContact CG2-CZ 3.5Å; V122-F157 VanDerWaalsContact CG2-CZ 3.5Å
123	D	94.1	Very high	96.4	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	16%	0.16	C	C	.	.			trans	-76.5	-166.7	176.9	75.4	5	0	0	0	113.3	L88 N89 Q90 T93 S125 S128 T152 S156	L88-D123 PolarHBondContact O-N 2.85Å; N89-D123 WeakPolarHBondContact CA-OD2 3.39Å; Q90-D123 PolarHBondContact N-OD2 3.39Å; T93-D123 WeakPolarHBondContact CB-OD2 3.39Å; T93-D123 VanDerWaalsContact OG1-CG 3.27Å; T93-D123 PolarHBondContact OG1-OD2 3.02Å; D123-S125 PolarHBondContact O-N 2.99Å; D123-S125 WeakPolarHBondContact OD1-CB 3.45Å; D123-S125 PolarHBondContact OD1-N 3.32Å; D123-S125 PolarHBondContact OD1-OG 2.94Å; D123-S128 WeakPolarHBondContact OD1-CB 3.35Å; D123-S128 PolarHBondContact OD1-OG 3.29Å; D123-T152 WeakPolarHBondContact CA-OG1 3.5Å; D123-S156 WeakPolarHBondContact O-CB 3.4Å; D123-S156 PolarHBondContact O-OG 3.13Å
124	S	93.8	Very high	96.6	Very high	26 Å²	26	31.9 Å²	31.9	18%	0.182	16%	0.158	C	C	.	.	S	Bend	trans	-76	2.1	-177.3	-55.8	0	0	0	0	114.7	A153 R154	S124-A153 WeakPolarHBondContact OG-CB 3.37Å; S124-R154 WeakPolarHBondContact OG-CB 3.44Å; S124-R154 PolarHBondContact OG-N 2.87Å
125	S	95.3	Very high	96.7	Very high	8 Å²	8	30.4 Å²	30.4	6%	0.056	15%	0.152	C	C	.	.			trans	-92	136.6	-177.1	65.8	0	0	0	0	111.9	Q90 D123 E127 S128 A129 S156	Q90-S125 VanDerWaalsContact CG-OG 3.24Å; Q90-S125 WeakPolarHBondContact CG-OG 3.44Å; D123-S125 PolarHBondContact O-N 2.99Å; D123-S125 WeakPolarHBondContact OD1-CB 3.45Å; D123-S125 PolarHBondContact OD1-N 3.32Å; D123-S125 PolarHBondContact OD1-OG 2.94Å; S125-E127 PolarHBondContact O-N 2.97Å; S125-S128 PolarHBondContact O-N 2.66Å; S125-S128 VanDerWaalsContact OG-CB 3.24Å; S125-S128 WeakPolarHBondContact OG-CB 3.47Å; S125-S128 PolarHBondContact OG-N 2.97Å; S125-S128 PolarHBondContact OG-OG 2.92Å; S125-A129 PolarHBondContact O-N 3.44Å; S125-S156 WeakPolarHBondContact O-CB 3.34Å
126	K	95.6	Very high	96.8	Very high	80 Å²	80	30.4 Å²	30.4	35%	0.348	15%	0.152	S	C	.	.	H	α-helix	trans	-61.2	-37.4	176.4	-170.9	-171.2	177.9	-136.1	0	111.1	S128 A129 E130 D159 L160	K126-S128 VanDerWaalsContact C-N 3.27Å; K126-S128 PolarHBondContact O-N 3.13Å; K126-A129 PolarHBondContact O-N 3.1Å; K126-A129 VanDerWaalsContact O-N 3.14Å; K126-E130 WeakPolarHBondContact CE-OE1 3.43Å; K126-E130 HydrophobicContact CG-CG 4.48Å; K126-E130 IonicContact NZ-OE1 2.74Å; K126-E130 PolarHBondContact NZ-OE1 3.45Å; K126-E130 WeakPolarHBondContact O-CG 3.26Å; K126-E130 PolarHBondContact O-N 3.26Å; K126-D159 HydrophobicContact CB-CB 4.45Å; K126-D159 VanDerWaalsContact CE-O 3.31Å; K126-D159 WeakPolarHBondContact CE-O 3.29Å; K126-D159 HydrophobicContact CG-CB 4.15Å; K126-L160 HydrophobicContact CG-CD2 3.77Å
127	E	95.6	Very high	96.8	Very high	113 Å²	113	30.5 Å²	30.5	53%	0.528	16%	0.157	S	C	.	.	H	α-helix	trans	-61	-36	178.5	-63.1	76.4	-170.2	0	0	112	S125 E130 A131	S125-E127 PolarHBondContact O-N 2.97Å; E127-E130 PolarHBondContact O-N 3.32Å; E127-A131 WeakPolarHBondContact O-CB 3.48Å; E127-A131 PolarHBondContact O-N 2.88Å
128	S	95.9	Very high	96.7	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.007	16%	0.163	C	C	.	.	H	α-helix	trans	-71.2	-36.7	176.2	-63.3	0	0	0	0	111.9	L88 D123 S125 K126 A131 A132	L88-S128 VanDerWaalsContact O-CB 3.29Å; L88-S128 WeakPolarHBondContact O-CB 3.26Å; L88-S128 PolarHBondContact O-OG 3.08Å; D123-S128 WeakPolarHBondContact OD1-CB 3.35Å; D123-S128 PolarHBondContact OD1-OG 3.29Å; S125-S128 PolarHBondContact O-N 2.66Å; S125-S128 VanDerWaalsContact OG-CB 3.24Å; S125-S128 WeakPolarHBondContact OG-CB 3.47Å; S125-S128 PolarHBondContact OG-N 2.97Å; S125-S128 PolarHBondContact OG-OG 2.92Å; K126-S128 VanDerWaalsContact C-N 3.27Å; K126-S128 PolarHBondContact O-N 3.13Å; S128-A131 PolarHBondContact O-N 3Å; S128-A132 PolarHBondContact O-N 3.36Å
129	A	97.3	Very high	96.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67.8	-39.9	173.1	0	0	0	0	0	111.9	V122 S125 K126 A132 C133 F157 L160	V122-A129 HydrophobicContact CG1-CB 4.13Å; S125-A129 PolarHBondContact O-N 3.44Å; K126-A129 PolarHBondContact O-N 3.1Å; K126-A129 VanDerWaalsContact O-N 3.14Å; A129-A132 WeakPolarHBondContact O-CB 3.41Å; A129-A132 PolarHBondContact O-N 2.86Å; A129-C133 PolarHBondContact O-N 2.87Å; A129-C133 VanDerWaalsContact O-N 3.08Å; A129-F157 HydrophobicContact CB-CD1 3.92Å; A129-F157 HydrophobicContact CB-CE1 4.24Å; A129-F157 HydrophobicContact CB-CG 4.46Å; A129-L160 HydrophobicContact CB-CD1 3.84Å; A129-L160 HydrophobicContact CB-CD2 4.06Å; A129-L160 HydrophobicContact CB-CG 3.98Å
130	E	97.7	Very high	96.3	Very high	61 Å²	61	33.1 Å²	33.1	29%	0.285	18%	0.175	S	C	.	.	H	α-helix	trans	-60.5	-46	172.4	-71.7	176.9	173.1	0	0	110.8	K126 E127 A132 C133 D134 L160	K126-E130 WeakPolarHBondContact CE-OE1 3.43Å; K126-E130 HydrophobicContact CG-CG 4.48Å; K126-E130 IonicContact NZ-OE1 2.74Å; K126-E130 PolarHBondContact NZ-OE1 3.45Å; K126-E130 WeakPolarHBondContact O-CG 3.26Å; K126-E130 PolarHBondContact O-N 3.26Å; E127-E130 PolarHBondContact O-N 3.32Å; E130-A132 VanDerWaalsContact C-N 3.28Å; E130-A132 PolarHBondContact O-N 2.96Å; E130-C133 WeakPolarHBondContact O-CB 3.36Å; E130-C133 PolarHBondContact O-N 2.84Å; E130-C133 VanDerWaalsContact O-N 3.11Å; E130-D134 PolarHBondContact O-N 2.84Å; E130-L160 HydrophobicContact CB-CD2 4.48Å; E130-L160 HydrophobicContact CG-CD2 3.43Å; E130-L160 VanDerWaalsContact CG-CD2 3.43Å
131	A	97.1	Very high	96	Very high	32 Å²	32	38.8 Å²	38.8	26%	0.264	21%	0.205	S	C	.	.	H	α-helix	trans	-60.5	-36.2	175.9	0	0	0	0	0	112.8	L88 E127 S128 D134 I135	L88-A131 HydrophobicContact CD1-CB 4.42Å; E127-A131 WeakPolarHBondContact O-CB 3.48Å; E127-A131 PolarHBondContact O-N 2.88Å; S128-A131 PolarHBondContact O-N 3Å; A131-D134 PolarHBondContact O-N 3.17Å; A131-I135 WeakPolarHBondContact O-CD1 3.32Å; A131-I135 VanDerWaalsContact O-CG1 3.25Å; A131-I135 WeakPolarHBondContact O-CG1 2.95Å; A131-I135 PolarHBondContact O-N 3.05Å; A131-I135 VanDerWaalsContact O-N 3.09Å
132	A	97.9	Very high	95.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63	-46.5	173.9	0	0	0	0	0	111.1	L88 F120 V122 S128 A129 E130 D134 I135 L136 F157	L88-A132 HydrophobicContact CD1-CB 3.59Å; F120-A132 HydrophobicContact CD1-CB 4.04Å; V122-A132 HydrophobicContact CG2-CB 4.06Å; S128-A132 PolarHBondContact O-N 3.36Å; A129-A132 WeakPolarHBondContact O-CB 3.41Å; A129-A132 PolarHBondContact O-N 2.86Å; E130-A132 VanDerWaalsContact C-N 3.28Å; E130-A132 PolarHBondContact O-N 2.96Å; A132-D134 VanDerWaalsContact C-N 3.35Å; A132-D134 PolarHBondContact O-N 3.11Å; A132-I135 PolarHBondContact O-N 3.13Å; A132-L136 WeakPolarHBondContact O-CB 3.32Å; A132-L136 VanDerWaalsContact O-CG 3.3Å; A132-L136 WeakPolarHBondContact O-CG 3.43Å; A132-L136 PolarHBondContact O-N 2.97Å; A132-F157 HydrophobicContact CB-CE1 3.83Å; A132-F157 HydrophobicContact CB-CZ 4.04Å
133	C	98.1	Very high	95.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-39.6	176.2	-72	0	0	0	0	112.6	A129 E130 I135 L136 S137 L160 A168	A129-C133 PolarHBondContact O-N 2.87Å; A129-C133 VanDerWaalsContact O-N 3.08Å; E130-C133 WeakPolarHBondContact O-CB 3.36Å; E130-C133 PolarHBondContact O-N 2.84Å; E130-C133 VanDerWaalsContact O-N 3.11Å; C133-I135 VanDerWaalsContact C-N 3.31Å; C133-I135 PolarHBondContact O-N 2.82Å; C133-L136 PolarHBondContact O-N 2.85Å; C133-S137 WeakPolarHBondContact O-CB 3.45Å; C133-S137 PolarHBondContact O-N 2.76Å; C133-S137 PolarHBondContact O-OG 2.91Å; C133-L160 VanDerWaalsContact SG-CD1 3.52Å; C133-A168 HydrophobicContact CB-CB 3.79Å; C133-A168 WeakPolarHBondContact O-CB 3.38Å
134	D	97.5	Very high	95.7	Very high	89 Å²	89	39.2 Å²	39.2	48%	0.476	22%	0.215	S	C	.	.	H	α-helix	trans	-62	-39.4	175.7	-74.2	-19.6	0	0	0	111.9	E130 A131 A132 Q138	E130-D134 PolarHBondContact O-N 2.84Å; A131-D134 PolarHBondContact O-N 3.17Å; A132-D134 VanDerWaalsContact C-N 3.35Å; A132-D134 PolarHBondContact O-N 3.11Å; D134-Q138 WeakPolarHBondContact O-CG 3.43Å; D134-Q138 PolarHBondContact O-NE2 3.42Å
135	I	97.5	Very high	96	Very high	9 Å²	9	41.4 Å²	41.4	5%	0.046	22%	0.221	C	C	.	.	H	α-helix	trans	-70.5	-49.1	176.3	-64.3	162.9	0	0	0	110.1	F86 L88 I104 I108 F120 A131 A132 C133 S137 Q138 L139	F86-I135 HydrophobicContact CD1-CD1 4.23Å; F86-I135 HydrophobicContact CE1-CG2 4.46Å; F86-I135 HydrophobicContact CE2-CG2 4.4Å; F86-I135 HydrophobicContact CZ-CG2 4.21Å; L88-I135 HydrophobicContact CD1-CD1 4.19Å; L88-I135 HydrophobicContact CD2-CD1 4.11Å; I104-I135 HydrophobicContact CD1-CD1 4.16Å; I104-I135 HydrophobicContact CG2-CD1 3.68Å; I104-I135 HydrophobicContact CG2-CG1 3.78Å; I108-I135 HydrophobicContact CD1-CG1 4.35Å; I108-I135 HydrophobicContact CD1-CG2 4.14Å; F120-I135 HydrophobicContact CE1-CB 3.85Å; F120-I135 HydrophobicContact CE1-CD1 4.02Å; F120-I135 HydrophobicContact CE1-CG2 3.67Å; F120-I135 HydrophobicContact CZ-CB 4.18Å; F120-I135 HydrophobicContact CZ-CG2 3.67Å; A131-I135 WeakPolarHBondContact O-CD1 3.32Å; A131-I135 VanDerWaalsContact O-CG1 3.25Å; A131-I135 WeakPolarHBondContact O-CG1 2.95Å; A131-I135 PolarHBondContact O-N 3.05Å; A131-I135 VanDerWaalsContact O-N 3.09Å; A132-I135 PolarHBondContact O-N 3.13Å; C133-I135 VanDerWaalsContact C-N 3.31Å; C133-I135 PolarHBondContact O-N 2.82Å; I135-S137 PolarHBondContact O-N 2.67Å; I135-Q138 WeakPolarHBondContact O-CB 3.37Å; I135-Q138 PolarHBondContact O-N 3.09Å; I135-L139 HydrophobicContact CG2-CD2 4.35Å; I135-L139 WeakPolarHBondContact O-CG 3.46Å; I135-L139 PolarHBondContact O-N 3.49Å
136	L	97.3	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-53.9	-42.3	178.4	-75	172.2	0	0	0	111.7	F120 A132 C133 Q138 L139 L147 L149 A168 V172	F120-L136 HydrophobicContact CD2-CD2 4.36Å; F120-L136 HydrophobicContact CE2-CD2 3.6Å; F120-L136 HydrophobicContact CE2-CG 4.14Å; F120-L136 HydrophobicContact CZ-CD2 3.98Å; F120-L136 HydrophobicContact CZ-CG 4.15Å; A132-L136 WeakPolarHBondContact O-CB 3.32Å; A132-L136 VanDerWaalsContact O-CG 3.3Å; A132-L136 WeakPolarHBondContact O-CG 3.43Å; A132-L136 PolarHBondContact O-N 2.97Å; C133-L136 PolarHBondContact O-N 2.85Å; L136-Q138 PolarHBondContact O-N 3.09Å; L136-Q138 VanDerWaalsContact O-N 3.13Å; L136-L139 HydrophobicContact CD2-CD1 4.1Å; L136-L139 WeakPolarHBondContact O-CB 3.4Å; L136-L139 PolarHBondContact O-N 2.9Å; L136-L147 HydrophobicContact CD2-CD1 4.05Å; L136-L147 HydrophobicContact CD2-CD2 4.34Å; L136-L149 HydrophobicContact CD1-CD1 4.4Å; L136-L149 HydrophobicContact CD1-CD2 4.16Å; L136-A168 HydrophobicContact CB-CB 4.07Å; L136-V172 HydrophobicContact CD2-CG2 3.83Å
137	S	97.3	Very high	96.2	Very high	46 Å²	46	38.8 Å²	38.8	32%	0.322	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.5	178.5	-60.6	0	0	0	0	113.7	C133 I135 A168	C133-S137 WeakPolarHBondContact O-CB 3.45Å; C133-S137 PolarHBondContact O-N 2.76Å; C133-S137 PolarHBondContact O-OG 2.91Å; I135-S137 PolarHBondContact O-N 2.67Å; S137-A168 WeakPolarHBondContact OG-CB 3.47Å
138	Q	96.3	Very high	96.4	Very high	104 Å²	104	33.6 Å²	33.6	49%	0.486	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-5.3	178	-67.2	172.5	72.4	0	0	113.4	I108 D134 I135 L136 V140	I108-Q138 HydrophobicContact CD1-CB 4.4Å; I108-Q138 HydrophobicContact CG2-CB 3.88Å; D134-Q138 WeakPolarHBondContact O-CG 3.43Å; D134-Q138 PolarHBondContact O-NE2 3.42Å; I135-Q138 WeakPolarHBondContact O-CB 3.37Å; I135-Q138 PolarHBondContact O-N 3.09Å; L136-Q138 PolarHBondContact O-N 3.09Å; L136-Q138 VanDerWaalsContact O-N 3.13Å; Q138-V140 PolarHBondContact O-N 2.85Å
139	L	93.3	Very high	96.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-80.5	29.2	-176.4	-57.6	-172	0	0	0	114	F120 I135 L136 N141 C142 L144 V172	F120-L139 HydrophobicContact CZ-CD1 4.48Å; I135-L139 HydrophobicContact CG2-CD2 4.35Å; I135-L139 WeakPolarHBondContact O-CG 3.46Å; I135-L139 PolarHBondContact O-N 3.49Å; L136-L139 HydrophobicContact CD2-CD1 4.1Å; L136-L139 WeakPolarHBondContact O-CB 3.4Å; L136-L139 PolarHBondContact O-N 2.9Å; L139-N141 PolarHBondContact O-N 3.44Å; L139-C142 HydrophobicContact CB-CB 4.14Å; L139-C142 WeakPolarHBondContact O-CB 3.47Å; L139-C142 PolarHBondContact O-N 3.44Å; L139-C142 VanDerWaalsContact O-N 3.08Å; L139-L144 HydrophobicContact CD1-CD1 4.27Å; L139-V172 HydrophobicContact CD1-CG2 4.37Å
140	V	94.2	Very high	96.5	Very high	73 Å²	73	36.7 Å²	36.7	44%	0.442	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-60.2	-33.8	-177	-175.8	0	0	0	0	112.4	Q138 C142 V171 N175	Q138-V140 PolarHBondContact O-N 2.85Å; V140-C142 VanDerWaalsContact C-N 3.35Å; V140-V171 HydrophobicContact CG2-CG1 3.83Å; V140-N175 WeakPolarHBondContact O-CB 3.34Å
141	N	90.4	Very high	96.3	Very high	118 Å²	118	34.9 Å²	34.9	63%	0.631	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-92.3	7.7	-179	-61.7	-39.7	0	0	0	113.5	N113 L139	N113-N141 WeakPolarHBondContact CA-O 3.5Å; L139-N141 PolarHBondContact O-N 3.44Å
142	C	91.1	Very high	96	Very high	4 Å²	4	36.4 Å²	36.4	3%	0.027	21%	0.205	C	C	.	.			trans	-88	144.1	-178.4	-59	0	0	0	0	111.2	S112 L139 V140 L144 S176	S112-C142 WeakPolarHBondContact O-CA 3.37Å; S112-C142 PolarHBondContact O-SG 2.86Å; L139-C142 HydrophobicContact CB-CB 4.14Å; L139-C142 WeakPolarHBondContact O-CB 3.47Å; L139-C142 PolarHBondContact O-N 3.44Å; L139-C142 VanDerWaalsContact O-N 3.08Å; V140-C142 VanDerWaalsContact C-N 3.35Å; C142-L144 HydrophobicContact CB-CD2 3.93Å; C142-L144 HydrophobicContact CB-CG 3.98Å; C142-S176 PolarHBondContact O-OG 3.05Å
143	S	94.1	Very high	95.5	Very high	60 Å²	60	39.5 Å²	39.5	42%	0.42	23%	0.23	S	C	.	.			trans	-116.4	72.1	169.2	-161.3	0	0	0	0	108.8	S178	S143-S178 PolarHBondContact OG-OG 2.81Å
144	L	97.3	Very high	95.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.			trans	-68.5	141.2	-175.1	-58.3	-173.2	0	0	0	110.8	L115 V118 L139 C142 L147 V172 S176 S178 L179	L115-L144 HydrophobicContact CB-CD2 4.02Å; V118-L144 HydrophobicContact CB-CD1 4.25Å; V118-L144 HydrophobicContact CB-CD2 4.32Å; V118-L144 HydrophobicContact CG2-CD1 4.33Å; V118-L144 HydrophobicContact CG2-CD2 3.62Å; L139-L144 HydrophobicContact CD1-CD1 4.27Å; C142-L144 HydrophobicContact CB-CD2 3.93Å; C142-L144 HydrophobicContact CB-CG 3.98Å; L144-L147 HydrophobicContact CD1-CD1 4.39Å; L144-V172 HydrophobicContact CD1-CG1 3.9Å; L144-V172 HydrophobicContact CD1-CG2 4.42Å; L144-S176 WeakPolarHBondContact CB-OG 3.33Å; L144-S176 PolarHBondContact N-OG 3.3Å; L144-S178 CarbonylContact O-C 3.57Å; L144-S178 VanDerWaalsContact O-C 3.29Å; L144-S178 PolarHBondContact O-OG 2.96Å; L144-L179 HydrophobicContact CB-CD1 4.32Å; L144-L179 WeakPolarHBondContact O-CA 3.31Å; L144-L179 PolarHBondContact O-N 3.4Å
145	K	98.2	Very high	95	Very high	72 Å²	72	46.7 Å²	46.7	31%	0.313	26%	0.257	S	S	.	.	S	Bend	trans	-100.1	-31.7	167.7	-67.8	177.5	179.2	164.6	0	111.3	Q116 Y117 S178 S180 S181	Q116-K145 HydrophobicContact CB-CD 4.37Å; Q116-K145 HydrophobicContact CB-CG 4.48Å; Q116-K145 PolarHBondContact O-N 2.88Å; Y117-K145 HydrophobicContact CE1-CB 4.11Å; Y117-K145 HydrophobicContact CE1-CD 4.39Å; Y117-K145 HydrophobicContact CE2-CD 4.49Å; K145-S178 WeakPolarHBondContact CA-O 3.47Å; K145-S180 WeakPolarHBondContact O-CA 3.41Å; K145-S180 PolarHBondContact O-N 2.84Å; K145-S180 PolarHBondContact O-OG 3.07Å; K145-S181 PolarHBondContact O-N 3.04Å
146	T	98.4	Very high	94.9	Very high	33 Å²	33	46.3 Å²	46.3	20%	0.202	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.3	177.9	-59.6	0	0	0	0	110	Q116 Y117 V118 S181	Q116-T146 PolarHBondContact O-N 3.39Å; Y117-T146 WeakPolarHBondContact CD1-OG1 3.31Å; V118-T146 PolarHBondContact N-O 3.39Å; T146-S181 VanDerWaalsContact CA-O 3.31Å; T146-S181 WeakPolarHBondContact CA-O 3.21Å
147	L	98.6	Very high	94.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.8	166	177.2	64.8	0	0	0	109.1	V118 F120 L136 L144 L149 L169 V172 L179 S181 L182 K183	V118-L147 HydrophobicContact CG1-CD1 4.48Å; V118-L147 CarbonylContact O-C 3.52Å; V118-L147 VanDerWaalsContact O-CA 3.3Å; V118-L147 WeakPolarHBondContact O-CA 3.46Å; F120-L147 HydrophobicContact CD2-CD1 4.12Å; F120-L147 HydrophobicContact CE2-CD1 4Å; L136-L147 HydrophobicContact CD2-CD1 4.05Å; L136-L147 HydrophobicContact CD2-CD2 4.34Å; L144-L147 HydrophobicContact CD1-CD1 4.39Å; L147-L149 HydrophobicContact CD1-CD2 4.14Å; L147-L149 HydrophobicContact CG-CD2 4.48Å; L147-L169 HydrophobicContact CD2-CD1 3.68Å; L147-V172 HydrophobicContact CD2-CB 4.29Å; L147-V172 HydrophobicContact CD2-CG1 3.99Å; L147-V172 HydrophobicContact CD2-CG2 4.29Å; L147-L179 HydrophobicContact CB-CD1 4.17Å; L147-S181 PolarHBondContact N-O 2.85Å; L147-L182 HydrophobicContact CB-CD1 3.92Å; L147-L182 HydrophobicContact CD2-CD1 3.89Å; L147-L182 HydrophobicContact CG-CD1 4.11Å; L147-L182 WeakPolarHBondContact O-CA 3.29Å; L147-K183 PolarHBondContact O-N 3.2Å
148	G	98.6	Very high	94.8	Very high	4 Å²	4	47 Å²	47	4%	0.041	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.9	169.8	0	0	0	0	0	111.8	V118 S119 F120 K183	V118-G148 PolarHBondContact O-N 3.09Å; S119-G148 CarbonylContact C-O 3.43Å; S119-G148 WeakPolarHBondContact CA-O 3.21Å; F120-G148 PolarHBondContact N-O 3.29Å; G148-K183 CarbonylContact C-O 3.53Å; G148-K183 WeakPolarHBondContact CA-O 3.44Å
149	L	98.2	Very high	94.8	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.5	168.7	-54.1	-176.4	0	0	0	106.7	F120 L136 L147 F157 F165 L169 K183 I184 T187	F120-L149 HydrophobicContact CB-CD2 3.94Å; F120-L149 HydrophobicContact CD2-CD2 3.57Å; F120-L149 HydrophobicContact CE2-CD2 4.4Å; F120-L149 HydrophobicContact CG-CD2 4.02Å; L136-L149 HydrophobicContact CD1-CD1 4.4Å; L136-L149 HydrophobicContact CD1-CD2 4.16Å; L147-L149 HydrophobicContact CD1-CD2 4.14Å; L147-L149 HydrophobicContact CG-CD2 4.48Å; L149-F157 HydrophobicContact CB-CE2 3.94Å; L149-F157 HydrophobicContact CB-CZ 4.12Å; L149-F157 HydrophobicContact CD1-CZ 4.49Å; L149-F157 HydrophobicContact CD2-CZ 4.41Å; L149-F165 HydrophobicContact CD1-CE2 3.72Å; L149-F165 HydrophobicContact CD1-CZ 3.63Å; L149-L169 HydrophobicContact CD1-CD1 4.36Å; L149-K183 PolarHBondContact N-O 3.22Å; L149-I184 HydrophobicContact CD1-CG2 4.12Å; L149-I184 HydrophobicContact CG-CG2 4.3Å; L149-T187 HydrophobicContact CB-CG2 4.48Å; L149-T187 HydrophobicContact CD1-CG2 4.37Å
150	I	96.9	Very high	95	Very high	64 Å²	64	46.9 Å²	46.9	33%	0.328	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	111	-169.6	-56.1	168.3	0	0	0	107.6	F120 K121 V122 T152	F120-I150 PolarHBondContact O-N 3.2Å; K121-I150 WeakPolarHBondContact CA-O 3.42Å; K121-I150 HydrophobicContact CG-CB 4.25Å; K121-I150 HydrophobicContact CG-CD1 4.34Å; K121-I150 HydrophobicContact CG-CG2 4.43Å; V122-I150 PolarHBondContact N-O 3.22Å; I150-T152 PolarHBondContact O-N 3.34Å
151	S	94.3	Very high	95.1	Very high	22 Å²	22	46.9 Å²	46.9	15%	0.154	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	118.7	167.3	-66.4	0	0	0	0	109.3	V122 A153	V122-S151 WeakPolarHBondContact O-CA 3.42Å; S151-A153 VanDerWaalsContact C-N 3.32Å
152	T	90.5	Very high	95.4	Very high	65 Å²	65	45.3 Å²	45.3	40%	0.399	25%	0.246	S	C	.	.	S	Bend	trans	-82.2	-13.7	-176.5	65.7	0	0	0	0	113.1	K121 V122 D123 I150	K121-T152 HydrophobicContact CB-CG2 3.77Å; K121-T152 HydrophobicContact CG-CG2 4.13Å; V122-T152 PolarHBondContact O-N 3.46Å; V122-T152 PolarHBondContact O-OG1 2.99Å; D123-T152 WeakPolarHBondContact CA-OG1 3.5Å; I150-T152 PolarHBondContact O-N 3.34Å
153	A	87.9	Confident	95.7	Very high	64 Å²	64	49.5 Å²	49.5	53%	0.529	28%	0.275	S	S	.	.	S	Bend	trans	-149.9	-114.4	-179.8	0	0	0	0	0	109.2	S124 S151	S124-A153 WeakPolarHBondContact OG-CB 3.37Å; S151-A153 VanDerWaalsContact C-N 3.32Å
154	R	90.2	Very high	95.8	Very high	189 Å²	189	49.3 Å²	49.3	71%	0.713	27%	0.267	S	S	*	.	S	Bend	trans	-69.1	146	174.1	-59.6	-174.1	-156.8	161.2	6.5	111	S124 S156	S124-R154 WeakPolarHBondContact OG-CB 3.44Å; S124-R154 PolarHBondContact OG-N 2.87Å; R154-S156 VanDerWaalsContact C-N 3.31Å; R154-S156 PolarHBondContact O-N 3.11Å
155	P	93.5	Very high	95.9	Very high	52 Å²	52	49.3 Å²	49.3	34%	0.338	27%	0.267	S	S	.	.			trans	-78	75	-176	33.7	-37.9	0	0	0	112.6	F157 M158 D186	P155-F157 PolarHBondContact O-N 3.22Å; P155-F157 VanDerWaalsContact O-N 3.13Å; P155-M158 HydrophobicContact CB-CG 4.28Å; P155-M158 WeakPolarHBondContact O-CB 3.47Å; P155-M158 PolarHBondContact O-N 2.74Å; P155-D186 HydrophobicContact CB-CB 3.53Å
156	S	95.9	Very high	95.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-62.1	-18.5	-175.6	53.1	0	0	0	0	114.8	V122 D123 S125 R154 M158 D159	V122-S156 WeakPolarHBondContact CG1-OG 3.39Å; D123-S156 WeakPolarHBondContact O-CB 3.4Å; D123-S156 PolarHBondContact O-OG 3.13Å; S125-S156 WeakPolarHBondContact O-CB 3.34Å; R154-S156 VanDerWaalsContact C-N 3.31Å; R154-S156 PolarHBondContact O-N 3.11Å; S156-M158 PolarHBondContact O-N 2.91Å; S156-D159 WeakPolarHBondContact O-CB 3.42Å; S156-D159 PolarHBondContact O-N 3.16Å; S156-D159 VanDerWaalsContact O-N 3.11Å
157	F	97.1	Very high	95.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-62	-28.6	171.1	-70.7	-65.1	0	0	0	112.9	V122 A129 A132 L149 P155 D159 L160 F165 T187	V122-F157 HydrophobicContact CB-CE2 4.11Å; V122-F157 HydrophobicContact CB-CZ 4.15Å; V122-F157 HydrophobicContact CG2-CE1 4.38Å; V122-F157 HydrophobicContact CG2-CE2 3.87Å; V122-F157 HydrophobicContact CG2-CZ 3.5Å; V122-F157 VanDerWaalsContact CG2-CZ 3.5Å; A129-F157 HydrophobicContact CB-CD1 3.92Å; A129-F157 HydrophobicContact CB-CE1 4.24Å; A129-F157 HydrophobicContact CB-CG 4.46Å; A132-F157 HydrophobicContact CB-CE1 3.83Å; A132-F157 HydrophobicContact CB-CZ 4.04Å; L149-F157 HydrophobicContact CB-CE2 3.94Å; L149-F157 HydrophobicContact CB-CZ 4.12Å; L149-F157 HydrophobicContact CD1-CZ 4.49Å; L149-F157 HydrophobicContact CD2-CZ 4.41Å; P155-F157 PolarHBondContact O-N 3.22Å; P155-F157 VanDerWaalsContact O-N 3.13Å; F157-D159 VanDerWaalsContact C-N 3.27Å; F157-D159 PolarHBondContact O-N 2.6Å; F157-L160 HydrophobicContact CD1-CD1 4.26Å; F157-L160 WeakPolarHBondContact O-CB 3.48Å; F157-L160 PolarHBondContact O-N 3.07Å; F157-F165 HydrophobicContact CB-CD2 4.41Å; F157-F165 HydrophobicContact CB-CE2 4.29Å; F157-F165 AromaticContact CD1-CD2 3.72Å; F157-F165 HydrophobicContact CD1-CD2 3.72Å; F157-F165 AromaticContact CD1-CE2 3.55Å; F157-F165 HydrophobicContact CD1-CE2 3.55Å; F157-F165 HydrophobicContact CE1-CD2 4.36Å; F157-F165 AromaticContact CE1-CE2 3.99Å; F157-F165 HydrophobicContact CE1-CE2 3.99Å; F157-F165 HydrophobicContact CG-CD2 4.36Å; F157-F165 HydrophobicContact CG-CE2 4Å; F157-T187 HydrophobicContact CB-CG2 4.39Å; F157-T187 HydrophobicContact CD2-CG2 4.22Å; F157-T187 HydrophobicContact CG-CG2 4.4Å
158	M	96.1	Very high	95.9	Very high	60 Å²	60	48.5 Å²	48.5	30%	0.296	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-72.5	-20.2	175.8	-62.9	-62.1	-165.7	0	0	113	P155 S156 L160 D186 T187 P188 S212 P214	P155-M158 HydrophobicContact CB-CG 4.28Å; P155-M158 WeakPolarHBondContact O-CB 3.47Å; P155-M158 PolarHBondContact O-N 2.74Å; S156-M158 PolarHBondContact O-N 2.91Å; M158-L160 PolarHBondContact O-N 3.04Å; M158-D186 VanDerWaalsContact CE-C 3.41Å; M158-T187 VanDerWaalsContact CE-C 3.5Å; M158-T187 WeakPolarHBondContact CE-O 3.04Å; M158-T187 VanDerWaalsContact SD-C 3.6Å; M158-P188 HydrophobicContact SD-CB 3.99Å; M158-S212 WeakPolarHBondContact CE-O 3.34Å; M158-P214 HydrophobicContact CE-CG 3.89Å; M158-P214 HydrophobicContact SD-CG 4.27Å
159	D	95.9	Very high	95.8	Very high	94 Å²	94	48.4 Å²	48.4	50%	0.503	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-78.8	-9.4	176.6	-59.7	-37.6	0	0	0	112.1	K126 S156 F157	K126-D159 HydrophobicContact CB-CB 4.45Å; K126-D159 VanDerWaalsContact CE-O 3.31Å; K126-D159 WeakPolarHBondContact CE-O 3.29Å; K126-D159 HydrophobicContact CG-CB 4.15Å; S156-D159 WeakPolarHBondContact O-CB 3.42Å; S156-D159 PolarHBondContact O-N 3.16Å; S156-D159 VanDerWaalsContact O-N 3.11Å; F157-D159 VanDerWaalsContact C-N 3.27Å; F157-D159 PolarHBondContact O-N 2.6Å
160	L	96.6	Very high	95.8	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.047	28%	0.279	C	S	.	.	S	Bend	trans	-81.9	149.1	177.1	-57.3	-173.6	0	0	0	111.4	K126 A129 E130 C133 F157 M158 K162 F165	K126-L160 HydrophobicContact CG-CD2 3.77Å; A129-L160 HydrophobicContact CB-CD1 3.84Å; A129-L160 HydrophobicContact CB-CD2 4.06Å; A129-L160 HydrophobicContact CB-CG 3.98Å; E130-L160 HydrophobicContact CB-CD2 4.48Å; E130-L160 HydrophobicContact CG-CD2 3.43Å; E130-L160 VanDerWaalsContact CG-CD2 3.43Å; C133-L160 VanDerWaalsContact SG-CD1 3.52Å; F157-L160 HydrophobicContact CD1-CD1 4.26Å; F157-L160 WeakPolarHBondContact O-CB 3.48Å; F157-L160 PolarHBondContact O-N 3.07Å; M158-L160 PolarHBondContact O-N 3.04Å; L160-K162 PolarHBondContact O-N 3.47Å; L160-F165 HydrophobicContact CD1-CD2 4.5Å
161	P	97.1	Very high	95.8	Very high	72 Å²	72	48.5 Å²	48.5	47%	0.468	27%	0.272	S	S	.	.			trans	-56.2	124.8	164.2	-20.9	32.3	0	0	0	109.8	S163 H164 F165	P161-S163 PolarHBondContact O-N 3.04Å; P161-S163 VanDerWaalsContact O-N 3.1Å; P161-H164 HydrophobicContact CB-CB 4.28Å; P161-H164 WeakPolarHBondContact O-CB 3.29Å; P161-H164 PolarHBondContact O-N 3.33Å; P161-F165 PolarHBondContact O-N 3.43Å
162	K	96.4	Very high	96	Very high	86 Å²	86	47.5 Å²	47.5	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-47.9	-45.3	-177.7	-176.6	174.4	70.7	147.3	0	112.9	L160 H164 F165 I166 P188 D190	L160-K162 PolarHBondContact O-N 3.47Å; K162-H164 VanDerWaalsContact C-N 3.27Å; K162-H164 PolarHBondContact O-N 2.85Å; K162-F165 PolarHBondContact O-N 3.36Å; K162-I166 HydrophobicContact CG-CG1 4.01Å; K162-I166 WeakPolarHBondContact O-CB 3.43Å; K162-I166 VanDerWaalsContact O-CG1 3.26Å; K162-I166 WeakPolarHBondContact O-CG1 3.21Å; K162-I166 PolarHBondContact O-N 3.44Å; K162-P188 HydrophobicContact CG-CB 4.28Å; K162-P188 WeakPolarHBondContact CG-O 3.29Å; K162-D190 WeakPolarHBondContact CE-OD2 3.38Å; K162-D190 IonicContact NZ-OD2 2.78Å; K162-D190 PolarHBondContact NZ-OD2 2.65Å
163	S	97.1	Very high	96.3	Very high	92 Å²	92	44.4 Å²	44.4	64%	0.643	25%	0.246	S	C	*	.	H	α-helix	trans	-60.4	-34.2	179.5	53.2	0	0	0	0	113.7	P161 S167	P161-S163 PolarHBondContact O-N 3.04Å; P161-S163 VanDerWaalsContact O-N 3.1Å; S163-S167 WeakPolarHBondContact O-CB 3.5Å; S163-S167 PolarHBondContact O-N 3.27Å; S163-S167 PolarHBondContact O-OG 2.52Å
164	H	97.9	Very high	96.7	Very high	56 Å²	56	44.1 Å²	44.1	26%	0.259	24%	0.237	S	C	.	.	H	α-helix	trans	-69.5	-44.3	178.1	-177.9	-156.3	0	0	0	111.2	P161 K162 S167 A168	P161-H164 HydrophobicContact CB-CB 4.28Å; P161-H164 WeakPolarHBondContact O-CB 3.29Å; P161-H164 PolarHBondContact O-N 3.33Å; K162-H164 VanDerWaalsContact C-N 3.27Å; K162-H164 PolarHBondContact O-N 2.85Å; H164-S167 PolarHBondContact O-OG 3.45Å; H164-A168 PolarHBondContact O-N 2.67Å
165	F	98.4	Very high	97	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-47.2	176.1	177.8	-93.8	0	0	0	111.8	L149 F157 L160 P161 K162 S167 A168 L169 T187 P188 V189	L149-F165 HydrophobicContact CD1-CE2 3.72Å; L149-F165 HydrophobicContact CD1-CZ 3.63Å; F157-F165 HydrophobicContact CB-CD2 4.41Å; F157-F165 HydrophobicContact CB-CE2 4.29Å; F157-F165 AromaticContact CD1-CD2 3.72Å; F157-F165 HydrophobicContact CD1-CD2 3.72Å; F157-F165 AromaticContact CD1-CE2 3.55Å; F157-F165 HydrophobicContact CD1-CE2 3.55Å; F157-F165 HydrophobicContact CE1-CD2 4.36Å; F157-F165 AromaticContact CE1-CE2 3.99Å; F157-F165 HydrophobicContact CE1-CE2 3.99Å; F157-F165 HydrophobicContact CG-CD2 4.36Å; F157-F165 HydrophobicContact CG-CE2 4Å; L160-F165 HydrophobicContact CD1-CD2 4.5Å; P161-F165 PolarHBondContact O-N 3.43Å; K162-F165 PolarHBondContact O-N 3.36Å; F165-S167 VanDerWaalsContact C-N 3.34Å; F165-S167 PolarHBondContact O-N 2.92Å; F165-A168 PolarHBondContact O-N 2.56Å; F165-L169 HydrophobicContact CE1-CB 4.49Å; F165-L169 HydrophobicContact CE1-CD2 3.79Å; F165-L169 HydrophobicContact CZ-CD2 4.13Å; F165-L169 WeakPolarHBondContact O-CB 3.27Å; F165-L169 PolarHBondContact O-N 2.78Å; F165-T187 HydrophobicContact CE1-CG2 4.37Å; F165-T187 HydrophobicContact CE2-CG2 4.13Å; F165-T187 HydrophobicContact CZ-CG2 3.6Å; F165-P188 HydrophobicContact CB-CG 3.83Å; F165-P188 HydrophobicContact CD1-CG 3.59Å; F165-P188 HydrophobicContact CD2-CG 4.46Å; F165-P188 HydrophobicContact CE1-CG 4.28Å; F165-P188 HydrophobicContact CG-CG 3.69Å; F165-V189 HydrophobicContact CE1-CG1 3.74Å
166	I	98.3	Very high	97.1	Very high	25 Å²	25	35.3 Å²	35.3	13%	0.128	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-40.2	-179.9	-66	-57.5	0	0	0	111.6	K162 L169 T170 V189	K162-I166 HydrophobicContact CG-CG1 4.01Å; K162-I166 WeakPolarHBondContact O-CB 3.43Å; K162-I166 VanDerWaalsContact O-CG1 3.26Å; K162-I166 WeakPolarHBondContact O-CG1 3.21Å; K162-I166 PolarHBondContact O-N 3.44Å; I166-L169 PolarHBondContact O-N 2.59Å; I166-T170 VanDerWaalsContact O-CB 3.26Å; I166-T170 WeakPolarHBondContact O-CB 3.48Å; I166-T170 PolarHBondContact O-N 3.37Å; I166-T170 PolarHBondContact O-OG1 3.41Å; I166-V189 HydrophobicContact CD1-CG1 4.43Å
167	S	97.9	Very high	97	Very high	63 Å²	63	40.6 Å²	40.6	44%	0.441	23%	0.225	S	C	.	.	H	α-helix	trans	-64.3	-43.7	179.1	65.3	0	0	0	0	111.7	S163 H164 F165 T170 V171	S163-S167 WeakPolarHBondContact O-CB 3.5Å; S163-S167 PolarHBondContact O-N 3.27Å; S163-S167 PolarHBondContact O-OG 2.52Å; H164-S167 PolarHBondContact O-OG 3.45Å; F165-S167 VanDerWaalsContact C-N 3.34Å; F165-S167 PolarHBondContact O-N 2.92Å; S167-T170 PolarHBondContact O-N 2.79Å; S167-V171 PolarHBondContact O-N 3.17Å
168	A	98.2	Very high	96.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-46.1	176.4	0	0	0	0	0	111.9	C133 L136 S137 H164 F165 T170 V171	C133-A168 HydrophobicContact CB-CB 3.79Å; C133-A168 WeakPolarHBondContact O-CB 3.38Å; L136-A168 HydrophobicContact CB-CB 4.07Å; S137-A168 WeakPolarHBondContact OG-CB 3.47Å; H164-A168 PolarHBondContact O-N 2.67Å; F165-A168 PolarHBondContact O-N 2.56Å; A168-T170 VanDerWaalsContact C-N 3.34Å; A168-T170 PolarHBondContact O-N 2.92Å; A168-V171 WeakPolarHBondContact O-CB 3.15Å; A168-V171 PolarHBondContact O-N 3.09Å
169	L	98.1	Very high	97	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-36.1	179.4	-172.8	62.4	0	0	0	112.5	L147 L149 F165 I166 V171 V172 F173 V189	L147-L169 HydrophobicContact CD2-CD1 3.68Å; L149-L169 HydrophobicContact CD1-CD1 4.36Å; F165-L169 HydrophobicContact CE1-CB 4.49Å; F165-L169 HydrophobicContact CE1-CD2 3.79Å; F165-L169 HydrophobicContact CZ-CD2 4.13Å; F165-L169 WeakPolarHBondContact O-CB 3.27Å; F165-L169 PolarHBondContact O-N 2.78Å; I166-L169 PolarHBondContact O-N 2.59Å; L169-V171 PolarHBondContact O-N 3.16Å; L169-V172 PolarHBondContact O-N 2.96Å; L169-F173 HydrophobicContact CD1-CE1 3.95Å; L169-F173 HydrophobicContact CD1-CZ 4.07Å; L169-F173 HydrophobicContact CD2-CE1 4.24Å; L169-F173 HydrophobicContact CD2-CE2 3.87Å; L169-F173 HydrophobicContact CD2-CZ 3.5Å; L169-F173 VanDerWaalsContact CD2-CZ 3.5Å; L169-F173 HydrophobicContact CG-CD1 4.48Å; L169-F173 HydrophobicContact CG-CD2 4.47Å; L169-F173 HydrophobicContact CG-CE1 3.87Å; L169-F173 HydrophobicContact CG-CE2 3.87Å; L169-F173 HydrophobicContact CG-CZ 3.54Å; L169-F173 PolarHBondContact O-N 3Å; L169-V189 HydrophobicContact CD2-CG1 3.58Å
170	T	97.8	Very high	97.2	Very high	39 Å²	39	36.5 Å²	36.5	24%	0.239	21%	0.209	C	C	.	.	H	α-helix	trans	-59.1	-33	177.7	-64.8	0	0	0	0	112	I166 S167 A168 V172 F173 V174 V196	I166-T170 VanDerWaalsContact O-CB 3.26Å; I166-T170 WeakPolarHBondContact O-CB 3.48Å; I166-T170 PolarHBondContact O-N 3.37Å; I166-T170 PolarHBondContact O-OG1 3.41Å; S167-T170 PolarHBondContact O-N 2.79Å; A168-T170 VanDerWaalsContact C-N 3.34Å; A168-T170 PolarHBondContact O-N 2.92Å; T170-V172 PolarHBondContact O-N 3.23Å; T170-F173 PolarHBondContact O-N 2.86Å; T170-V174 HydrophobicContact CG2-CG2 3.87Å; T170-V174 WeakPolarHBondContact O-CB 3.46Å; T170-V174 WeakPolarHBondContact O-CG2 3.25Å; T170-V174 PolarHBondContact O-N 2.86Å; T170-V196 HydrophobicContact CG2-CG1 4.25Å
171	V	97.3	Very high	97.3	Very high	30 Å²	30	36.7 Å²	36.7	18%	0.182	21%	0.212	C	C	.	.	H	α-helix	trans	-56.3	-42.8	174.1	175.2	0	0	0	0	110.6	V140 S167 A168 L169 N175	V140-V171 HydrophobicContact CG2-CG1 3.83Å; S167-V171 PolarHBondContact O-N 3.17Å; A168-V171 WeakPolarHBondContact O-CB 3.15Å; A168-V171 PolarHBondContact O-N 3.09Å; L169-V171 PolarHBondContact O-N 3.16Å; V171-N175 WeakPolarHBondContact O-CB 3.29Å; V171-N175 PolarHBondContact O-N 3.36Å; V171-N175 VanDerWaalsContact O-N 3.12Å; V171-N175 PolarHBondContact O-ND2 2.76Å
172	V	97	Very high	97.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.5	-48.7	177.9	178.7	0	0	0	0	111	L136 L139 L144 L147 L169 T170 V174 N175 S176	L136-V172 HydrophobicContact CD2-CG2 3.83Å; L139-V172 HydrophobicContact CD1-CG2 4.37Å; L144-V172 HydrophobicContact CD1-CG1 3.9Å; L144-V172 HydrophobicContact CD1-CG2 4.42Å; L147-V172 HydrophobicContact CD2-CB 4.29Å; L147-V172 HydrophobicContact CD2-CG1 3.99Å; L147-V172 HydrophobicContact CD2-CG2 4.29Å; L169-V172 PolarHBondContact O-N 2.96Å; T170-V172 PolarHBondContact O-N 3.23Å; V172-V174 VanDerWaalsContact C-N 3.28Å; V172-V174 PolarHBondContact O-N 2.9Å; V172-N175 PolarHBondContact O-N 3.02Å; V172-S176 WeakPolarHBondContact O-CB 3.41Å; V172-S176 PolarHBondContact O-N 2.99Å; V172-S176 PolarHBondContact O-OG 2.9Å
173	F	97.4	Very high	97.4	Very high	1 Å²	1	33 Å²	33	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-57.1	-42.3	-179.2	-65.3	-13.1	0	0	0	112.2	L169 T170 L179 L182 V196 L197 N200 N201	L169-F173 HydrophobicContact CD1-CE1 3.95Å; L169-F173 HydrophobicContact CD1-CZ 4.07Å; L169-F173 HydrophobicContact CD2-CE1 4.24Å; L169-F173 HydrophobicContact CD2-CE2 3.87Å; L169-F173 HydrophobicContact CD2-CZ 3.5Å; L169-F173 VanDerWaalsContact CD2-CZ 3.5Å; L169-F173 HydrophobicContact CG-CD1 4.48Å; L169-F173 HydrophobicContact CG-CD2 4.47Å; L169-F173 HydrophobicContact CG-CE1 3.87Å; L169-F173 HydrophobicContact CG-CE2 3.87Å; L169-F173 HydrophobicContact CG-CZ 3.54Å; L169-F173 PolarHBondContact O-N 3Å; T170-F173 PolarHBondContact O-N 2.86Å; F173-L179 HydrophobicContact CD1-CD2 4.13Å; F173-L179 HydrophobicContact CE1-CD2 4.35Å; F173-L182 HydrophobicContact CE1-CD1 4.22Å; F173-L182 HydrophobicContact CE1-CD2 3.62Å; F173-L182 HydrophobicContact CZ-CD2 3.81Å; F173-V196 HydrophobicContact CB-CG1 4.09Å; F173-V196 HydrophobicContact CD2-CG1 4.4Å; F173-L197 HydrophobicContact CD1-CB 4.42Å; F173-L197 HydrophobicContact CD1-CD1 3.81Å; F173-L197 HydrophobicContact CD2-CB 3.9Å; F173-L197 HydrophobicContact CE1-CB 4.39Å; F173-L197 HydrophobicContact CE1-CD1 3.83Å; F173-L197 HydrophobicContact CE2-CB 3.86Å; F173-L197 HydrophobicContact CG-CB 4.19Å; F173-L197 HydrophobicContact CG-CD1 4.3Å; F173-L197 HydrophobicContact CZ-CB 4.1Å; F173-L197 HydrophobicContact CZ-CD1 4.3Å; F173-L197 HydrophobicContact CZ-CD2 4.45Å; F173-N200 WeakPolarHBondContact O-CB 3.32Å; F173-N201 PolarHBondContact O-OD1 3.47Å
174	V	97.3	Very high	97.5	Very high	57 Å²	57	28.7 Å²	28.7	35%	0.345	16%	0.158	S	C	.	.	H	α-helix	trans	-74.1	-40.6	-178.4	174.1	0	0	0	0	111.8	T170 V172 K177 V196	T170-V174 HydrophobicContact CG2-CG2 3.87Å; T170-V174 WeakPolarHBondContact O-CB 3.46Å; T170-V174 WeakPolarHBondContact O-CG2 3.25Å; T170-V174 PolarHBondContact O-N 2.86Å; V172-V174 VanDerWaalsContact C-N 3.28Å; V172-V174 PolarHBondContact O-N 2.9Å; V174-K177 WeakPolarHBondContact O-CE 3.48Å; V174-K177 PolarHBondContact O-NZ 3.31Å; V174-V196 HydrophobicContact CG2-CG1 4.13Å
175	N	96.1	Very high	97.4	Very high	56 Å²	56	28 Å²	28	30%	0.299	16%	0.156	S	C	.	.	H	α-helix	trans	-91.2	-29.6	-171.6	-64.8	-66.3	0	0	0	113.6	V140 V171 V172 K177	V140-N175 WeakPolarHBondContact O-CB 3.34Å; V171-N175 WeakPolarHBondContact O-CB 3.29Å; V171-N175 PolarHBondContact O-N 3.36Å; V171-N175 VanDerWaalsContact O-N 3.12Å; V171-N175 PolarHBondContact O-ND2 2.76Å; V172-N175 PolarHBondContact O-N 3.02Å; N175-K177 PolarHBondContact O-N 2.85Å; N175-K177 VanDerWaalsContact O-N 3.15Å
176	S	95.2	Very high	97.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.169	C	C	.	.			trans	-88.5	81	-177.7	-64.9	0	0	0	0	112.1	C142 L144 V172 S178 L179 N201	C142-S176 PolarHBondContact O-OG 3.05Å; L144-S176 WeakPolarHBondContact CB-OG 3.33Å; L144-S176 PolarHBondContact N-OG 3.3Å; V172-S176 WeakPolarHBondContact O-CB 3.41Å; V172-S176 PolarHBondContact O-N 2.99Å; V172-S176 PolarHBondContact O-OG 2.9Å; S176-S178 PolarHBondContact O-N 2.93Å; S176-S178 VanDerWaalsContact O-N 3.1Å; S176-L179 PolarHBondContact O-N 3.11Å; S176-N201 PolarHBondContact O-ND2 2.85Å
177	K	94.3	Very high	97.3	Very high	112 Å²	112	29.2 Å²	29.2	49%	0.487	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-7.9	-178.3	-56	-50.8	-168.6	-172	0	115.5	V174 N175 N200	V174-K177 WeakPolarHBondContact O-CE 3.48Å; V174-K177 PolarHBondContact O-NZ 3.31Å; N175-K177 PolarHBondContact O-N 2.85Å; N175-K177 VanDerWaalsContact O-N 3.15Å; K177-N200 PolarHBondContact NZ-OD1 2.67Å
178	S	95.6	Very high	97.3	Very high	36 Å²	36	26.4 Å²	26.4	25%	0.252	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	17.1	179.7	59.9	0	0	0	0	113.8	S143 L144 K145 S176 S180	S143-S178 PolarHBondContact OG-OG 2.81Å; L144-S178 CarbonylContact O-C 3.57Å; L144-S178 VanDerWaalsContact O-C 3.29Å; L144-S178 PolarHBondContact O-OG 2.96Å; K145-S178 WeakPolarHBondContact CA-O 3.47Å; S176-S178 PolarHBondContact O-N 2.93Å; S176-S178 VanDerWaalsContact O-N 3.1Å; S178-S180 PolarHBondContact O-N 3.41Å; S178-S180 VanDerWaalsContact O-N 3.17Å
179	L	98.2	Very high	97.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.			trans	-65.4	118	-175	-171.1	66	0	0	0	110.3	L144 L147 F173 S176 L182 L197 N201 T204 L205	L144-L179 HydrophobicContact CB-CD1 4.32Å; L144-L179 WeakPolarHBondContact O-CA 3.31Å; L144-L179 PolarHBondContact O-N 3.4Å; L147-L179 HydrophobicContact CB-CD1 4.17Å; F173-L179 HydrophobicContact CD1-CD2 4.13Å; F173-L179 HydrophobicContact CE1-CD2 4.35Å; S176-L179 PolarHBondContact O-N 3.11Å; L179-L182 HydrophobicContact CD2-CD1 4.46Å; L179-L197 HydrophobicContact CD2-CD1 3.97Å; L179-N201 HydrophobicContact CB-CB 4.47Å; L179-T204 CarbonylContact O-C 3.51Å; L179-T204 WeakPolarHBondContact O-CB 3.49Å; L179-T204 PolarHBondContact O-OG1 3.01Å; L179-L205 PolarHBondContact O-N 3Å
180	S	98.3	Very high	97.2	Very high	31 Å²	31	27.1 Å²	27.1	22%	0.217	15%	0.147	C	C	.	.			trans	-116.5	-24.6	-173.4	68.2	0	0	0	0	113.8	K145 S178 T204 K206 L207	K145-S180 WeakPolarHBondContact O-CA 3.41Å; K145-S180 PolarHBondContact O-N 2.84Å; K145-S180 PolarHBondContact O-OG 3.07Å; S178-S180 PolarHBondContact O-N 3.41Å; S178-S180 VanDerWaalsContact O-N 3.17Å; S180-T204 VanDerWaalsContact CA-O 3.27Å; S180-T204 WeakPolarHBondContact CA-O 3.27Å; S180-T204 WeakPolarHBondContact CB-O 3.48Å; S180-K206 WeakPolarHBondContact O-CA 3.45Å; S180-K206 PolarHBondContact O-N 2.86Å; S180-L207 PolarHBondContact O-N 3.48Å
181	S	98.7	Very high	97.3	Very high	14 Å²	14	27 Å²	27	10%	0.098	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	124.5	-179.6	169.9	0	0	0	0	109.6	K145 T146 L147 L207	K145-S181 PolarHBondContact O-N 3.04Å; T146-S181 VanDerWaalsContact CA-O 3.31Å; T146-S181 WeakPolarHBondContact CA-O 3.21Å; L147-S181 PolarHBondContact N-O 2.85Å; S181-L207 WeakPolarHBondContact CA-O 3.45Å
182	L	98.8	Very high	97.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123	177.7	-174.6	62.8	0	0	0	109.7	L147 F173 L179 I184 L197 L205 L207 L208 K209	L147-L182 HydrophobicContact CB-CD1 3.92Å; L147-L182 HydrophobicContact CD2-CD1 3.89Å; L147-L182 HydrophobicContact CG-CD1 4.11Å; L147-L182 WeakPolarHBondContact O-CA 3.29Å; F173-L182 HydrophobicContact CE1-CD1 4.22Å; F173-L182 HydrophobicContact CE1-CD2 3.62Å; F173-L182 HydrophobicContact CZ-CD2 3.81Å; L179-L182 HydrophobicContact CD2-CD1 4.46Å; L182-I184 HydrophobicContact CD1-CG2 3.6Å; L182-I184 HydrophobicContact CD2-CD1 3.91Å; L182-I184 HydrophobicContact CD2-CG1 4.33Å; L182-I184 HydrophobicContact CD2-CG2 4.31Å; L182-I184 HydrophobicContact CG-CD1 4.28Å; L182-I184 HydrophobicContact CG-CG1 4.15Å; L182-I184 HydrophobicContact CG-CG2 3.79Å; L182-L197 HydrophobicContact CD2-CD1 4.18Å; L182-L197 HydrophobicContact CD2-CD2 3.69Å; L182-L205 HydrophobicContact CB-CD1 4.36Å; L182-L207 PolarHBondContact N-O 2.97Å; L182-L208 HydrophobicContact CB-CD1 4.11Å; L182-L208 HydrophobicContact CD2-CD1 3.94Å; L182-L208 HydrophobicContact CG-CD1 4.22Å; L182-L208 WeakPolarHBondContact O-CA 3.29Å; L182-K209 PolarHBondContact O-N 3.34Å
183	K	98.6	Very high	97.4	Very high	81 Å²	81	29.6 Å²	29.6	35%	0.352	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.1	171.2	-55.2	178.7	-176.6	174.5	0	108	L147 G148 L149 L207 K209	L147-K183 PolarHBondContact O-N 3.2Å; G148-K183 CarbonylContact C-O 3.53Å; G148-K183 WeakPolarHBondContact CA-O 3.44Å; L149-K183 PolarHBondContact N-O 3.22Å; K183-L207 HydrophobicContact CG-CD2 4.02Å; K183-K209 HydrophobicContact CB-CB 4.39Å; K183-K209 HydrophobicContact CD-CD 4.5Å; K183-K209 HydrophobicContact CG-CB 4.26Å; K183-K209 HydrophobicContact CG-CD 4.31Å; K183-K209 HydrophobicContact CG-CG 4.41Å
184	I	97.9	Very high	97.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.162	C	C	.	.			trans	-141.8	34.2	-172.4	51.7	165.8	0	0	0	109.7	L149 L182 T187 V189 L208 K209 M210 C213	L149-I184 HydrophobicContact CD1-CG2 4.12Å; L149-I184 HydrophobicContact CG-CG2 4.3Å; L182-I184 HydrophobicContact CD1-CG2 3.6Å; L182-I184 HydrophobicContact CD2-CD1 3.91Å; L182-I184 HydrophobicContact CD2-CG1 4.33Å; L182-I184 HydrophobicContact CD2-CG2 4.31Å; L182-I184 HydrophobicContact CG-CD1 4.28Å; L182-I184 HydrophobicContact CG-CG1 4.15Å; L182-I184 HydrophobicContact CG-CG2 3.79Å; I184-T187 HydrophobicContact CB-CG2 4.2Å; I184-T187 WeakPolarHBondContact O-CB 3.31Å; I184-T187 WeakPolarHBondContact O-CG2 3.47Å; I184-T187 PolarHBondContact O-OG1 3.08Å; I184-V189 HydrophobicContact CD1-CB 4.39Å; I184-V189 HydrophobicContact CD1-CG1 3.82Å; I184-V189 HydrophobicContact CD1-CG2 3.97Å; I184-L208 HydrophobicContact CD1-CD1 4.33Å; I184-L208 HydrophobicContact CG1-CD1 4.45Å; I184-K209 WeakPolarHBondContact CG1-O 3.39Å; I184-K209 PolarHBondContact N-O 2.97Å; I184-M210 HydrophobicContact CD1-CB 4.2Å; I184-M210 HydrophobicContact CG1-CB 3.94Å; I184-C213 PolarHBondContact O-SG 3.21Å; I184-C213 VanDerWaalsContact O-SG 3.38Å
185	D	96.9	Very high	97.5	Very high	43 Å²	43	33 Å²	33	23%	0.23	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	145.5	173.9	-55.8	-51.9	0	0	0	109.6	T187 M210 S211	D185-T187 PolarHBondContact O-N 3.4Å; D185-M210 WeakPolarHBondContact OD1-CA 3.37Å; D185-M210 PolarHBondContact OD1-N 2.9Å; D185-S211 CarbonylContact C-O 3.53Å; D185-S211 VanDerWaalsContact CA-O 3.25Å; D185-S211 WeakPolarHBondContact CA-O 3.4Å; D185-S211 PolarHBondContact OD1-N 3.14Å
186	D	96.2	Very high	97.6	Very high	50 Å²	50	32.6 Å²	32.6	27%	0.267	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	40.5	179.3	-49.4	-67.1	0	0	0	114.8	P155 M158 S211 S212	P155-D186 HydrophobicContact CB-CB 3.53Å; M158-D186 VanDerWaalsContact CE-C 3.41Å; D186-S211 PolarHBondContact N-O 2.97Å; D186-S212 WeakPolarHBondContact OD1-CB 3.27Å; D186-S212 PolarHBondContact OD1-OG 3.4Å; D186-S212 VanDerWaalsContact OD1-OG 3.1Å
187	T	97.6	Very high	97.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.172	C	C	.	.			trans	-120	154.3	178.7	65.8	0	0	0	0	113.4	L149 F157 M158 F165 I184 D185 V189	L149-T187 HydrophobicContact CB-CG2 4.48Å; L149-T187 HydrophobicContact CD1-CG2 4.37Å; F157-T187 HydrophobicContact CB-CG2 4.39Å; F157-T187 HydrophobicContact CD2-CG2 4.22Å; F157-T187 HydrophobicContact CG-CG2 4.4Å; M158-T187 VanDerWaalsContact CE-C 3.5Å; M158-T187 WeakPolarHBondContact CE-O 3.04Å; M158-T187 VanDerWaalsContact SD-C 3.6Å; F165-T187 HydrophobicContact CE1-CG2 4.37Å; F165-T187 HydrophobicContact CE2-CG2 4.13Å; F165-T187 HydrophobicContact CZ-CG2 3.6Å; I184-T187 HydrophobicContact CB-CG2 4.2Å; I184-T187 WeakPolarHBondContact O-CB 3.31Å; I184-T187 WeakPolarHBondContact O-CG2 3.47Å; I184-T187 PolarHBondContact O-OG1 3.08Å; D185-T187 PolarHBondContact O-N 3.4Å; T187-V189 PolarHBondContact O-N 3.3Å
188	P	97.5	Very high	97.9	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.019	15%	0.149	C	C	.	.			trans	-81.1	31.5	-179.5	35.3	-37.8	0	0	0	112.9	M158 K162 F165	M158-P188 HydrophobicContact SD-CB 3.99Å; K162-P188 HydrophobicContact CG-CB 4.28Å; K162-P188 WeakPolarHBondContact CG-O 3.29Å; F165-P188 HydrophobicContact CB-CG 3.83Å; F165-P188 HydrophobicContact CD1-CG 3.59Å; F165-P188 HydrophobicContact CD2-CG 4.46Å; F165-P188 HydrophobicContact CE1-CG 4.28Å; F165-P188 HydrophobicContact CG-CG 3.69Å
189	V	97.7	Very high	98	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.167	C	C	.	.			trans	-59.9	149.5	175.1	-72	0	0	0	0	111.7	F165 I166 L169 I184 T187 C213 H215 V216	F165-V189 HydrophobicContact CE1-CG1 3.74Å; I166-V189 HydrophobicContact CD1-CG1 4.43Å; L169-V189 HydrophobicContact CD2-CG1 3.58Å; I184-V189 HydrophobicContact CD1-CB 4.39Å; I184-V189 HydrophobicContact CD1-CG1 3.82Å; I184-V189 HydrophobicContact CD1-CG2 3.97Å; T187-V189 PolarHBondContact O-N 3.3Å; V189-C213 HydrophobicContact CG2-CB 3.77Å; V189-C213 VanDerWaalsContact CG2-SG 3.57Å; V189-H215 WeakPolarHBondContact O-CB 3.46Å; V189-V216 HydrophobicContact CG2-CG2 3.93Å; V189-V216 WeakPolarHBondContact O-CG2 3.49Å
190	D	97.9	Very high	98	Very high	17 Å²	17	31.2 Å²	31.2	9%	0.091	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-135.8	168.2	-178.3	62.7	15	0	0	0	113.3	K162 P192 S193 L194 H215	K162-D190 WeakPolarHBondContact CE-OD2 3.38Å; K162-D190 IonicContact NZ-OD2 2.78Å; K162-D190 PolarHBondContact NZ-OD2 2.65Å; D190-P192 WeakPolarHBondContact OD1-CD 3.35Å; D190-S193 PolarHBondContact N-OG 3.37Å; D190-S193 VanDerWaalsContact N-OG 3.08Å; D190-S193 PolarHBondContact O-N 3.3Å; D190-S193 PolarHBondContact O-OG 2.97Å; D190-S193 WeakPolarHBondContact OD1-CB 3.23Å; D190-S193 PolarHBondContact OD1-N 2.85Å; D190-S193 PolarHBondContact OD1-OG 3.43Å; D190-L194 PolarHBondContact O-N 3.03Å; D190-H215 WeakPolarHBondContact CA-O 3.35Å; D190-H215 HydrophobicContact CB-CB 3.94Å
191	D	98.4	Very high	98	Very high	36 Å²	36	29.9 Å²	29.9	19%	0.193	17%	0.168	C	C	.	.	H	α-helix	trans	-53.5	-43	-178.1	-60.8	-3.6	0	0	0	113.8	S193 L194 K195 V216 S217 G220	D191-S193 VanDerWaalsContact C-N 3.34Å; D191-S193 PolarHBondContact O-N 2.72Å; D191-L194 PolarHBondContact O-N 3.37Å; D191-K195 WeakPolarHBondContact O-CG 3.34Å; D191-K195 PolarHBondContact O-N 3.04Å; D191-V216 VanDerWaalsContact OD1-CA 3.32Å; D191-V216 WeakPolarHBondContact OD1-CA 3.39Å; D191-S217 PolarHBondContact OD1-N 3.27Å; D191-S217 WeakPolarHBondContact OD2-CB 3.32Å; D191-S217 PolarHBondContact OD2-OG 3.35Å; D191-G220 VanDerWaalsContact CG-CA 3.45Å; D191-G220 WeakPolarHBondContact OD1-CA 3.49Å
192	P	98.6	Very high	97.9	Very high	83 Å²	83	30.5 Å²	30.5	54%	0.539	17%	0.172	S	C	.	.	H	α-helix	trans	-57.3	-43.6	173.2	-26.4	35.5	0	0	0	113.4	D190 L194 K195 V196	D190-P192 WeakPolarHBondContact OD1-CD 3.35Å; P192-L194 VanDerWaalsContact C-N 3.34Å; P192-L194 PolarHBondContact O-N 2.7Å; P192-K195 WeakPolarHBondContact O-CB 3.48Å; P192-K195 PolarHBondContact O-N 2.77Å; P192-V196 WeakPolarHBondContact O-CG2 3.1Å; P192-V196 PolarHBondContact O-N 2.83Å; P192-V196 VanDerWaalsContact O-N 3.12Å
193	S	98.1	Very high	97.9	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.014	21%	0.21	C	C	.	.	H	α-helix	trans	-65.4	-36.4	178	73.2	0	0	0	0	112.6	D190 D191 V196 L197	D190-S193 PolarHBondContact N-OG 3.37Å; D190-S193 VanDerWaalsContact N-OG 3.08Å; D190-S193 PolarHBondContact O-N 3.3Å; D190-S193 PolarHBondContact O-OG 2.97Å; D190-S193 WeakPolarHBondContact OD1-CB 3.23Å; D190-S193 PolarHBondContact OD1-N 2.85Å; D190-S193 PolarHBondContact OD1-OG 3.43Å; D191-S193 VanDerWaalsContact C-N 3.34Å; D191-S193 PolarHBondContact O-N 2.72Å; S193-V196 WeakPolarHBondContact O-CB 3.49Å; S193-V196 PolarHBondContact O-N 3.32Å; S193-L197 PolarHBondContact O-N 3.17Å
194	L	98.4	Very high	97.9	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-65.8	-37.1	173.1	-65.8	-179.3	0	0	0	112.1	D190 D191 P192 V196 L197 V198 M210 V216 V224	D190-L194 PolarHBondContact O-N 3.03Å; D191-L194 PolarHBondContact O-N 3.37Å; P192-L194 VanDerWaalsContact C-N 3.34Å; P192-L194 PolarHBondContact O-N 2.7Å; L194-V196 VanDerWaalsContact C-N 3.28Å; L194-V196 PolarHBondContact O-N 3.26Å; L194-L197 HydrophobicContact CD2-CD2 4.33Å; L194-L197 WeakPolarHBondContact O-CB 3.4Å; L194-L197 PolarHBondContact O-N 3.2Å; L194-V198 VanDerWaalsContact O-CG2 3.26Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.39Å; L194-M210 HydrophobicContact CD1-CE 4.05Å; L194-M210 HydrophobicContact CD2-CE 4.43Å; L194-V216 HydrophobicContact CD1-CB 4.49Å; L194-V216 HydrophobicContact CD1-CG1 3.69Å; L194-V216 HydrophobicContact CD1-CG2 3.97Å; L194-V224 HydrophobicContact CB-CG2 4.09Å; L194-V224 HydrophobicContact CD1-CG2 4.23Å; L194-V224 HydrophobicContact CD2-CG2 4.48Å
195	K	98.3	Very high	97.9	Very high	129 Å²	129	35.5 Å²	35.5	56%	0.561	20%	0.204	S	C	*	.	H	α-helix	trans	-61.6	-38.1	172.7	-73.4	178.1	179.4	178.8	0	111.9	D191 P192 V198 A199	D191-K195 WeakPolarHBondContact O-CG 3.34Å; D191-K195 PolarHBondContact O-N 3.04Å; P192-K195 WeakPolarHBondContact O-CB 3.48Å; P192-K195 PolarHBondContact O-N 2.77Å; K195-V198 PolarHBondContact O-N 3.06Å; K195-A199 VanDerWaalsContact O-CB 3.27Å; K195-A199 WeakPolarHBondContact O-CB 3.49Å; K195-A199 PolarHBondContact O-N 2.82Å
196	V	98.4	Very high	98	Very high	46 Å²	46	38.7 Å²	38.7	28%	0.279	22%	0.216	S	C	.	.	H	α-helix	trans	-65.1	-44.1	174.2	177.4	0	0	0	0	110.9	T170 F173 V174 P192 S193 L194 A199 N200	T170-V196 HydrophobicContact CG2-CG1 4.25Å; F173-V196 HydrophobicContact CB-CG1 4.09Å; F173-V196 HydrophobicContact CD2-CG1 4.4Å; V174-V196 HydrophobicContact CG2-CG1 4.13Å; P192-V196 WeakPolarHBondContact O-CG2 3.1Å; P192-V196 PolarHBondContact O-N 2.83Å; P192-V196 VanDerWaalsContact O-N 3.12Å; S193-V196 WeakPolarHBondContact O-CB 3.49Å; S193-V196 PolarHBondContact O-N 3.32Å; L194-V196 VanDerWaalsContact C-N 3.28Å; L194-V196 PolarHBondContact O-N 3.26Å; V196-A199 PolarHBondContact O-N 2.8Å; V196-N200 PolarHBondContact O-N 2.79Å; V196-N200 PolarHBondContact O-ND2 2.88Å
197	L	98.4	Very high	98.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-55.6	-52.9	173.9	171.7	65.8	0	0	0	110.9	F173 L179 L182 S193 L194 A199 N200 N201 L205	F173-L197 HydrophobicContact CD1-CB 4.42Å; F173-L197 HydrophobicContact CD1-CD1 3.81Å; F173-L197 HydrophobicContact CD2-CB 3.9Å; F173-L197 HydrophobicContact CE1-CB 4.39Å; F173-L197 HydrophobicContact CE1-CD1 3.83Å; F173-L197 HydrophobicContact CE2-CB 3.86Å; F173-L197 HydrophobicContact CG-CB 4.19Å; F173-L197 HydrophobicContact CG-CD1 4.3Å; F173-L197 HydrophobicContact CZ-CB 4.1Å; F173-L197 HydrophobicContact CZ-CD1 4.3Å; F173-L197 HydrophobicContact CZ-CD2 4.45Å; L179-L197 HydrophobicContact CD2-CD1 3.97Å; L182-L197 HydrophobicContact CD2-CD1 4.18Å; L182-L197 HydrophobicContact CD2-CD2 3.69Å; S193-L197 PolarHBondContact O-N 3.17Å; L194-L197 HydrophobicContact CD2-CD2 4.33Å; L194-L197 WeakPolarHBondContact O-CB 3.4Å; L194-L197 PolarHBondContact O-N 3.2Å; L197-A199 PolarHBondContact O-N 2.99Å; L197-N200 PolarHBondContact O-N 3.45Å; L197-N200 VanDerWaalsContact O-N 3.17Å; L197-N201 HydrophobicContact CD1-CB 4.07Å; L197-N201 WeakPolarHBondContact O-CB 3.35Å; L197-N201 PolarHBondContact O-N 2.87Å; L197-L205 HydrophobicContact CD2-CD2 4.09Å; L197-L205 HydrophobicContact CG-CD2 4.47Å
198	V	98.1	Very high	98.2	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-58.7	-48.2	-179.4	171.6	0	0	0	0	111.2	L194 K195 N200 N201 S202 V224 Q227	L194-V198 VanDerWaalsContact O-CG2 3.26Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.39Å; K195-V198 PolarHBondContact O-N 3.06Å; V198-N200 PolarHBondContact O-N 2.69Å; V198-N200 VanDerWaalsContact O-N 3.08Å; V198-N201 PolarHBondContact O-N 2.91Å; V198-S202 VanDerWaalsContact O-CB 3.28Å; V198-S202 WeakPolarHBondContact O-CB 3.39Å; V198-S202 PolarHBondContact O-N 2.84Å; V198-V224 HydrophobicContact CG2-CB 4.18Å; V198-V224 HydrophobicContact CG2-CG1 4.4Å; V198-V224 HydrophobicContact CG2-CG2 3.82Å; V198-Q227 HydrophobicContact CG1-CB 3.37Å; V198-Q227 HydrophobicContact CG1-CG 3.93Å; V198-Q227 VanDerWaalsContact CG1-OE1 3.3Å
199	A	98.1	Very high	98.2	Very high	78 Å²	78	39.8 Å²	39.8	65%	0.645	22%	0.219	S	C	*	.	H	α-helix	trans	-61.4	-21.4	-178.9	0	0	0	0	0	113.9	K195 V196 L197	K195-A199 VanDerWaalsContact O-CB 3.27Å; K195-A199 WeakPolarHBondContact O-CB 3.49Å; K195-A199 PolarHBondContact O-N 2.82Å; V196-A199 PolarHBondContact O-N 2.8Å; L197-A199 PolarHBondContact O-N 2.99Å
200	N	97.9	Very high	98.2	Very high	41 Å²	41	39.8 Å²	39.8	22%	0.219	22%	0.219	C	C	.	.	H	α-helix	trans	-108	-21.9	-178.4	-71.7	-81	0	0	0	114.1	F173 K177 V196 L197 V198	F173-N200 WeakPolarHBondContact O-CB 3.32Å; K177-N200 PolarHBondContact NZ-OD1 2.67Å; V196-N200 PolarHBondContact O-N 2.79Å; V196-N200 PolarHBondContact O-ND2 2.88Å; L197-N200 PolarHBondContact O-N 3.45Å; L197-N200 VanDerWaalsContact O-N 3.17Å; V198-N200 PolarHBondContact O-N 2.69Å; V198-N200 VanDerWaalsContact O-N 3.08Å
201	N	97.9	Very high	98	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.011	22%	0.218	C	C	.	.	H	α-helix	trans	-138.3	13.7	-167.2	-59.6	121.1	0	0	0	114.7	F173 S176 L179 L197 V198 D203 T204 L205	F173-N201 PolarHBondContact O-OD1 3.47Å; S176-N201 PolarHBondContact O-ND2 2.85Å; L179-N201 HydrophobicContact CB-CB 4.47Å; L197-N201 HydrophobicContact CD1-CB 4.07Å; L197-N201 WeakPolarHBondContact O-CB 3.35Å; L197-N201 PolarHBondContact O-N 2.87Å; V198-N201 PolarHBondContact O-N 2.91Å; N201-D203 PolarHBondContact O-N 3.45Å; N201-D203 VanDerWaalsContact O-N 3.15Å; N201-T204 PolarHBondContact O-N 2.79Å; N201-T204 VanDerWaalsContact O-N 3.08Å; N201-T204 PolarHBondContact O-OG1 3.37Å; N201-L205 WeakPolarHBondContact O-CB 3.34Å; N201-L205 PolarHBondContact O-N 3.3Å
202	S	97.4	Very high	97.9	Very high	27 Å²	27	40 Å²	40	19%	0.189	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-37.4	178	55.5	0	0	0	0	113.6	V198 T204	V198-S202 VanDerWaalsContact O-CB 3.28Å; V198-S202 WeakPolarHBondContact O-CB 3.39Å; V198-S202 PolarHBondContact O-N 2.84Å; S202-T204 VanDerWaalsContact C-N 3.34Å
203	D	97.4	Very high	97.7	Very high	148 Å²	148	36 Å²	36	79%	0.791	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.7	-174.5	-58.2	-21.3	0	0	0	112.9	N201	N201-D203 PolarHBondContact O-N 3.45Å; N201-D203 VanDerWaalsContact O-N 3.15Å
204	T	98.3	Very high	97.6	Very high	38 Å²	38	39.6 Å²	39.6	23%	0.233	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-26.2	-172.2	59	0	0	0	0	113.6	L179 S180 N201 S202 K206	L179-T204 CarbonylContact O-C 3.51Å; L179-T204 WeakPolarHBondContact O-CB 3.49Å; L179-T204 PolarHBondContact O-OG1 3.01Å; S180-T204 VanDerWaalsContact CA-O 3.27Å; S180-T204 WeakPolarHBondContact CA-O 3.27Å; S180-T204 WeakPolarHBondContact CB-O 3.48Å; N201-T204 PolarHBondContact O-N 2.79Å; N201-T204 VanDerWaalsContact O-N 3.08Å; N201-T204 PolarHBondContact O-OG1 3.37Å; S202-T204 VanDerWaalsContact C-N 3.34Å; T204-K206 PolarHBondContact O-N 3.08Å
205	L	98.6	Very high	97.5	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.			trans	-65.6	125.1	-175.5	-166.6	68.3	0	0	0	111.4	L179 L182 L197 N201 V224 C228 G230 L231	L179-L205 PolarHBondContact O-N 3Å; L182-L205 HydrophobicContact CB-CD1 4.36Å; L197-L205 HydrophobicContact CD2-CD2 4.09Å; L197-L205 HydrophobicContact CG-CD2 4.47Å; N201-L205 WeakPolarHBondContact O-CB 3.34Å; N201-L205 PolarHBondContact O-N 3.3Å; L205-V224 HydrophobicContact CD2-CG1 4.24Å; L205-C228 HydrophobicContact CD2-CB 4.4Å; L205-G230 CarbonylContact O-C 3.55Å; L205-G230 VanDerWaalsContact O-C 3.27Å; L205-L231 HydrophobicContact CD2-CD1 4.48Å; L205-L231 HydrophobicContact CG-CD1 4.36Å; L205-L231 PolarHBondContact O-N 3.08Å
206	K	98.8	Very high	97.5	Very high	111 Å²	111	38.1 Å²	38.1	48%	0.483	22%	0.218	S	C	.	.			trans	-124.4	-29.6	-179.4	-66.3	176.8	-175.2	179.9	0	112.7	S180 T204 R232 E233	S180-K206 WeakPolarHBondContact O-CA 3.45Å; S180-K206 PolarHBondContact O-N 2.86Å; T204-K206 PolarHBondContact O-N 3.08Å; K206-R232 PolarHBondContact O-N 2.95Å; K206-E233 PolarHBondContact O-N 3.15Å
207	L	98.8	Very high	97.4	Very high	22 Å²	22	37.8 Å²	37.8	12%	0.115	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	127.3	-179.4	179.7	164.6	0	0	0	109.8	S180 S181 L182 K183 K209 E233	S180-L207 PolarHBondContact O-N 3.48Å; S181-L207 WeakPolarHBondContact CA-O 3.45Å; L182-L207 PolarHBondContact N-O 2.97Å; K183-L207 HydrophobicContact CG-CD2 4.02Å; L207-K209 HydrophobicContact CD2-CD 4.42Å; L207-K209 HydrophobicContact CD2-CG 3.83Å; L207-E233 WeakPolarHBondContact CA-O 3.43Å; L207-E233 HydrophobicContact CB-CB 4.18Å; L207-E233 HydrophobicContact CD1-CB 4.38Å; L207-E233 WeakPolarHBondContact CD1-OE2 3.44Å; L207-E233 HydrophobicContact CG-CB 3.95Å
208	L	98.8	Very high	97.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	117.8	172	-179	58	0	0	0	110	L182 I184 M210 I221 V224 L231 E233 L234 A235	L182-L208 HydrophobicContact CB-CD1 4.11Å; L182-L208 HydrophobicContact CD2-CD1 3.94Å; L182-L208 HydrophobicContact CG-CD1 4.22Å; L182-L208 WeakPolarHBondContact O-CA 3.29Å; I184-L208 HydrophobicContact CD1-CD1 4.33Å; I184-L208 HydrophobicContact CG1-CD1 4.45Å; L208-M210 HydrophobicContact CD1-CB 4.48Å; L208-M210 HydrophobicContact CD1-CG 4.47Å; L208-M210 HydrophobicContact CD1-SD 4.25Å; L208-M210 HydrophobicContact CD2-CG 4.47Å; L208-M210 HydrophobicContact CD2-SD 3.62Å; L208-M210 HydrophobicContact CG-CG 4.1Å; L208-M210 HydrophobicContact CG-SD 3.87Å; L208-I221 HydrophobicContact CD2-CD1 4.18Å; L208-V224 HydrophobicContact CD2-CG1 3.93Å; L208-L231 HydrophobicContact CB-CD1 4.07Å; L208-E233 PolarHBondContact N-O 2.94Å; L208-L234 HydrophobicContact CB-CD1 4.12Å; L208-L234 HydrophobicContact CD2-CD1 4.23Å; L208-L234 HydrophobicContact CG-CD1 4.23Å; L208-L234 CarbonylContact O-C 3.29Å; L208-L234 VanDerWaalsContact O-CA 3.31Å; L208-L234 WeakPolarHBondContact O-CA 3.42Å; L208-A235 PolarHBondContact O-N 3.15Å
209	K	98.6	Very high	97.3	Very high	53 Å²	53	43.5 Å²	43.5	23%	0.23	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.1	170.2	-60.4	-169.2	179.5	-166.5	0	109.1	L182 K183 I184 L207 A235	L182-K209 PolarHBondContact O-N 3.34Å; K183-K209 HydrophobicContact CB-CB 4.39Å; K183-K209 HydrophobicContact CD-CD 4.5Å; K183-K209 HydrophobicContact CG-CB 4.26Å; K183-K209 HydrophobicContact CG-CD 4.31Å; K183-K209 HydrophobicContact CG-CG 4.41Å; I184-K209 WeakPolarHBondContact CG1-O 3.39Å; I184-K209 PolarHBondContact N-O 2.97Å; L207-K209 HydrophobicContact CD2-CD 4.42Å; L207-K209 HydrophobicContact CD2-CG 3.83Å; K209-A235 HydrophobicContact CB-CB 4.08Å; K209-A235 HydrophobicContact CD-CB 4.4Å; K209-A235 HydrophobicContact CG-CB 3.84Å
210	M	97.3	Very high	97.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.23	C	C	.	.			trans	-151.5	42.9	-172.2	60.7	176.5	-63.4	0	0	112	I184 D185 L194 L208 C213 V216 I221 A235	I184-M210 HydrophobicContact CD1-CB 4.2Å; I184-M210 HydrophobicContact CG1-CB 3.94Å; D185-M210 WeakPolarHBondContact OD1-CA 3.37Å; D185-M210 PolarHBondContact OD1-N 2.9Å; L194-M210 HydrophobicContact CD1-CE 4.05Å; L194-M210 HydrophobicContact CD2-CE 4.43Å; L208-M210 HydrophobicContact CD1-CB 4.48Å; L208-M210 HydrophobicContact CD1-CG 4.47Å; L208-M210 HydrophobicContact CD1-SD 4.25Å; L208-M210 HydrophobicContact CD2-CG 4.47Å; L208-M210 HydrophobicContact CD2-SD 3.62Å; L208-M210 HydrophobicContact CG-CG 4.1Å; L208-M210 HydrophobicContact CG-SD 3.87Å; M210-C213 HydrophobicContact CE-CB 4.26Å; M210-C213 PolarHBondContact O-SG 2.89Å; M210-V216 HydrophobicContact CE-CB 3.98Å; M210-V216 HydrophobicContact CE-CG1 3.77Å; M210-V216 HydrophobicContact CE-CG2 3.6Å; M210-I221 HydrophobicContact SD-CD1 3.8Å; M210-A235 PolarHBondContact N-O 2.85Å
211	S	94.6	Very high	97.3	Very high	9 Å²	9	38 Å²	38	6%	0.063	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	150.8	168.9	-65.3	0	0	0	0	110.4	D185 D186 C213 D263	D185-S211 CarbonylContact C-O 3.53Å; D185-S211 VanDerWaalsContact CA-O 3.25Å; D185-S211 WeakPolarHBondContact CA-O 3.4Å; D185-S211 PolarHBondContact OD1-N 3.14Å; D186-S211 PolarHBondContact N-O 2.97Å; S211-C213 PolarHBondContact O-N 2.83Å; S211-D263 VanDerWaalsContact CB-OD2 3.25Å; S211-D263 WeakPolarHBondContact CB-OD2 3.39Å; S211-D263 PolarHBondContact OG-OD2 3Å
212	S	94.4	Very high	97.4	Very high	49 Å²	49	39.8 Å²	39.8	34%	0.343	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	43.1	-178.7	-51.3	0	0	0	0	114.4	M158 D186 P214 N237	M158-S212 WeakPolarHBondContact CE-O 3.34Å; D186-S212 WeakPolarHBondContact OD1-CB 3.27Å; D186-S212 PolarHBondContact OD1-OG 3.4Å; D186-S212 VanDerWaalsContact OD1-OG 3.1Å; S212-P214 VanDerWaalsContact O-CD 3.29Å; S212-P214 WeakPolarHBondContact O-CD 3.26Å; S212-N237 WeakPolarHBondContact CA-OD1 3.31Å; S212-N237 PolarHBondContact N-OD1 2.77Å
213	C	96.2	Very high	97.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.228	C	C	.	.			trans	-105.8	89	176.2	-67.7	0	0	0	0	110.8	I184 V189 M210 S211 H215 V216	I184-C213 PolarHBondContact O-SG 3.21Å; I184-C213 VanDerWaalsContact O-SG 3.38Å; V189-C213 HydrophobicContact CG2-CB 3.77Å; V189-C213 VanDerWaalsContact CG2-SG 3.57Å; M210-C213 HydrophobicContact CE-CB 4.26Å; M210-C213 PolarHBondContact O-SG 2.89Å; S211-C213 PolarHBondContact O-N 2.83Å; C213-H215 VanDerWaalsContact C-N 3.26Å; C213-H215 PolarHBondContact O-N 3.45Å; C213-V216 HydrophobicContact CB-CG2 4.1Å; C213-V216 PolarHBondContact O-N 2.99Å
214	P	94.4	Very high	97.4	Very high	77 Å²	77	32.6 Å²	32.6	50%	0.5	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-11.6	-164.1	30.6	-37.5	0	0	0	114.7	M158 S212	M158-P214 HydrophobicContact CE-CG 3.89Å; M158-P214 HydrophobicContact SD-CG 4.27Å; S212-P214 VanDerWaalsContact O-CD 3.29Å; S212-P214 WeakPolarHBondContact O-CD 3.26Å
215	H	96.7	Very high	97.4	Very high	92 Å²	92	30.8 Å²	30.8	43%	0.426	18%	0.18	S	C	.	.	B	Isolated β-bridge	trans	-102.8	6.6	-178.9	-54.1	-46.1	0	0	0	113.2	V189 D190 C213	V189-H215 WeakPolarHBondContact O-CB 3.46Å; D190-H215 WeakPolarHBondContact CA-O 3.35Å; D190-H215 HydrophobicContact CB-CB 3.94Å; C213-H215 VanDerWaalsContact C-N 3.26Å; C213-H215 PolarHBondContact O-N 3.45Å
216	V	97.7	Very high	97.4	Very high	7 Å²	7	35 Å²	35	4%	0.042	20%	0.202	C	C	.	.			trans	-94.4	136	171.8	177.9	0	0	0	0	108.9	V189 D191 L194 M210 C213 L240	V189-V216 HydrophobicContact CG2-CG2 3.93Å; V189-V216 WeakPolarHBondContact O-CG2 3.49Å; D191-V216 VanDerWaalsContact OD1-CA 3.32Å; D191-V216 WeakPolarHBondContact OD1-CA 3.39Å; L194-V216 HydrophobicContact CD1-CB 4.49Å; L194-V216 HydrophobicContact CD1-CG1 3.69Å; L194-V216 HydrophobicContact CD1-CG2 3.97Å; M210-V216 HydrophobicContact CE-CB 3.98Å; M210-V216 HydrophobicContact CE-CG1 3.77Å; M210-V216 HydrophobicContact CE-CG2 3.6Å; C213-V216 HydrophobicContact CB-CG2 4.1Å; C213-V216 PolarHBondContact O-N 2.99Å; V216-L240 HydrophobicContact CB-CD1 4.4Å; V216-L240 HydrophobicContact CG1-CD1 4.12Å; V216-L240 HydrophobicContact CG1-CD2 4.37Å; V216-L240 VanDerWaalsContact O-CD2 3.31Å; V216-L240 WeakPolarHBondContact O-CD2 3.48Å
217	S	97.6	Very high	97.3	Very high	38 Å²	38	34 Å²	34	27%	0.266	20%	0.199	S	C	.	.			trans	-102.9	164.5	174.7	80.9	0	0	0	0	111.7	D191 A219 G220 I221	D191-S217 PolarHBondContact OD1-N 3.27Å; D191-S217 WeakPolarHBondContact OD2-CB 3.32Å; D191-S217 PolarHBondContact OD2-OG 3.35Å; S217-A219 PolarHBondContact O-N 2.83Å; S217-A219 PolarHBondContact OG-N 3.24Å; S217-G220 WeakPolarHBondContact O-CA 3.28Å; S217-G220 PolarHBondContact O-N 3.14Å; S217-G220 PolarHBondContact OG-N 3.02Å; S217-I221 PolarHBondContact O-N 3.33Å
218	P	97.7	Very high	97.3	Very high	56 Å²	56	33 Å²	33	36%	0.364	19%	0.194	S	C	.	.	H	α-helix	trans	-52.4	-34.6	169.7	-27.8	35.6	0	0	0	113.2	I221 L222 L240	P218-I221 VanDerWaalsContact O-CG2 3.28Å; P218-I221 WeakPolarHBondContact O-CG2 3.2Å; P218-L222 VanDerWaalsContact O-CB 3.28Å; P218-L222 WeakPolarHBondContact O-CB 3.37Å; P218-L222 PolarHBondContact O-N 3.26Å; P218-L240 HydrophobicContact CG-CD2 4.46Å
219	A	97.3	Very high	97.2	Very high	65 Å²	65	36.4 Å²	36.4	54%	0.537	21%	0.209	S	C	.	.	H	α-helix	trans	-69.7	-34.2	176.2	0	0	0	0	0	112.6	S217 C223	S217-A219 PolarHBondContact O-N 2.83Å; S217-A219 PolarHBondContact OG-N 3.24Å; A219-C223 PolarHBondContact O-N 3.05Å; A219-C223 VanDerWaalsContact O-N 3.16Å
220	G	97.6	Very high	97.2	Very high	2 Å²	2	35.1 Å²	35.1	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-62.6	-48.9	175.2	0	0	0	0	0	112.5	D191 S217 C223	D191-G220 VanDerWaalsContact CG-CA 3.45Å; D191-G220 WeakPolarHBondContact OD1-CA 3.49Å; S217-G220 WeakPolarHBondContact O-CA 3.28Å; S217-G220 PolarHBondContact O-N 3.14Å; S217-G220 PolarHBondContact OG-N 3.02Å; G220-C223 WeakPolarHBondContact O-CB 3.34Å; G220-C223 PolarHBondContact O-N 3.2Å
221	I	98.3	Very high	97.3	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-71.6	-34.3	179	-169.8	58.6	0	0	0	112.6	L208 M210 S217 P218 C223 V224 A225 L234 L236 L240 L245	L208-I221 HydrophobicContact CD2-CD1 4.18Å; M210-I221 HydrophobicContact SD-CD1 3.8Å; S217-I221 PolarHBondContact O-N 3.33Å; P218-I221 VanDerWaalsContact O-CG2 3.28Å; P218-I221 WeakPolarHBondContact O-CG2 3.2Å; I221-C223 VanDerWaalsContact C-N 3.28Å; I221-C223 PolarHBondContact O-N 3.42Å; I221-V224 HydrophobicContact CD1-CB 4.21Å; I221-V224 HydrophobicContact CD1-CG2 4.38Å; I221-V224 WeakPolarHBondContact O-CB 3.36Å; I221-V224 PolarHBondContact O-N 3.14Å; I221-A225 PolarHBondContact O-N 3.42Å; I221-L234 HydrophobicContact CD1-CD1 4.1Å; I221-L236 HydrophobicContact CD1-CD2 4.43Å; I221-L236 HydrophobicContact CG1-CD2 3.84Å; I221-L240 HydrophobicContact CG2-CB 4.17Å; I221-L245 HydrophobicContact CG1-CD1 4.21Å; I221-L245 HydrophobicContact CG1-CD2 4.27Å; I221-L245 HydrophobicContact CG2-CD1 4.43Å; I221-L245 HydrophobicContact CG2-CD2 4.09Å
222	L	98.4	Very high	97.5	Very high	41 Å²	41	38.9 Å²	38.9	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-59	-41.9	174.5	-176.3	62.9	0	0	0	111.2	P218 V224 A225 D226 E244 A248	P218-L222 VanDerWaalsContact O-CB 3.28Å; P218-L222 WeakPolarHBondContact O-CB 3.37Å; P218-L222 PolarHBondContact O-N 3.26Å; L222-V224 PolarHBondContact O-N 3.07Å; L222-A225 PolarHBondContact O-N 3.16Å; L222-A225 VanDerWaalsContact O-N 3.14Å; L222-D226 WeakPolarHBondContact O-CB 3.44Å; L222-D226 PolarHBondContact O-N 3.38Å; L222-E244 HydrophobicContact CD1-CB 4.05Å; L222-E244 HydrophobicContact CD2-CB 3.98Å; L222-A248 HydrophobicContact CD1-CB 3.76Å
223	C	97.9	Very high	97.7	Very high	23 Å²	23	39.3 Å²	39.3	16%	0.155	22%	0.221	C	C	.	.	H	α-helix	trans	-58.4	-32.3	174.9	178	0	0	0	0	113	A219 G220 I221 Q227	A219-C223 PolarHBondContact O-N 3.05Å; A219-C223 VanDerWaalsContact O-N 3.16Å; G220-C223 WeakPolarHBondContact O-CB 3.34Å; G220-C223 PolarHBondContact O-N 3.2Å; I221-C223 VanDerWaalsContact C-N 3.28Å; I221-C223 PolarHBondContact O-N 3.42Å; C223-Q227 PolarHBondContact SG-NE2 2.96Å; C223-Q227 VanDerWaalsContact SG-NE2 3.42Å
224	V	98.4	Very high	97.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-71	-51.1	174	-179.6	0	0	0	0	110.2	L194 V198 L205 L208 I221 L222 D226 Q227 C228	L194-V224 HydrophobicContact CB-CG2 4.09Å; L194-V224 HydrophobicContact CD1-CG2 4.23Å; L194-V224 HydrophobicContact CD2-CG2 4.48Å; V198-V224 HydrophobicContact CG2-CB 4.18Å; V198-V224 HydrophobicContact CG2-CG1 4.4Å; V198-V224 HydrophobicContact CG2-CG2 3.82Å; L205-V224 HydrophobicContact CD2-CG1 4.24Å; L208-V224 HydrophobicContact CD2-CG1 3.93Å; I221-V224 HydrophobicContact CD1-CB 4.21Å; I221-V224 HydrophobicContact CD1-CG2 4.38Å; I221-V224 WeakPolarHBondContact O-CB 3.36Å; I221-V224 PolarHBondContact O-N 3.14Å; L222-V224 PolarHBondContact O-N 3.07Å; V224-D226 VanDerWaalsContact C-N 3.3Å; V224-D226 PolarHBondContact O-N 3.23Å; V224-Q227 PolarHBondContact O-N 3.03Å; V224-C228 HydrophobicContact CG1-CB 4.2Å; V224-C228 WeakPolarHBondContact O-CB 3.47Å; V224-C228 PolarHBondContact O-N 2.71Å; V224-C228 PolarHBondContact O-SG 3.43Å
225	A	98.1	Very high	98	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-37	-178.7	0	0	0	0	0	113	I221 L222 Q227 L245 A248 L249	I221-A225 PolarHBondContact O-N 3.42Å; L222-A225 PolarHBondContact O-N 3.16Å; L222-A225 VanDerWaalsContact O-N 3.14Å; A225-Q227 VanDerWaalsContact C-N 3.31Å; A225-Q227 PolarHBondContact O-N 3.03Å; A225-L245 HydrophobicContact CB-CD1 3.56Å; A225-A248 HydrophobicContact CB-CB 4.05Å; A225-L249 HydrophobicContact CB-CD2 3.92Å; A225-L249 HydrophobicContact CB-CG 4.21Å
226	D	97.2	Very high	98.1	Very high	87 Å²	87	31.5 Å²	31.5	47%	0.465	18%	0.179	S	C	.	.	H	α-helix	trans	-68.8	-25.5	-179.9	-81.8	-21.3	0	0	0	114	L222 V224 H229 A248	L222-D226 WeakPolarHBondContact O-CB 3.44Å; L222-D226 PolarHBondContact O-N 3.38Å; V224-D226 VanDerWaalsContact C-N 3.3Å; V224-D226 PolarHBondContact O-N 3.23Å; D226-H229 PolarHBondContact O-NE2 2.9Å; D226-A248 WeakPolarHBondContact OD1-CB 3.42Å
227	Q	97.6	Very high	98.1	Very high	91 Å²	91	31.7 Å²	31.7	43%	0.425	18%	0.179	S	C	.	.	H	α-helix	trans	-114.2	-32.2	-172.6	-66.9	-172.6	63.7	0	0	113	V198 C223 V224 A225 H229	V198-Q227 HydrophobicContact CG1-CB 3.37Å; V198-Q227 HydrophobicContact CG1-CG 3.93Å; V198-Q227 VanDerWaalsContact CG1-OE1 3.3Å; C223-Q227 PolarHBondContact SG-NE2 2.96Å; C223-Q227 VanDerWaalsContact SG-NE2 3.42Å; V224-Q227 PolarHBondContact O-N 3.03Å; A225-Q227 VanDerWaalsContact C-N 3.31Å; A225-Q227 PolarHBondContact O-N 3.03Å; Q227-H229 VanDerWaalsContact C-N 3.29Å; Q227-H229 PolarHBondContact O-N 3.29Å; Q227-H229 PolarHBondContact O-ND1 2.99Å
228	C	98	Very high	98.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.			trans	-86.9	65	-179.2	-59.7	0	0	0	0	110.9	L205 V224 G230 L231	L205-C228 HydrophobicContact CD2-CB 4.4Å; V224-C228 HydrophobicContact CG1-CB 4.2Å; V224-C228 WeakPolarHBondContact O-CB 3.47Å; V224-C228 PolarHBondContact O-N 2.71Å; V224-C228 PolarHBondContact O-SG 3.43Å; C228-G230 PolarHBondContact O-N 3.2Å; C228-L231 VanDerWaalsContact O-CB 3.29Å; C228-L231 WeakPolarHBondContact O-CB 3.28Å; C228-L231 PolarHBondContact O-N 2.93Å
229	H	98	Very high	97.9	Very high	72 Å²	72	32 Å²	32	33%	0.333	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-15.3	-176.2	-53.5	118.8	0	0	0	114.6	D226 Q227 V255	D226-H229 PolarHBondContact O-NE2 2.9Å; Q227-H229 VanDerWaalsContact C-N 3.29Å; Q227-H229 PolarHBondContact O-N 3.29Å; Q227-H229 PolarHBondContact O-ND1 2.99Å; H229-V255 WeakPolarHBondContact O-CB 3.41Å; H229-V255 VanDerWaalsContact O-CG1 3.32Å; H229-V255 WeakPolarHBondContact O-CG1 3.27Å; H229-V255 PolarHBondContact O-N 3.1Å
230	G	98.4	Very high	97.9	Very high	26 Å²	26	28.9 Å²	28.9	27%	0.268	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-0.7	176.5	0	0	0	0	0	115.2	L205 C228 R232	L205-G230 CarbonylContact O-C 3.55Å; L205-G230 VanDerWaalsContact O-C 3.27Å; C228-G230 PolarHBondContact O-N 3.2Å; G230-R232 PolarHBondContact O-N 2.76Å
231	L	98.7	Very high	97.9	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	15%	0.145	C	C	.	.			trans	-65.3	125.7	-176.2	-168.4	70.6	0	0	0	111.2	L205 L208 C228 L234 L249 H254 V255 L257	L205-L231 HydrophobicContact CD2-CD1 4.48Å; L205-L231 HydrophobicContact CG-CD1 4.36Å; L205-L231 PolarHBondContact O-N 3.08Å; L208-L231 HydrophobicContact CB-CD1 4.07Å; C228-L231 VanDerWaalsContact O-CB 3.29Å; C228-L231 WeakPolarHBondContact O-CB 3.28Å; C228-L231 PolarHBondContact O-N 2.93Å; L231-L234 HydrophobicContact CD2-CB 4.25Å; L231-L234 HydrophobicContact CD2-CD1 4.46Å; L231-L234 HydrophobicContact CD2-CD2 4.38Å; L231-L249 HydrophobicContact CD2-CD2 4.26Å; L231-H254 PolarHBondContact O-CE1 2.82Å; L231-V255 WeakPolarHBondContact O-CG1 3.39Å; L231-L257 VanDerWaalsContact O-CD1 3.29Å; L231-L257 WeakPolarHBondContact O-CD1 3.28Å
232	R	98.7	Very high	97.9	Very high	88 Å²	88	29.5 Å²	29.5	33%	0.332	15%	0.15	S	C	.	.			trans	-114.9	-29.6	-178.7	-69.2	172.9	-177	-86.9	-5	112.4	K206 G230 V255 L257 E258 H259	K206-R232 PolarHBondContact O-N 2.95Å; G230-R232 PolarHBondContact O-N 2.76Å; R232-V255 HydrophobicContact CG-CG1 3.95Å; R232-L257 WeakPolarHBondContact O-CG 3.26Å; R232-E258 HydrophobicContact CB-CB 4.49Å; R232-E258 HydrophobicContact CB-CG 4.32Å; R232-E258 WeakPolarHBondContact CD-OE1 3.39Å; R232-E258 IonicContact CZ-OE1 3.9Å; R232-E258 IonicContact NE-OE1 2.95Å; R232-E258 IonicContact NH1-OE1 2.68Å; R232-E258 PolarHBondContact NH1-OE1 2.87Å; R232-E258 PolarHBondContact O-N 3.33Å; R232-H259 PolarHBondContact O-N 3.47Å; R232-H259 VanDerWaalsContact O-N 3.09Å
233	E	98.8	Very high	97.9	Very high	58 Å²	58	29 Å²	29	27%	0.271	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.6	-178.5	-58.7	-170.8	-155.6	0	0	111	K206 L207 L208 H259	K206-E233 PolarHBondContact O-N 3.15Å; L207-E233 WeakPolarHBondContact CA-O 3.43Å; L207-E233 HydrophobicContact CB-CB 4.18Å; L207-E233 HydrophobicContact CD1-CB 4.38Å; L207-E233 WeakPolarHBondContact CD1-OE2 3.44Å; L207-E233 HydrophobicContact CG-CB 3.95Å; L208-E233 PolarHBondContact N-O 2.94Å; E233-H259 VanDerWaalsContact CA-O 3.29Å; E233-H259 WeakPolarHBondContact CA-O 3.46Å; E233-H259 HydrophobicContact CB-CB 4.12Å; E233-H259 HydrophobicContact CG-CB 3.74Å
234	L	98.9	Very high	97.9	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.4	176.8	-178.4	58.9	0	0	0	110.6	L208 I221 L231 L236 L249 H259 L260 R261	L208-L234 HydrophobicContact CB-CD1 4.12Å; L208-L234 HydrophobicContact CD2-CD1 4.23Å; L208-L234 HydrophobicContact CG-CD1 4.23Å; L208-L234 CarbonylContact O-C 3.29Å; L208-L234 VanDerWaalsContact O-CA 3.31Å; L208-L234 WeakPolarHBondContact O-CA 3.42Å; I221-L234 HydrophobicContact CD1-CD1 4.1Å; L231-L234 HydrophobicContact CD2-CB 4.25Å; L231-L234 HydrophobicContact CD2-CD1 4.46Å; L231-L234 HydrophobicContact CD2-CD2 4.38Å; L234-L236 HydrophobicContact CD1-CD2 4.12Å; L234-L236 HydrophobicContact CD2-CD2 3.63Å; L234-L236 HydrophobicContact CG-CD2 3.82Å; L234-L236 HydrophobicContact CG-CG 4.33Å; L234-L249 HydrophobicContact CD2-CD1 4.17Å; L234-H259 PolarHBondContact N-O 2.88Å; L234-L260 HydrophobicContact CB-CD1 4Å; L234-L260 HydrophobicContact CD2-CD1 4.19Å; L234-L260 HydrophobicContact CG-CD1 4.17Å; L234-L260 CarbonylContact O-C 3.55Å; L234-L260 WeakPolarHBondContact O-CA 3.29Å; L234-R261 PolarHBondContact O-N 2.75Å
235	A	98.8	Very high	98	Very high	3 Å²	3	33.2 Å²	33.2	3%	0.025	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	128.8	169.5	0	0	0	0	0	110.8	L208 K209 M210 R261	L208-A235 PolarHBondContact O-N 3.15Å; K209-A235 HydrophobicContact CB-CB 4.08Å; K209-A235 HydrophobicContact CD-CB 4.4Å; K209-A235 HydrophobicContact CG-CB 3.84Å; M210-A235 PolarHBondContact N-O 2.85Å; A235-R261 WeakPolarHBondContact CA-O 3.4Å; A235-R261 HydrophobicContact CB-CB 3.85Å; A235-R261 HydrophobicContact CB-CG 4.3Å
236	L	98.3	Very high	98	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	169.7	-176.6	53.4	78.5	0	0	0	111.9	I221 L234 L240 L241 L245 R261 I262 D263	I221-L236 HydrophobicContact CD1-CD2 4.43Å; I221-L236 HydrophobicContact CG1-CD2 3.84Å; L234-L236 HydrophobicContact CD1-CD2 4.12Å; L234-L236 HydrophobicContact CD2-CD2 3.63Å; L234-L236 HydrophobicContact CG-CD2 3.82Å; L234-L236 HydrophobicContact CG-CG 4.33Å; L236-L240 HydrophobicContact CB-CD1 4.36Å; L236-L240 HydrophobicContact CD1-CB 4.31Å; L236-L241 HydrophobicContact CD1-CB 4.28Å; L236-L245 HydrophobicContact CD2-CD2 3.86Å; L236-R261 PolarHBondContact N-O 2.97Å; L236-R261 VanDerWaalsContact N-O 3.15Å; L236-I262 HydrophobicContact CD1-CD1 3.51Å; L236-I262 HydrophobicContact CG-CD1 4.28Å; L236-I262 WeakPolarHBondContact O-CA 3.42Å; L236-D263 PolarHBondContact O-N 3.37Å
237	N	97.5	Very high	98	Very high	11 Å²	11	33.3 Å²	33.3	6%	0.059	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	152.4	172	-59.7	94.1	0	0	0	112.7	S212 H239 L240 D263	S212-N237 WeakPolarHBondContact CA-OD1 3.31Å; S212-N237 PolarHBondContact N-OD1 2.77Å; N237-H239 WeakPolarHBondContact CB-CE1 3.36Å; N237-H239 VanDerWaalsContact CB-ND1 3.29Å; N237-H239 WeakPolarHBondContact CB-ND1 3.47Å; N237-H239 PolarHBondContact O-N 3.01Å; N237-H239 VanDerWaalsContact O-N 3.14Å; N237-L240 PolarHBondContact O-N 3.03Å; N237-D263 CarbonylContact C-O 3.43Å; N237-D263 VanDerWaalsContact CA-O 3.26Å; N237-D263 WeakPolarHBondContact CA-O 3.27Å
238	Y	97.1	Very high	98.1	Very high	8 Å²	8	29.3 Å²	29.3	3%	0.031	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-55.3	-33.9	179.3	-172.8	-96.6	0	0	0	114.3	L240 L241 I262 D263 V264 F274 H275 I277 F308	Y238-L240 PolarHBondContact O-N 3.49Å; Y238-L240 VanDerWaalsContact O-N 3.1Å; Y238-L241 HydrophobicContact CD2-CD2 3.98Å; Y238-L241 HydrophobicContact CE2-CD2 3.91Å; Y238-L241 WeakPolarHBondContact O-CB 3.34Å; Y238-L241 PolarHBondContact O-N 3.23Å; Y238-I262 HydrophobicContact CD2-CG2 3.88Å; Y238-I262 HydrophobicContact CG-CG2 4.41Å; Y238-D263 PolarHBondContact N-O 3.31Å; Y238-V264 HydrophobicContact CD2-CG2 4.21Å; Y238-V264 HydrophobicContact CG-CG1 4.13Å; Y238-V264 HydrophobicContact CG-CG2 4.33Å; Y238-F274 HydrophobicContact CD1-CB 4.5Å; Y238-F274 AromaticContact CD1-CD1 3.76Å; Y238-F274 HydrophobicContact CD1-CD1 3.76Å; Y238-F274 HydrophobicContact CE1-CB 4.07Å; Y238-F274 HydrophobicContact CE1-CD1 4.19Å; Y238-H275 AromaticContact CD1-CE1 3.71Å; Y238-H275 AromaticContact CE1-CE1 3.46Å; Y238-H275 VanDerWaalsContact CE1-CE1 3.46Å; Y238-H275 WeakPolarHBondContact CE1-CE1 3.36Å; Y238-H275 AromaticContact CE1-ND1 3.65Å; Y238-H275 AromaticContact CE1-NE2 3.92Å; Y238-H275 WeakPolarHBondContact CE1-O 3.47Å; Y238-H275 PolarHBondContact O-CE1 3.48Å; Y238-H275 VanDerWaalsContact O-CE1 3.29Å; Y238-H275 PolarHBondContact OH-O 3.3Å; Y238-I277 HydrophobicContact CE2-CG1 4.49Å; Y238-F308 HydrophobicContact CD1-CE1 4.49Å; Y238-F308 HydrophobicContact CD1-CZ 4.31Å; Y238-F308 HydrophobicContact CD2-CE1 4.03Å; Y238-F308 HydrophobicContact CE1-CE1 4.06Å; Y238-F308 HydrophobicContact CE1-CZ 4.02Å; Y238-F308 AromaticContact CE2-CE1 3.58Å; Y238-F308 HydrophobicContact CE2-CE1 3.58Å; Y238-F308 HydrophobicContact CE2-CZ 4.32Å; Y238-F308 HydrophobicContact CG-CE1 4.47Å; Y238-F308 AromaticContact CZ-CE1 3.58Å
239	H	94.1	Very high	98.1	Very high	91 Å²	91	29.3 Å²	29.3	42%	0.421	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-62.9	-17.7	179.3	70.8	-98.5	0	0	0	113.8	N237	N237-H239 WeakPolarHBondContact CB-CE1 3.36Å; N237-H239 VanDerWaalsContact CB-ND1 3.29Å; N237-H239 WeakPolarHBondContact CB-ND1 3.47Å; N237-H239 PolarHBondContact O-N 3.01Å; N237-H239 VanDerWaalsContact O-N 3.14Å
240	L	97.3	Very high	98.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-93.9	-14.6	174.1	-58.6	-179.8	0	0	0	113.2	V216 P218 I221 L236 N237 Y238	V216-L240 HydrophobicContact CB-CD1 4.4Å; V216-L240 HydrophobicContact CG1-CD1 4.12Å; V216-L240 HydrophobicContact CG1-CD2 4.37Å; V216-L240 VanDerWaalsContact O-CD2 3.31Å; V216-L240 WeakPolarHBondContact O-CD2 3.48Å; P218-L240 HydrophobicContact CG-CD2 4.46Å; I221-L240 HydrophobicContact CG2-CB 4.17Å; L236-L240 HydrophobicContact CB-CD1 4.36Å; L236-L240 HydrophobicContact CD1-CB 4.31Å; N237-L240 PolarHBondContact O-N 3.03Å; Y238-L240 PolarHBondContact O-N 3.49Å; Y238-L240 VanDerWaalsContact O-N 3.1Å
241	L	97.9	Very high	98.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.139	C	C	.	.			trans	-73.6	126.9	177.7	-177.4	65.9	0	0	0	109.2	L236 Y238 L245 L246 I262 H275 I277 W282	L236-L241 HydrophobicContact CD1-CB 4.28Å; Y238-L241 HydrophobicContact CD2-CD2 3.98Å; Y238-L241 HydrophobicContact CE2-CD2 3.91Å; Y238-L241 WeakPolarHBondContact O-CB 3.34Å; Y238-L241 PolarHBondContact O-N 3.23Å; L241-L245 HydrophobicContact CD1-CD2 4.33Å; L241-L246 HydrophobicContact CD1-CD2 3.91Å; L241-L246 HydrophobicContact CD1-CG 3.97Å; L241-I262 HydrophobicContact CD1-CD1 4.07Å; L241-I262 HydrophobicContact CD2-CD1 4.13Å; L241-I262 HydrophobicContact CD2-CG1 4.29Å; L241-I262 HydrophobicContact CD2-CG2 4.38Å; L241-I262 HydrophobicContact CG-CD1 4.48Å; L241-H275 PolarHBondContact O-CE1 3.37Å; L241-H275 PolarHBondContact O-NE2 3.21Å; L241-I277 HydrophobicContact CD2-CD1 4.42Å; L241-I277 HydrophobicContact CD2-CG1 4.07Å; L241-I277 HydrophobicContact CG-CD1 4.05Å; L241-I277 HydrophobicContact CG-CG1 4.24Å; L241-W282 HydrophobicContact CD2-CH2 3.92Å; L241-W282 HydrophobicContact CD2-CZ2 3.99Å
242	S	98.1	Very high	98	Very high	16 Å²	16	37 Å²	37	11%	0.112	18%	0.183	C	C	.	.			trans	-138.2	167.8	175.7	84.8	0	0	0	0	111.7	E244 L245 L246	S242-E244 VanDerWaalsContact C-N 3.3Å; S242-E244 VanDerWaalsContact CB-OE2 3.23Å; S242-E244 WeakPolarHBondContact CB-OE2 3.21Å; S242-E244 PolarHBondContact OG-N 3.12Å; S242-E244 PolarHBondContact OG-OE2 2.89Å; S242-L245 PolarHBondContact O-N 3.25Å; S242-L245 PolarHBondContact OG-N 3.44Å; S242-L245 VanDerWaalsContact OG-N 3.14Å; S242-L246 PolarHBondContact O-N 3.3Å; S242-L246 VanDerWaalsContact O-N 3.08Å
243	D	98.6	Very high	97.9	Very high	29 Å²	29	40.7 Å²	40.7	16%	0.155	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-43.6	172.7	-71.8	-61.1	0	0	0	111	L245 L246 L247 I277 Q278 S281	D243-L245 VanDerWaalsContact C-N 3.31Å; D243-L245 PolarHBondContact O-N 3.03Å; D243-L246 PolarHBondContact O-N 2.8Å; D243-L247 WeakPolarHBondContact O-CB 3.46Å; D243-L247 WeakPolarHBondContact O-CG 3.44Å; D243-L247 PolarHBondContact O-N 2.93Å; D243-I277 WeakPolarHBondContact OD1-CG2 3.31Å; D243-Q278 WeakPolarHBondContact OD1-CB 3.16Å; D243-Q278 PolarHBondContact OD1-N 3.36Å; D243-S281 WeakPolarHBondContact CB-OG 3.49Å; D243-S281 WeakPolarHBondContact OD1-CB 3.47Å; D243-S281 PolarHBondContact OD1-OG 2.87Å
244	E	98.6	Very high	97.8	Very high	112 Å²	112	38.2 Å²	38.2	52%	0.523	19%	0.19	S	C	.	.	H	α-helix	trans	-60.4	-41.8	177.1	-57.8	74.1	-160.8	0	0	111.4	L222 S242 L247 A248	L222-E244 HydrophobicContact CD1-CB 4.05Å; L222-E244 HydrophobicContact CD2-CB 3.98Å; S242-E244 VanDerWaalsContact C-N 3.3Å; S242-E244 VanDerWaalsContact CB-OE2 3.23Å; S242-E244 WeakPolarHBondContact CB-OE2 3.21Å; S242-E244 PolarHBondContact OG-N 3.12Å; S242-E244 PolarHBondContact OG-OE2 2.89Å; E244-L247 PolarHBondContact O-N 3.31Å; E244-A248 WeakPolarHBondContact O-CB 3.3Å; E244-A248 PolarHBondContact O-N 2.81Å
245	L	98.7	Very high	97.8	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-47.5	177.9	-179.4	62.2	0	0	0	111.5	I221 A225 L236 L241 S242 D243 L247 A248 L249	I221-L245 HydrophobicContact CG1-CD1 4.21Å; I221-L245 HydrophobicContact CG1-CD2 4.27Å; I221-L245 HydrophobicContact CG2-CD1 4.43Å; I221-L245 HydrophobicContact CG2-CD2 4.09Å; A225-L245 HydrophobicContact CB-CD1 3.56Å; L236-L245 HydrophobicContact CD2-CD2 3.86Å; L241-L245 HydrophobicContact CD1-CD2 4.33Å; S242-L245 PolarHBondContact O-N 3.25Å; S242-L245 PolarHBondContact OG-N 3.44Å; S242-L245 VanDerWaalsContact OG-N 3.14Å; D243-L245 VanDerWaalsContact C-N 3.31Å; D243-L245 PolarHBondContact O-N 3.03Å; L245-L247 VanDerWaalsContact C-N 3.3Å; L245-L247 PolarHBondContact O-N 3.17Å; L245-A248 PolarHBondContact O-N 3.43Å; L245-L249 HydrophobicContact CD1-CD1 4.3Å; L245-L249 HydrophobicContact CD1-CG 4.41Å; L245-L249 HydrophobicContact CG-CD1 4.16Å; L245-L249 VanDerWaalsContact O-CG 3.29Å; L245-L249 WeakPolarHBondContact O-CG 3.31Å; L245-L249 PolarHBondContact O-N 2.76Å
246	L	98.5	Very high	97.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.3	-40.1	177.5	-74.4	-177.3	0	0	0	111.6	L241 S242 D243 L249 S250 L260 I277 W282 F285	L241-L246 HydrophobicContact CD1-CD2 3.91Å; L241-L246 HydrophobicContact CD1-CG 3.97Å; S242-L246 PolarHBondContact O-N 3.3Å; S242-L246 VanDerWaalsContact O-N 3.08Å; D243-L246 PolarHBondContact O-N 2.8Å; L246-L249 PolarHBondContact O-N 2.86Å; L246-S250 VanDerWaalsContact O-CB 3.31Å; L246-S250 WeakPolarHBondContact O-CB 3.33Å; L246-S250 PolarHBondContact O-N 3.03Å; L246-S250 PolarHBondContact O-OG 3.08Å; L246-L260 HydrophobicContact CD2-CD2 4.09Å; L246-I277 HydrophobicContact CD1-CG2 3.58Å; L246-W282 HydrophobicContact CD1-CD2 3.86Å; L246-W282 HydrophobicContact CD1-CE3 3.79Å; L246-W282 HydrophobicContact CD1-CG 4.48Å; L246-W282 HydrophobicContact CD1-CH2 4.14Å; L246-W282 HydrophobicContact CD1-CZ2 4.21Å; L246-W282 HydrophobicContact CD1-CZ3 3.91Å; L246-W282 HydrophobicContact CD2-CZ3 4.1Å; L246-F285 HydrophobicContact CD2-CB 4.48Å; L246-F285 HydrophobicContact CD2-CD2 4.16Å; L246-F285 HydrophobicContact CD2-CG 4.17Å
247	L	98.6	Very high	97.8	Very high	89 Å²	89	47.8 Å²	47.8	47%	0.466	23%	0.23	S	C	.	.	H	α-helix	trans	-67	-39.8	177.4	-68.5	172.1	0	0	0	112.1	D243 E244 L245 S250 S251 A284	D243-L247 WeakPolarHBondContact O-CB 3.46Å; D243-L247 WeakPolarHBondContact O-CG 3.44Å; D243-L247 PolarHBondContact O-N 2.93Å; E244-L247 PolarHBondContact O-N 3.31Å; L245-L247 VanDerWaalsContact C-N 3.3Å; L245-L247 PolarHBondContact O-N 3.17Å; L247-S250 CarbonylContact O-C 3.54Å; L247-S250 WeakPolarHBondContact O-CA 3.49Å; L247-S250 PolarHBondContact O-N 3.21Å; L247-S250 VanDerWaalsContact O-N 3.07Å; L247-S251 PolarHBondContact O-N 3.49Å; L247-S251 VanDerWaalsContact O-N 3.13Å; L247-A284 HydrophobicContact CD2-CB 3.94Å
248	A	98.6	Very high	97.9	Very high	8 Å²	8	51.4 Å²	51.4	7%	0.066	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-46.7	174.8	0	0	0	0	0	111.7	L222 A225 D226 E244 L245 S250 S251	L222-A248 HydrophobicContact CD1-CB 3.76Å; A225-A248 HydrophobicContact CB-CB 4.05Å; D226-A248 WeakPolarHBondContact OD1-CB 3.42Å; E244-A248 WeakPolarHBondContact O-CB 3.3Å; E244-A248 PolarHBondContact O-N 2.81Å; L245-A248 PolarHBondContact O-N 3.43Å; A248-S250 PolarHBondContact O-N 3.2Å; A248-S251 WeakPolarHBondContact O-CB 3.4Å; A248-S251 PolarHBondContact O-N 2.77Å; A248-S251 VanDerWaalsContact O-N 3.16Å; A248-S251 PolarHBondContact O-OG 3.36Å
249	L	98.6	Very high	97.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.2	-18.5	174.4	-66	171.6	0	0	0	113.3	A225 L231 L234 L245 L246 H254 L257 H288	A225-L249 HydrophobicContact CB-CD2 3.92Å; A225-L249 HydrophobicContact CB-CG 4.21Å; L231-L249 HydrophobicContact CD2-CD2 4.26Å; L234-L249 HydrophobicContact CD2-CD1 4.17Å; L245-L249 HydrophobicContact CD1-CD1 4.3Å; L245-L249 HydrophobicContact CD1-CG 4.41Å; L245-L249 HydrophobicContact CG-CD1 4.16Å; L245-L249 VanDerWaalsContact O-CG 3.29Å; L245-L249 WeakPolarHBondContact O-CG 3.31Å; L245-L249 PolarHBondContact O-N 2.76Å; L246-L249 PolarHBondContact O-N 2.86Å; L249-H254 WeakPolarHBondContact CD2-NE2 3.39Å; L249-L257 HydrophobicContact CD1-CD2 4.33Å; L249-L257 HydrophobicContact CD2-CD1 4.36Å; L249-H288 PolarHBondContact O-CD2 2.57Å
250	S	98.5	Very high	98.2	Very high	21 Å²	21	49.2 Å²	49.2	15%	0.147	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	4	178.7	-52.7	0	0	0	0	113.6	L246 L247 A248 F285	L246-S250 VanDerWaalsContact O-CB 3.31Å; L246-S250 WeakPolarHBondContact O-CB 3.33Å; L246-S250 PolarHBondContact O-N 3.03Å; L246-S250 PolarHBondContact O-OG 3.08Å; L247-S250 CarbonylContact O-C 3.54Å; L247-S250 WeakPolarHBondContact O-CA 3.49Å; L247-S250 PolarHBondContact O-N 3.21Å; L247-S250 VanDerWaalsContact O-N 3.07Å; A248-S250 PolarHBondContact O-N 3.2Å; S250-F285 WeakPolarHBondContact OG-CA 3.12Å; S250-F285 PolarHBondContact OG-N 3.19Å
251	S	97.8	Very high	98.2	Very high	42 Å²	42	52.8 Å²	52.8	29%	0.294	25%	0.25	S	C	.	.	S	Bend	trans	-70.6	152.6	-178.9	71.6	0	0	0	0	111.7	L247 A248 K253 H254 H288	L247-S251 PolarHBondContact O-N 3.49Å; L247-S251 VanDerWaalsContact O-N 3.13Å; A248-S251 WeakPolarHBondContact O-CB 3.4Å; A248-S251 PolarHBondContact O-N 2.77Å; A248-S251 VanDerWaalsContact O-N 3.16Å; A248-S251 PolarHBondContact O-OG 3.36Å; S251-K253 PolarHBondContact O-N 3.1Å; S251-K253 VanDerWaalsContact O-N 3.13Å; S251-H254 WeakPolarHBondContact O-CB 3.39Å; S251-H254 PolarHBondContact O-N 3.18Å; S251-H288 PolarHBondContact O-CE1 3.2Å; S251-H288 VanDerWaalsContact O-CE1 3.27Å
252	E	96.3	Very high	98.3	Very high	198 Å²	198	52.7 Å²	52.7	93%	0.925	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.4	-179	-64	-173.7	165.2	0	0	113.7	H254	E252-H254 VanDerWaalsContact C-N 3.34Å
253	K	96.2	Very high	98.3	Very high	165 Å²	165	52.5 Å²	52.5	72%	0.717	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-29	176.9	-64	-178.9	-178	175.5	0	112.1	S251	S251-K253 PolarHBondContact O-N 3.1Å; S251-K253 VanDerWaalsContact O-N 3.13Å
254	H	98.1	Very high	98.2	Very high	6 Å²	6	51.1 Å²	51.1	3%	0.028	24%	0.239	C	C	.	.	S	Bend	trans	-77.7	140.8	-173.5	-159.3	-77.2	0	0	0	110.7	L231 L249 S251 E252 H288	L231-H254 PolarHBondContact O-CE1 2.82Å; L249-H254 WeakPolarHBondContact CD2-NE2 3.39Å; S251-H254 WeakPolarHBondContact O-CB 3.39Å; S251-H254 PolarHBondContact O-N 3.18Å; E252-H254 VanDerWaalsContact C-N 3.34Å; H254-H288 PolarHBondContact O-CE1 3.26Å; H254-H288 PolarHBondContact O-NE2 3.19Å
255	V	98.3	Very high	97.9	Very high	36 Å²	36	48.5 Å²	48.5	22%	0.218	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-63.3	159.9	172	71.8	0	0	0	0	110.6	H229 L231 R232 L257 H288	H229-V255 WeakPolarHBondContact O-CB 3.41Å; H229-V255 VanDerWaalsContact O-CG1 3.32Å; H229-V255 WeakPolarHBondContact O-CG1 3.27Å; H229-V255 PolarHBondContact O-N 3.1Å; L231-V255 WeakPolarHBondContact O-CG1 3.39Å; R232-V255 HydrophobicContact CG-CG1 3.95Å; V255-L257 PolarHBondContact O-N 3.42Å; V255-H288 PolarHBondContact O-NE2 2.77Å
256	R	98.3	Very high	97.5	Very high	166 Å²	166	48.7 Å²	48.7	63%	0.626	23%	0.232	S	C	*	.	P	Polyproline II helix	trans	-65.6	125.1	171.5	-69.4	-174	171.1	90.6	1.9	109.8	H288 S289	R256-H288 PolarHBondContact NE-O 3.45Å; R256-S289 WeakPolarHBondContact CA-OG 3.25Å
257	L	98.5	Very high	96.3	Very high	4 Å²	4	56 Å²	56	2%	0.021	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-73.2	138.7	177.8	-145.7	72.5	0	0	0	109.7	L231 R232 L249 V255 L260 F285 S289 V292	L231-L257 VanDerWaalsContact O-CD1 3.29Å; L231-L257 WeakPolarHBondContact O-CD1 3.28Å; R232-L257 WeakPolarHBondContact O-CG 3.26Å; L249-L257 HydrophobicContact CD1-CD2 4.33Å; L249-L257 HydrophobicContact CD2-CD1 4.36Å; V255-L257 PolarHBondContact O-N 3.42Å; L257-L260 HydrophobicContact CD2-CB 3.98Å; L257-F285 HydrophobicContact CB-CE2 4.28Å; L257-F285 HydrophobicContact CD2-CE2 3.7Å; L257-F285 HydrophobicContact CD2-CZ 3.81Å; L257-S289 PolarHBondContact N-OG 3.15Å; L257-V292 HydrophobicContact CB-CG2 4.12Å; L257-V292 WeakPolarHBondContact O-CB 3.44Å
258	E	98.6	Very high	95.2	Very high	87 Å²	87	55.8 Å²	55.8	41%	0.407	27%	0.266	S	S	.	.			trans	-103.1	-37.7	-178.4	-65.5	175.3	-163.5	0	0	110.6	R232 N293	R232-E258 HydrophobicContact CB-CB 4.49Å; R232-E258 HydrophobicContact CB-CG 4.32Å; R232-E258 WeakPolarHBondContact CD-OE1 3.39Å; R232-E258 IonicContact CZ-OE1 3.9Å; R232-E258 IonicContact NE-OE1 2.95Å; R232-E258 IonicContact NH1-OE1 2.68Å; R232-E258 PolarHBondContact NH1-OE1 2.87Å; R232-E258 PolarHBondContact O-N 3.33Å; E258-N293 PolarHBondContact O-N 3Å; E258-N293 PolarHBondContact O-ND2 3.34Å
259	H	98.8	Very high	93.7	Very high	53 Å²	53	59 Å²	59	25%	0.245	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	126.9	-178.5	-159.3	121.6	0	0	0	111.5	R232 E233 L234 N293 V295	R232-H259 PolarHBondContact O-N 3.47Å; R232-H259 VanDerWaalsContact O-N 3.09Å; E233-H259 VanDerWaalsContact CA-O 3.29Å; E233-H259 WeakPolarHBondContact CA-O 3.46Å; E233-H259 HydrophobicContact CB-CB 4.12Å; E233-H259 HydrophobicContact CG-CB 3.74Å; L234-H259 PolarHBondContact N-O 2.88Å; H259-N293 WeakPolarHBondContact CA-O 3.46Å; H259-V295 WeakPolarHBondContact NE2-CG2 3.4Å
260	L	98.8	Very high	92.1	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	117.5	166.1	-179.7	59	0	0	0	108.4	L234 L246 L257 I262 F285 N293 L294 V295	L234-L260 HydrophobicContact CB-CD1 4Å; L234-L260 HydrophobicContact CD2-CD1 4.19Å; L234-L260 HydrophobicContact CG-CD1 4.17Å; L234-L260 CarbonylContact O-C 3.55Å; L234-L260 WeakPolarHBondContact O-CA 3.29Å; L246-L260 HydrophobicContact CD2-CD2 4.09Å; L257-L260 HydrophobicContact CD2-CB 3.98Å; L260-I262 HydrophobicContact CD1-CD1 3.79Å; L260-I262 HydrophobicContact CD2-CD1 4.26Å; L260-I262 HydrophobicContact CG-CD1 3.88Å; L260-I262 HydrophobicContact CG-CG1 4.2Å; L260-F285 HydrophobicContact CB-CZ 4.1Å; L260-F285 HydrophobicContact CD2-CE1 4.07Å; L260-F285 HydrophobicContact CD2-CE2 4.29Å; L260-F285 HydrophobicContact CD2-CZ 3.67Å; L260-N293 PolarHBondContact N-O 3.36Å; L260-L294 HydrophobicContact CB-CD1 4.16Å; L260-L294 HydrophobicContact CD2-CD1 4.01Å; L260-L294 HydrophobicContact CG-CD1 3.98Å; L260-L294 CarbonylContact O-C 3.56Å; L260-L294 WeakPolarHBondContact O-CA 3.48Å; L260-V295 PolarHBondContact O-N 3.39Å
261	R	98.8	Very high	90.6	Very high	74 Å²	74	68.6 Å²	68.6	28%	0.279	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.5	173.8	173.9	174.9	168.9	171.4	-10.2	110.2	L234 A235 L236 D263 V295	L234-R261 PolarHBondContact O-N 2.75Å; A235-R261 WeakPolarHBondContact CA-O 3.4Å; A235-R261 HydrophobicContact CB-CB 3.85Å; A235-R261 HydrophobicContact CB-CG 4.3Å; L236-R261 PolarHBondContact N-O 2.97Å; L236-R261 VanDerWaalsContact N-O 3.15Å; R261-D263 IonicContact CZ-OD1 2.89Å; R261-D263 IonicContact CZ-OD2 2.67Å; R261-D263 IonicContact NE-OD1 2.79Å; R261-D263 PolarHBondContact NE-OD1 3.19Å; R261-D263 IonicContact NE-OD2 3.34Å; R261-D263 IonicContact NH2-OD1 3.74Å; R261-D263 PolarHBondContact NH2-OD1 3.18Å; R261-D263 IonicContact NH2-OD2 2.85Å; R261-D263 PolarHBondContact NH2-OD2 3.04Å; R261-V295 CarbonylContact C-O 3.43Å; R261-V295 VanDerWaalsContact CA-O 3.31Å; R261-V295 WeakPolarHBondContact CA-O 3.18Å; R261-V295 HydrophobicContact CB-CB 4.28Å; R261-V295 HydrophobicContact CG-CB 4.4Å; R261-V295 HydrophobicContact CG-CG1 4.42Å
262	I	98.6	Very high	89.5	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.1	178.3	-50.7	-64.2	0	0	0	109.5	L236 Y238 L241 L260 V264 L294 V295 M296 Y297	L236-I262 HydrophobicContact CD1-CD1 3.51Å; L236-I262 HydrophobicContact CG-CD1 4.28Å; L236-I262 WeakPolarHBondContact O-CA 3.42Å; Y238-I262 HydrophobicContact CD2-CG2 3.88Å; Y238-I262 HydrophobicContact CG-CG2 4.41Å; L241-I262 HydrophobicContact CD1-CD1 4.07Å; L241-I262 HydrophobicContact CD2-CD1 4.13Å; L241-I262 HydrophobicContact CD2-CG1 4.29Å; L241-I262 HydrophobicContact CD2-CG2 4.38Å; L241-I262 HydrophobicContact CG-CD1 4.48Å; L260-I262 HydrophobicContact CD1-CD1 3.79Å; L260-I262 HydrophobicContact CD2-CD1 4.26Å; L260-I262 HydrophobicContact CG-CD1 3.88Å; L260-I262 HydrophobicContact CG-CG1 4.2Å; I262-V264 HydrophobicContact CG2-CG2 4.22Å; I262-L294 HydrophobicContact CG1-CD1 4.11Å; I262-V295 PolarHBondContact N-O 3.2Å; I262-M296 HydrophobicContact CB-CE 4.32Å; I262-M296 HydrophobicContact CB-CG 4.27Å; I262-M296 HydrophobicContact CG2-CE 4.3Å; I262-M296 WeakPolarHBondContact O-CA 3.18Å; I262-Y297 PolarHBondContact O-N 2.97Å
263	D	97.9	Very high	88.8	Confident	11 Å²	11	68.4 Å²	68.4	6%	0.059	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.3	173.2	-62.1	-44.1	0	0	0	109.6	S211 L236 N237 Y238 R261 V265	S211-D263 VanDerWaalsContact CB-OD2 3.25Å; S211-D263 WeakPolarHBondContact CB-OD2 3.39Å; S211-D263 PolarHBondContact OG-OD2 3Å; L236-D263 PolarHBondContact O-N 3.37Å; N237-D263 CarbonylContact C-O 3.43Å; N237-D263 VanDerWaalsContact CA-O 3.26Å; N237-D263 WeakPolarHBondContact CA-O 3.27Å; Y238-D263 PolarHBondContact N-O 3.31Å; R261-D263 IonicContact CZ-OD1 2.89Å; R261-D263 IonicContact CZ-OD2 2.67Å; R261-D263 IonicContact NE-OD1 2.79Å; R261-D263 PolarHBondContact NE-OD1 3.19Å; R261-D263 IonicContact NE-OD2 3.34Å; R261-D263 IonicContact NH2-OD1 3.74Å; R261-D263 PolarHBondContact NH2-OD1 3.18Å; R261-D263 IonicContact NH2-OD2 2.85Å; R261-D263 PolarHBondContact NH2-OD2 3.04Å; D263-V265 HydrophobicContact CB-CG2 4.4Å
264	V	96.8	Very high	88.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	98.7	179.2	-159.4	0	0	0	0	108.1	Y238 I262 F274 M296 Y297 F298 F299 L300 F308	Y238-V264 HydrophobicContact CD2-CG2 4.21Å; Y238-V264 HydrophobicContact CG-CG1 4.13Å; Y238-V264 HydrophobicContact CG-CG2 4.33Å; I262-V264 HydrophobicContact CG2-CG2 4.22Å; V264-F274 HydrophobicContact CG1-CD1 4.19Å; V264-F274 HydrophobicContact CG1-CE1 3.89Å; V264-F274 HydrophobicContact CG1-CZ 4.34Å; V264-M296 HydrophobicContact CG2-CE 4.03Å; V264-Y297 WeakPolarHBondContact CA-O 3.36Å; V264-Y297 WeakPolarHBondContact CB-O 3.29Å; V264-Y297 PolarHBondContact N-O 3.24Å; V264-F298 HydrophobicContact CB-CD1 3.75Å; V264-F298 HydrophobicContact CB-CE1 4Å; V264-F298 HydrophobicContact CB-CG 4.31Å; V264-F298 HydrophobicContact CG1-CD1 4.02Å; V264-F298 HydrophobicContact CG1-CE1 4.09Å; V264-F298 HydrophobicContact CG2-CD1 3.86Å; V264-F298 HydrophobicContact CG2-CE1 3.67Å; V264-F298 HydrophobicContact CG2-CE2 4.43Å; V264-F298 HydrophobicContact CG2-CG 4.34Å; V264-F298 HydrophobicContact CG2-CZ 3.98Å; V264-F299 PolarHBondContact O-N 3.1Å; V264-L300 HydrophobicContact CG1-CD1 4.03Å; V264-L300 HydrophobicContact CG1-CD2 4.04Å; V264-L300 HydrophobicContact CG1-CG 4.3Å; V264-F308 HydrophobicContact CG1-CE1 4.09Å; V264-F308 HydrophobicContact CG1-CE2 4.25Å; V264-F308 HydrophobicContact CG1-CZ 3.54Å
265	V	93.4	Very high	88.4	Confident	58 Å²	58	65.5 Å²	65.5	35%	0.352	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130	-173.4	-175.7	0	0	0	0	109.2	D263 F299	D263-V265 HydrophobicContact CB-CG2 4.4Å; V265-F299 HydrophobicContact CG1-CB 4.49Å; V265-F299 HydrophobicContact CG2-CD2 4.09Å
266	S	88.8	Confident	88.3	Confident	4 Å²	4	67.4 Å²	67.4	3%	0.028	34%	0.344	C	S	.	.			trans	-92.7	112.1	167.9	-178.9	0	0	0	0	109.4	N268 F299 E304	S266-N268 PolarHBondContact OG-O 3.15Å; S266-F299 PolarHBondContact N-O 2.8Å; S266-E304 WeakPolarHBondContact CB-OE1 3.49Å; S266-E304 WeakPolarHBondContact CB-OE2 3.41Å; S266-E304 PolarHBondContact OG-OE1 2.77Å; S266-E304 PolarHBondContact OG-OE2 2.94Å
267	E	74.9	Confident	88.3	Confident	154 Å²	154	59.6 Å²	59.6	72%	0.72	32%	0.315	S	S	*	.	S	Bend	trans	-78.5	-32.6	174.7	-65.5	179.1	-175.9	0	0	111.4
268	N	73.8	Confident	88.2	Confident	85 Å²	85	65 Å²	65	46%	0.455	34%	0.339	S	S	.	.	S	Bend	trans	-131.8	104.4	-176.9	-64.5	-57.5	0	0	0	110.9	S266 G270 Q271 T272	S266-N268 PolarHBondContact OG-O 3.15Å; N268-G270 PolarHBondContact O-N 2.84Å; N268-Q271 HydrophobicContact CB-CB 4.25Å; N268-Q271 PolarHBondContact O-N 2.9Å; N268-T272 PolarHBondContact O-N 3.02Å; N268-T272 PolarHBondContact O-OG1 3.4Å
269	P	67.5	Low	88.1	Confident	74 Å²	74	64.6 Å²	64.6	48%	0.481	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	133.9	179.5	7.7	-17.5	0	0	0	112.4	Q271 Y301	P269-Q271 PolarHBondContact O-N 2.78Å; P269-Q271 VanDerWaalsContact O-N 3.09Å; P269-Y301 HydrophobicContact CB-CD2 3.66Å; P269-Y301 HydrophobicContact CB-CE1 4.47Å; P269-Y301 HydrophobicContact CB-CE2 3.38Å; P269-Y301 HydrophobicContact CB-CG 4.31Å; P269-Y301 HydrophobicContact CG-CE2 3.77Å
270	G	65.4	Low	88.1	Confident	65 Å²	65	65.2 Å²	65.2	67%	0.67	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	-2	171.7	0	0	0	0	0	115.3	N268	N268-G270 PolarHBondContact O-N 2.84Å
271	Q	67.4	Low	88.1	Confident	158 Å²	158	65.3 Å²	65.3	74%	0.738	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	-16.5	175.2	-63.8	-176.7	0.3	0	0	112.5	N268 P269 Q273	N268-Q271 HydrophobicContact CB-CB 4.25Å; N268-Q271 PolarHBondContact O-N 2.9Å; P269-Q271 PolarHBondContact O-N 2.78Å; P269-Q271 VanDerWaalsContact O-N 3.09Å; Q271-Q273 PolarHBondContact O-N 2.59Å
272	T	73.9	Confident	88	Confident	45 Å²	45	62.2 Å²	62.2	28%	0.276	34%	0.336	S	S	.	.			trans	-89.3	107.4	-174.6	-50.7	0	0	0	0	110	N268 F274	N268-T272 PolarHBondContact O-N 3.02Å; N268-T272 PolarHBondContact O-OG1 3.4Å; T272-F274 HydrophobicContact CG2-CD1 4.44Å; T272-F274 HydrophobicContact CG2-CD2 4.31Å; T272-F274 HydrophobicContact CG2-CE1 3.97Å; T272-F274 HydrophobicContact CG2-CE2 3.8Å; T272-F274 HydrophobicContact CG2-CZ 3.6Å
273	Q	82.5	Confident	88	Confident	192 Å²	192	65.3 Å²	65.3	90%	0.897	35%	0.353	S	S	*	.			trans	-94.5	109.4	168.3	-71.3	-176.5	-1.6	0	0	109.4	Q271	Q271-Q273 PolarHBondContact O-N 2.59Å
274	F	92.3	Very high	88	Confident	32 Å²	32	66.1 Å²	66.1	14%	0.14	36%	0.361	C	S	.	.			trans	-73.4	133.7	175	-65	-81.7	0	0	0	110.4	Y238 V264 T272 L300 E304 P307 F308	Y238-F274 HydrophobicContact CD1-CB 4.5Å; Y238-F274 AromaticContact CD1-CD1 3.76Å; Y238-F274 HydrophobicContact CD1-CD1 3.76Å; Y238-F274 HydrophobicContact CE1-CB 4.07Å; Y238-F274 HydrophobicContact CE1-CD1 4.19Å; V264-F274 HydrophobicContact CG1-CD1 4.19Å; V264-F274 HydrophobicContact CG1-CE1 3.89Å; V264-F274 HydrophobicContact CG1-CZ 4.34Å; T272-F274 HydrophobicContact CG2-CD1 4.44Å; T272-F274 HydrophobicContact CG2-CD2 4.31Å; T272-F274 HydrophobicContact CG2-CE1 3.97Å; T272-F274 HydrophobicContact CG2-CE2 3.8Å; T272-F274 HydrophobicContact CG2-CZ 3.6Å; F274-L300 HydrophobicContact CD2-CD1 4.5Å; F274-L300 HydrophobicContact CE1-CD2 4.23Å; F274-L300 HydrophobicContact CE2-CD1 4.13Å; F274-L300 HydrophobicContact CE2-CD2 3.48Å; F274-L300 VanDerWaalsContact CE2-CD2 3.48Å; F274-L300 HydrophobicContact CE2-CG 4.43Å; F274-L300 HydrophobicContact CZ-CD2 3.28Å; F274-E304 HydrophobicContact CD2-CB 4.26Å; F274-E304 HydrophobicContact CE2-CB 3.97Å; F274-E304 HydrophobicContact CE2-CG 4.5Å; F274-P307 HydrophobicContact CB-CG 3.74Å; F274-F308 HydrophobicContact CB-CE2 4.01Å; F274-F308 HydrophobicContact CB-CZ 3.9Å; F274-F308 HydrophobicContact CD1-CZ 4.19Å; F274-F308 HydrophobicContact CD2-CE2 4.08Å; F274-F308 HydrophobicContact CD2-CZ 4.43Å; F274-F308 AromaticContact CG-CE2 3.98Å; F274-F308 HydrophobicContact CG-CE2 3.98Å; F274-F308 AromaticContact CG-CZ 3.91Å; F274-F308 HydrophobicContact CG-CZ 3.91Å
275	H	94.1	Very high	88.1	Confident	77 Å²	77	66.1 Å²	66.1	36%	0.356	36%	0.361	S	S	.	.			trans	-69.9	165.9	171.2	66.1	-73.9	0	0	0	110.8	Y238 L241	Y238-H275 AromaticContact CD1-CE1 3.71Å; Y238-H275 AromaticContact CE1-CE1 3.46Å; Y238-H275 VanDerWaalsContact CE1-CE1 3.46Å; Y238-H275 WeakPolarHBondContact CE1-CE1 3.36Å; Y238-H275 AromaticContact CE1-ND1 3.65Å; Y238-H275 AromaticContact CE1-NE2 3.92Å; Y238-H275 WeakPolarHBondContact CE1-O 3.47Å; Y238-H275 PolarHBondContact O-CE1 3.48Å; Y238-H275 VanDerWaalsContact O-CE1 3.29Å; Y238-H275 PolarHBondContact OH-O 3.3Å; L241-H275 PolarHBondContact O-CE1 3.37Å; L241-H275 PolarHBondContact O-NE2 3.21Å
276	T	95.3	Very high	88.3	Confident	77 Å²	77	65.4 Å²	65.4	47%	0.472	35%	0.354	S	S	.	.			trans	-111.3	137.4	179.3	-60.1	0	0	0	0	109.6	P307	T276-P307 WeakPolarHBondContact OG1-CB 3.39Å
277	I	97.6	Very high	88.7	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.01	39%	0.39	C	S	.	.			trans	-84.9	148.8	168.8	-57.5	-57	0	0	0	108.7	Y238 L241 D243 L246 W282 Y311	Y238-I277 HydrophobicContact CE2-CG1 4.49Å; L241-I277 HydrophobicContact CD2-CD1 4.42Å; L241-I277 HydrophobicContact CD2-CG1 4.07Å; L241-I277 HydrophobicContact CG-CD1 4.05Å; L241-I277 HydrophobicContact CG-CG1 4.24Å; D243-I277 WeakPolarHBondContact OD1-CG2 3.31Å; L246-I277 HydrophobicContact CD1-CG2 3.58Å; I277-W282 HydrophobicContact CB-CZ2 4.46Å; I277-W282 HydrophobicContact CG1-CZ2 4.41Å; I277-W282 HydrophobicContact CG2-CD2 4.46Å; I277-W282 HydrophobicContact CG2-CG 4.46Å; I277-W282 HydrophobicContact CG2-CZ2 4.32Å; I277-Y311 PolarHBondContact O-OH 3.03Å
278	Q	97.1	Very high	89.9	Confident	116 Å²	116	68 Å²	68	54%	0.542	36%	0.363	S	S	.	.			trans	-78.8	145.4	175.3	-62.8	-175.1	-8.4	0	0	111.7	D243 S280 S281 W282	D243-Q278 WeakPolarHBondContact OD1-CB 3.16Å; D243-Q278 PolarHBondContact OD1-N 3.36Å; Q278-S280 WeakPolarHBondContact CB-OG 3.34Å; Q278-S280 PolarHBondContact O-N 2.85Å; Q278-S280 PolarHBondContact OE1-OG 3.44Å; Q278-S281 WeakPolarHBondContact O-CB 3.45Å; Q278-S281 PolarHBondContact O-N 3.43Å; Q278-S281 VanDerWaalsContact O-N 3.1Å; Q278-W282 PolarHBondContact O-N 3.48Å
279	K	97.1	Very high	91	Very high	80 Å²	80	64 Å²	64	35%	0.348	34%	0.342	S	S	.	.	H	α-helix	trans	-56.3	-39.7	174.4	-171.4	-167.6	-176.7	-50	0	111.8	S281 W282 D283 Y311	K279-S281 PolarHBondContact O-N 2.92Å; K279-W282 PolarHBondContact O-N 3.08Å; K279-D283 IonicContact NZ-OD1 3.71Å; K279-D283 PolarHBondContact NZ-OD1 3.25Å; K279-D283 IonicContact NZ-OD2 3.54Å; K279-D283 PolarHBondContact NZ-OD2 3.29Å; K279-D283 VanDerWaalsContact O-CG 3.23Å; K279-D283 PolarHBondContact O-N 3.48Å; K279-Y311 HydrophobicContact CB-CD1 4.21Å; K279-Y311 HydrophobicContact CB-CD2 3.81Å; K279-Y311 HydrophobicContact CB-CE1 4.25Å; K279-Y311 HydrophobicContact CB-CE2 3.88Å; K279-Y311 HydrophobicContact CB-CG 4Å; K279-Y311 HydrophobicContact CD-CD2 4.38Å; K279-Y311 HydrophobicContact CD-CG 4.37Å; K279-Y311 HydrophobicContact CG-CD2 3.66Å; K279-Y311 HydrophobicContact CG-CE2 4.09Å; K279-Y311 HydrophobicContact CG-CG 4.04Å
280	S	97.9	Very high	92.5	Very high	66 Å²	66	63.9 Å²	63.9	46%	0.462	34%	0.341	S	S	.	.	H	α-helix	trans	-56.5	-36	177.9	38.3	0	0	0	0	113.1	Q278 D283 A284	Q278-S280 WeakPolarHBondContact CB-OG 3.34Å; Q278-S280 PolarHBondContact O-N 2.85Å; Q278-S280 PolarHBondContact OE1-OG 3.44Å; S280-D283 PolarHBondContact O-N 3.17Å; S280-A284 WeakPolarHBondContact O-CB 3.29Å; S280-A284 PolarHBondContact O-N 2.63Å
281	S	98.3	Very high	94	Very high	2 Å²	2	69.8 Å²	69.8	1%	0.014	35%	0.349	C	S	.	.	H	α-helix	trans	-71.1	-41.9	178.6	-52.7	0	0	0	0	111.4	D243 Q278 K279 D283 A284 F285	D243-S281 WeakPolarHBondContact CB-OG 3.49Å; D243-S281 WeakPolarHBondContact OD1-CB 3.47Å; D243-S281 PolarHBondContact OD1-OG 2.87Å; Q278-S281 WeakPolarHBondContact O-CB 3.45Å; Q278-S281 PolarHBondContact O-N 3.43Å; Q278-S281 VanDerWaalsContact O-N 3.1Å; K279-S281 PolarHBondContact O-N 2.92Å; S281-D283 VanDerWaalsContact C-N 3.35Å; S281-A284 PolarHBondContact O-N 2.77Å; S281-F285 WeakPolarHBondContact O-CB 3.37Å; S281-F285 PolarHBondContact O-N 2.95Å
282	W	98.1	Very high	95.5	Very high	8 Å²	8	62.3 Å²	62.3	3%	0.03	31%	0.313	C	S	.	.	H	α-helix	trans	-63.2	-40.5	171.6	-70.5	115.6	0	0	0	112.6	L241 L246 I277 Q278 K279 F285 I286 L294 Y311 I313 P314	L241-W282 HydrophobicContact CD2-CH2 3.92Å; L241-W282 HydrophobicContact CD2-CZ2 3.99Å; L246-W282 HydrophobicContact CD1-CD2 3.86Å; L246-W282 HydrophobicContact CD1-CE3 3.79Å; L246-W282 HydrophobicContact CD1-CG 4.48Å; L246-W282 HydrophobicContact CD1-CH2 4.14Å; L246-W282 HydrophobicContact CD1-CZ2 4.21Å; L246-W282 HydrophobicContact CD1-CZ3 3.91Å; L246-W282 HydrophobicContact CD2-CZ3 4.1Å; I277-W282 HydrophobicContact CB-CZ2 4.46Å; I277-W282 HydrophobicContact CG1-CZ2 4.41Å; I277-W282 HydrophobicContact CG2-CD2 4.46Å; I277-W282 HydrophobicContact CG2-CG 4.46Å; I277-W282 HydrophobicContact CG2-CZ2 4.32Å; Q278-W282 PolarHBondContact O-N 3.48Å; K279-W282 PolarHBondContact O-N 3.08Å; W282-F285 HydrophobicContact CE3-CD1 4.29Å; W282-F285 HydrophobicContact CZ3-CD1 4.41Å; W282-F285 WeakPolarHBondContact O-CB 3.21Å; W282-F285 PolarHBondContact O-N 3.21Å; W282-I286 WeakPolarHBondContact O-CG2 3.49Å; W282-I286 PolarHBondContact O-N 3.21Å; W282-L294 HydrophobicContact CE3-CD2 4.17Å; W282-L294 HydrophobicContact CH2-CD1 4.43Å; W282-L294 HydrophobicContact CH2-CD2 3.88Å; W282-L294 HydrophobicContact CZ3-CD1 4.34Å; W282-L294 HydrophobicContact CZ3-CD2 3.49Å; W282-L294 VanDerWaalsContact CZ3-CD2 3.49Å; W282-Y311 AromaticContact CD1-CE2 3.62Å; W282-Y311 AromaticContact CD1-CZ 3.98Å; W282-Y311 PolarHBondContact NE1-OH 3.41Å; W282-I313 HydrophobicContact CD2-CG2 4.4Å; W282-P314 HydrophobicContact CE3-CG 3.82Å
283	D	98	Very high	96.7	Very high	66 Å²	66	63.2 Å²	63.2	35%	0.353	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-41.8	177.8	-68.9	-18.1	0	0	0	111.5	K279 S280 S281 F285 I286 K287	K279-D283 IonicContact NZ-OD1 3.71Å; K279-D283 PolarHBondContact NZ-OD1 3.25Å; K279-D283 IonicContact NZ-OD2 3.54Å; K279-D283 PolarHBondContact NZ-OD2 3.29Å; K279-D283 VanDerWaalsContact O-CG 3.23Å; K279-D283 PolarHBondContact O-N 3.48Å; S280-D283 PolarHBondContact O-N 3.17Å; S281-D283 VanDerWaalsContact C-N 3.35Å; D283-F285 VanDerWaalsContact C-N 3.35Å; D283-I286 WeakPolarHBondContact O-CG2 3.42Å; D283-K287 VanDerWaalsContact O-CB 3.22Å; D283-K287 WeakPolarHBondContact O-CB 3.35Å; D283-K287 PolarHBondContact O-N 3.43Å
284	A	98.3	Very high	97.4	Very high	28 Å²	28	54.1 Å²	54.1	23%	0.231	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-43.8	174	0	0	0	0	0	111.4	L247 S280 S281 K287 H288	L247-A284 HydrophobicContact CD2-CB 3.94Å; S280-A284 WeakPolarHBondContact O-CB 3.29Å; S280-A284 PolarHBondContact O-N 2.63Å; S281-A284 PolarHBondContact O-N 2.77Å; A284-K287 PolarHBondContact O-N 3.47Å; A284-H288 PolarHBondContact O-N 3.43Å
285	F	98.3	Very high	97.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.4	-48.4	178.9	-178.9	-112.8	0	0	0	113	L246 S250 L257 L260 S281 W282 D283 K287 H288 S289 V292 P314	L246-F285 HydrophobicContact CD2-CB 4.48Å; L246-F285 HydrophobicContact CD2-CD2 4.16Å; L246-F285 HydrophobicContact CD2-CG 4.17Å; S250-F285 WeakPolarHBondContact OG-CA 3.12Å; S250-F285 PolarHBondContact OG-N 3.19Å; L257-F285 HydrophobicContact CB-CE2 4.28Å; L257-F285 HydrophobicContact CD2-CE2 3.7Å; L257-F285 HydrophobicContact CD2-CZ 3.81Å; L260-F285 HydrophobicContact CB-CZ 4.1Å; L260-F285 HydrophobicContact CD2-CE1 4.07Å; L260-F285 HydrophobicContact CD2-CE2 4.29Å; L260-F285 HydrophobicContact CD2-CZ 3.67Å; S281-F285 WeakPolarHBondContact O-CB 3.37Å; S281-F285 PolarHBondContact O-N 2.95Å; W282-F285 HydrophobicContact CE3-CD1 4.29Å; W282-F285 HydrophobicContact CZ3-CD1 4.41Å; W282-F285 WeakPolarHBondContact O-CB 3.21Å; W282-F285 PolarHBondContact O-N 3.21Å; D283-F285 VanDerWaalsContact C-N 3.35Å; F285-K287 VanDerWaalsContact C-N 3.35Å; F285-H288 PolarHBondContact O-N 3.26Å; F285-S289 PolarHBondContact O-N 2.99Å; F285-V292 HydrophobicContact CD1-CG1 4.26Å; F285-V292 HydrophobicContact CE1-CB 4.39Å; F285-V292 HydrophobicContact CE1-CG1 3.55Å; F285-V292 HydrophobicContact CE1-CG2 4.11Å; F285-V292 HydrophobicContact CZ-CB 4.33Å; F285-V292 HydrophobicContact CZ-CG1 3.96Å; F285-V292 HydrophobicContact CZ-CG2 3.73Å; F285-P314 HydrophobicContact CD1-CG 4.41Å
286	I	97.6	Very high	98	Very high	42 Å²	42	49.7 Å²	49.7	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-71	-32.1	178.6	-165.9	60.8	0	0	0	112.4	W282 D283 H288 S289 P290 V292 P314 R338	W282-I286 WeakPolarHBondContact O-CG2 3.49Å; W282-I286 PolarHBondContact O-N 3.21Å; D283-I286 WeakPolarHBondContact O-CG2 3.42Å; I286-H288 VanDerWaalsContact C-N 3.33Å; I286-H288 PolarHBondContact O-N 3.18Å; I286-S289 CarbonylContact O-C 3.27Å; I286-P290 WeakPolarHBondContact O-CA 3.19Å; I286-P290 VanDerWaalsContact O-N 3.16Å; I286-V292 HydrophobicContact CD1-CG1 4.29Å; I286-P314 HydrophobicContact CB-CB 4.11Å; I286-P314 HydrophobicContact CB-CG 4.47Å; I286-P314 HydrophobicContact CD1-CB 3.9Å; I286-P314 HydrophobicContact CG1-CB 4.11Å; I286-R338 VanDerWaalsContact CD1-CZ 3.42Å; I286-R338 VanDerWaalsContact CD1-NH1 3.3Å
287	K	98.3	Very high	98.1	Very high	180 Å²	180	49.5 Å²	49.5	78%	0.783	25%	0.246	S	C	*	.	H	α-helix	trans	-62.4	-41.8	174.9	-178.5	-178.1	177.5	-174.3	0	111.3	D283 A284 F285	D283-K287 VanDerWaalsContact O-CB 3.22Å; D283-K287 WeakPolarHBondContact O-CB 3.35Å; D283-K287 PolarHBondContact O-N 3.43Å; A284-K287 PolarHBondContact O-N 3.47Å; F285-K287 VanDerWaalsContact C-N 3.35Å
288	H	98.5	Very high	98.1	Very high	32 Å²	32	49.5 Å²	49.5	15%	0.148	25%	0.246	C	C	.	.	H	α-helix	trans	-72.1	-48.6	177.6	-176.1	61.6	0	0	0	112.1	L249 S251 H254 V255 R256 A284 F285 I286 P290	L249-H288 PolarHBondContact O-CD2 2.57Å; S251-H288 PolarHBondContact O-CE1 3.2Å; S251-H288 VanDerWaalsContact O-CE1 3.27Å; H254-H288 PolarHBondContact O-CE1 3.26Å; H254-H288 PolarHBondContact O-NE2 3.19Å; V255-H288 PolarHBondContact O-NE2 2.77Å; R256-H288 PolarHBondContact NE-O 3.45Å; A284-H288 PolarHBondContact O-N 3.43Å; F285-H288 PolarHBondContact O-N 3.26Å; I286-H288 VanDerWaalsContact C-N 3.33Å; I286-H288 PolarHBondContact O-N 3.18Å; H288-P290 VanDerWaalsContact C-CD 3.47Å; H288-P290 VanDerWaalsContact O-CD 3.22Å; H288-P290 WeakPolarHBondContact O-CD 3.44Å
289	S	98.4	Very high	98	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.014	23%	0.233	C	C	.	.			trans	-119.9	70.4	-173.1	-57.9	0	0	0	0	112.2	R256 L257 F285 I286 K291 V292	R256-S289 WeakPolarHBondContact CA-OG 3.25Å; L257-S289 PolarHBondContact N-OG 3.15Å; F285-S289 PolarHBondContact O-N 2.99Å; I286-S289 CarbonylContact O-C 3.27Å; S289-K291 PolarHBondContact O-N 2.86Å; S289-V292 WeakPolarHBondContact O-CB 3.33Å; S289-V292 WeakPolarHBondContact O-CG1 3.33Å; S289-V292 PolarHBondContact O-N 3.18Å
290	P	97.8	Very high	97.8	Very high	72 Å²	72	43.1 Å²	43.1	47%	0.468	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.2	-170.6	25.7	-36.3	0	0	0	115	I286 H288 R338	I286-P290 WeakPolarHBondContact O-CA 3.19Å; I286-P290 VanDerWaalsContact O-N 3.16Å; H288-P290 VanDerWaalsContact C-CD 3.47Å; H288-P290 VanDerWaalsContact O-CD 3.22Å; H288-P290 WeakPolarHBondContact O-CD 3.44Å; P290-R338 PolarHBondContact O-NH2 3.47Å
291	K	97.6	Very high	97.3	Very high	189 Å²	189	44.8 Å²	44.8	82%	0.822	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	6.7	178.8	-64.9	-173.4	177.7	-177.1	0	113.3	S289	S289-K291 PolarHBondContact O-N 2.86Å
292	V	98.3	Very high	96.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.239	C	C	.	.			trans	-62	138.2	-178.4	69.7	0	0	0	0	111.1	L257 F285 I286 S289 R338	L257-V292 HydrophobicContact CB-CG2 4.12Å; L257-V292 WeakPolarHBondContact O-CB 3.44Å; F285-V292 HydrophobicContact CD1-CG1 4.26Å; F285-V292 HydrophobicContact CE1-CB 4.39Å; F285-V292 HydrophobicContact CE1-CG1 3.55Å; F285-V292 HydrophobicContact CE1-CG2 4.11Å; F285-V292 HydrophobicContact CZ-CB 4.33Å; F285-V292 HydrophobicContact CZ-CG1 3.96Å; F285-V292 HydrophobicContact CZ-CG2 3.73Å; I286-V292 HydrophobicContact CD1-CG1 4.29Å; S289-V292 WeakPolarHBondContact O-CB 3.33Å; S289-V292 WeakPolarHBondContact O-CG1 3.33Å; S289-V292 PolarHBondContact O-N 3.18Å; V292-R338 PolarHBondContact O-NH1 3.08Å; V292-R338 VanDerWaalsContact O-NH1 3.11Å; V292-R338 PolarHBondContact O-NH2 3.46Å
293	N	98.6	Very high	95.8	Very high	65 Å²	65	57.8 Å²	57.8	35%	0.348	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	112.5	165.5	-65.1	-61.9	0	0	0	108.6	E258 H259 L260 T316	E258-N293 PolarHBondContact O-N 3Å; E258-N293 PolarHBondContact O-ND2 3.34Å; H259-N293 WeakPolarHBondContact CA-O 3.46Å; L260-N293 PolarHBondContact N-O 3.36Å; N293-T316 WeakPolarHBondContact CA-OG1 3.46Å
294	L	98.7	Very high	95.5	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	111.7	169	174.3	60	0	0	0	108.7	L260 I262 W282 M296 I313 P314 V315 T316 H317	L260-L294 HydrophobicContact CB-CD1 4.16Å; L260-L294 HydrophobicContact CD2-CD1 4.01Å; L260-L294 HydrophobicContact CG-CD1 3.98Å; L260-L294 CarbonylContact O-C 3.56Å; L260-L294 WeakPolarHBondContact O-CA 3.48Å; I262-L294 HydrophobicContact CG1-CD1 4.11Å; W282-L294 HydrophobicContact CE3-CD2 4.17Å; W282-L294 HydrophobicContact CH2-CD1 4.43Å; W282-L294 HydrophobicContact CH2-CD2 3.88Å; W282-L294 HydrophobicContact CZ3-CD1 4.34Å; W282-L294 HydrophobicContact CZ3-CD2 3.49Å; W282-L294 VanDerWaalsContact CZ3-CD2 3.49Å; L294-M296 HydrophobicContact CD1-CG 4.08Å; L294-M296 HydrophobicContact CD2-SD 4.39Å; L294-M296 HydrophobicContact CG-CG 4.13Å; L294-M296 HydrophobicContact CG-SD 4.46Å; L294-I313 HydrophobicContact CD2-CG2 4.1Å; L294-P314 HydrophobicContact CD2-CG 4.06Å; L294-V315 HydrophobicContact CD2-CB 4.18Å; L294-V315 HydrophobicContact CG-CB 4.36Å; L294-V315 HydrophobicContact CG-CG2 4.28Å; L294-T316 PolarHBondContact N-OG1 3.4Å; L294-T316 PolarHBondContact O-N 3.45Å; L294-T316 PolarHBondContact O-OG1 2.68Å; L294-H317 PolarHBondContact O-N 2.89Å; L294-H317 VanDerWaalsContact O-N 3.09Å
295	V	98.8	Very high	95.3	Very high	11 Å²	11	54 Å²	54	7%	0.067	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.5	179.1	-177.4	0	0	0	0	108.2	H259 L260 R261 I262 Y297 H317	H259-V295 WeakPolarHBondContact NE2-CG2 3.4Å; L260-V295 PolarHBondContact O-N 3.39Å; R261-V295 CarbonylContact C-O 3.43Å; R261-V295 VanDerWaalsContact CA-O 3.31Å; R261-V295 WeakPolarHBondContact CA-O 3.18Å; R261-V295 HydrophobicContact CB-CB 4.28Å; R261-V295 HydrophobicContact CG-CB 4.4Å; R261-V295 HydrophobicContact CG-CG1 4.42Å; I262-V295 PolarHBondContact N-O 3.2Å; V295-Y297 HydrophobicContact CG1-CD1 3.89Å; V295-Y297 HydrophobicContact CG1-CE1 3.46Å; V295-Y297 VanDerWaalsContact CG1-CE1 3.46Å; V295-H317 WeakPolarHBondContact CA-O 3.3Å; V295-H317 HydrophobicContact CB-CB 4.28Å; V295-H317 HydrophobicContact CG1-CB 4.07Å; V295-H317 HydrophobicContact CG2-CB 3.99Å
296	M	98.7	Very high	94.9	Very high	6 Å²	6	58.8 Å²	58.8	3%	0.03	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	124.4	178.5	-59.1	-172.1	72.1	0	0	111.3	I262 V264 L294 F298 V315 H317 L318 Y319	I262-M296 HydrophobicContact CB-CE 4.32Å; I262-M296 HydrophobicContact CB-CG 4.27Å; I262-M296 HydrophobicContact CG2-CE 4.3Å; I262-M296 WeakPolarHBondContact O-CA 3.18Å; V264-M296 HydrophobicContact CG2-CE 4.03Å; L294-M296 HydrophobicContact CD1-CG 4.08Å; L294-M296 HydrophobicContact CD2-SD 4.39Å; L294-M296 HydrophobicContact CG-CG 4.13Å; L294-M296 HydrophobicContact CG-SD 4.46Å; M296-F298 HydrophobicContact CB-CD2 4.29Å; M296-F298 HydrophobicContact CB-CE2 3.62Å; M296-F298 HydrophobicContact CB-CZ 4.37Å; M296-F298 HydrophobicContact CE-CE2 4.14Å; M296-F298 HydrophobicContact CE-CZ 3.71Å; M296-F298 HydrophobicContact SD-CE2 4.42Å; M296-F298 HydrophobicContact SD-CZ 4.39Å; M296-V315 HydrophobicContact CB-CG2 4.31Å; M296-V315 HydrophobicContact CG-CG2 3.97Å; M296-V315 HydrophobicContact SD-CG2 4.19Å; M296-H317 PolarHBondContact N-O 2.87Å; M296-L318 HydrophobicContact CB-CD2 4.05Å; M296-Y319 PolarHBondContact O-N 3.11Å
297	Y	98.4	Very high	94.7	Very high	72 Å²	72	58 Å²	58	28%	0.282	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.8	177.4	-72.6	11.2	0	0	0	108.9	I262 V264 V295 F299 Y319	I262-Y297 PolarHBondContact O-N 2.97Å; V264-Y297 WeakPolarHBondContact CA-O 3.36Å; V264-Y297 WeakPolarHBondContact CB-O 3.29Å; V264-Y297 PolarHBondContact N-O 3.24Å; V295-Y297 HydrophobicContact CG1-CD1 3.89Å; V295-Y297 HydrophobicContact CG1-CE1 3.46Å; V295-Y297 VanDerWaalsContact CG1-CE1 3.46Å; Y297-F299 HydrophobicContact CD2-CE2 4.38Å; Y297-Y319 CarbonylContact C-O 3.59Å; Y297-Y319 WeakPolarHBondContact CA-O 3.39Å; Y297-Y319 VanDerWaalsContact CD1-CB 3.45Å; Y297-Y319 HydrophobicContact CD1-CD1 4.43Å; Y297-Y319 HydrophobicContact CD1-CG 4.26Å; Y297-Y319 HydrophobicContact CD2-CD1 4.3Å; Y297-Y319 HydrophobicContact CE1-CG 4.41Å; Y297-Y319 HydrophobicContact CG-CD1 4.14Å; Y297-Y319 HydrophobicContact CG-CG 4.42Å
298	F	97.3	Very high	94.7	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.009	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.7	-178	-71.6	-93.5	0	0	0	110.5	V264 M296 L300 F305 F308 F309 L318 Y319 F320 G321	V264-F298 HydrophobicContact CB-CD1 3.75Å; V264-F298 HydrophobicContact CB-CE1 4Å; V264-F298 HydrophobicContact CB-CG 4.31Å; V264-F298 HydrophobicContact CG1-CD1 4.02Å; V264-F298 HydrophobicContact CG1-CE1 4.09Å; V264-F298 HydrophobicContact CG2-CD1 3.86Å; V264-F298 HydrophobicContact CG2-CE1 3.67Å; V264-F298 HydrophobicContact CG2-CE2 4.43Å; V264-F298 HydrophobicContact CG2-CG 4.34Å; V264-F298 HydrophobicContact CG2-CZ 3.98Å; M296-F298 HydrophobicContact CB-CD2 4.29Å; M296-F298 HydrophobicContact CB-CE2 3.62Å; M296-F298 HydrophobicContact CB-CZ 4.37Å; M296-F298 HydrophobicContact CE-CE2 4.14Å; M296-F298 HydrophobicContact CE-CZ 3.71Å; M296-F298 HydrophobicContact SD-CE2 4.42Å; M296-F298 HydrophobicContact SD-CZ 4.39Å; F298-L300 HydrophobicContact CD1-CD1 3.79Å; F298-L300 HydrophobicContact CD1-CG 4.19Å; F298-L300 HydrophobicContact CE1-CD1 4.4Å; F298-F305 HydrophobicContact CB-CE1 4.03Å; F298-F305 HydrophobicContact CB-CZ 4.16Å; F298-F305 HydrophobicContact CD1-CD1 4.3Å; F298-F305 AromaticContact CD1-CE1 3.59Å; F298-F305 HydrophobicContact CD1-CE1 3.59Å; F298-F305 HydrophobicContact CD1-CZ 4.42Å; F298-F305 HydrophobicContact CE1-CE1 4.24Å; F298-F305 AromaticContact CG-CE1 3.95Å; F298-F305 HydrophobicContact CG-CE1 3.95Å; F298-F308 HydrophobicContact CE1-CB 4.42Å; F298-F308 AromaticContact CE1-CD1 3.64Å; F298-F308 HydrophobicContact CE1-CD1 3.64Å; F298-F308 HydrophobicContact CE1-CD2 4.11Å; F298-F308 AromaticContact CE1-CE1 3.83Å; F298-F308 HydrophobicContact CE1-CE1 3.83Å; F298-F308 HydrophobicContact CE1-CE2 4.28Å; F298-F308 AromaticContact CE1-CG 3.79Å; F298-F308 HydrophobicContact CE1-CG 3.79Å; F298-F308 HydrophobicContact CE1-CZ 4.15Å; F298-F308 AromaticContact CZ-CD1 3.98Å; F298-F308 HydrophobicContact CZ-CD1 3.98Å; F298-F308 HydrophobicContact CZ-CE1 4.38Å; F298-F308 HydrophobicContact CZ-CG 4.34Å; F298-F309 HydrophobicContact CE1-CE2 4.49Å; F298-F309 HydrophobicContact CE2-CE2 4.29Å; F298-F309 AromaticContact CE2-CZ 3.77Å; F298-F309 HydrophobicContact CE2-CZ 3.77Å; F298-F309 HydrophobicContact CZ-CE2 4.03Å; F298-F309 AromaticContact CZ-CZ 3.8Å; F298-F309 HydrophobicContact CZ-CZ 3.8Å; F298-L318 HydrophobicContact CD2-CD2 4.32Å; F298-L318 HydrophobicContact CE2-CD2 3.79Å; F298-Y319 PolarHBondContact N-O 3.49Å; F298-F320 HydrophobicContact CB-CD1 3.88Å; F298-F320 HydrophobicContact CB-CE1 4.29Å; F298-F320 HydrophobicContact CD2-CD1 4.4Å; F298-F320 HydrophobicContact CD2-CE1 4.09Å; F298-F320 HydrophobicContact CG-CD1 4.29Å; F298-F320 HydrophobicContact CG-CE1 4.19Å; F298-G321 PolarHBondContact O-N 2.97Å
299	F	94.8	Very high	94.6	Very high	62 Å²	62	48.5 Å²	48.5	27%	0.272	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	59.8	172.8	-61	-88.4	0	0	0	109.1	V264 V265 S266 Y297 Y319 R322	V264-F299 PolarHBondContact O-N 3.1Å; V265-F299 HydrophobicContact CG1-CB 4.49Å; V265-F299 HydrophobicContact CG2-CD2 4.09Å; S266-F299 PolarHBondContact N-O 2.8Å; Y297-F299 HydrophobicContact CD2-CE2 4.38Å; F299-Y319 AromaticContact CE1-CE1 3.93Å; F299-Y319 HydrophobicContact CE1-CE1 3.93Å; F299-Y319 HydrophobicContact CZ-CD1 4.15Å; F299-Y319 AromaticContact CZ-CE1 3.73Å; F299-Y319 HydrophobicContact CZ-CE1 3.73Å; F299-R322 PolarHBondContact O-NH1 2.81Å
300	L	92.9	Very high	94.4	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	26%	0.256	C	S	.	.			trans	-109.7	167.3	-174.4	-58.4	-169.7	0	0	0	112	V264 F274 F298 E304 F305 F308 R322	V264-L300 HydrophobicContact CG1-CD1 4.03Å; V264-L300 HydrophobicContact CG1-CD2 4.04Å; V264-L300 HydrophobicContact CG1-CG 4.3Å; F274-L300 HydrophobicContact CD2-CD1 4.5Å; F274-L300 HydrophobicContact CE1-CD2 4.23Å; F274-L300 HydrophobicContact CE2-CD1 4.13Å; F274-L300 HydrophobicContact CE2-CD2 3.48Å; F274-L300 VanDerWaalsContact CE2-CD2 3.48Å; F274-L300 HydrophobicContact CE2-CG 4.43Å; F274-L300 HydrophobicContact CZ-CD2 3.28Å; F298-L300 HydrophobicContact CD1-CD1 3.79Å; F298-L300 HydrophobicContact CD1-CG 4.19Å; F298-L300 HydrophobicContact CE1-CD1 4.4Å; L300-E304 HydrophobicContact CB-CB 4.32Å; L300-E304 HydrophobicContact CD1-CB 4.32Å; L300-F305 HydrophobicContact CB-CD2 4.33Å; L300-F305 HydrophobicContact CB-CE1 4.38Å; L300-F305 HydrophobicContact CB-CE2 3.74Å; L300-F305 HydrophobicContact CB-CZ 3.77Å; L300-F305 HydrophobicContact CD1-CD1 4.1Å; L300-F305 HydrophobicContact CD1-CE1 3.97Å; L300-F305 HydrophobicContact CD1-CG 4.45Å; L300-F305 HydrophobicContact CD1-CZ 4.21Å; L300-F305 HydrophobicContact CG-CE1 4.48Å; L300-F305 HydrophobicContact CG-CZ 4.3Å; L300-F308 HydrophobicContact CD1-CD2 4.19Å; L300-F308 HydrophobicContact CD1-CE2 3.68Å; L300-F308 HydrophobicContact CD1-CZ 4.39Å; L300-R322 VanDerWaalsContact O-CB 3.27Å; L300-R322 WeakPolarHBondContact O-CB 3.25Å; L300-R322 WeakPolarHBondContact O-CD 2.95Å
301	Y	88.6	Confident	94.3	Very high	101 Å²	101	54.2 Å²	54.2	40%	0.396	24%	0.244	S	C	.	.			trans	-93.1	159.3	163.1	-61.3	-86.4	0	0	0	110.3	P269 E303 E304 F305 R322	P269-Y301 HydrophobicContact CB-CD2 3.66Å; P269-Y301 HydrophobicContact CB-CE1 4.47Å; P269-Y301 HydrophobicContact CB-CE2 3.38Å; P269-Y301 HydrophobicContact CB-CG 4.31Å; P269-Y301 HydrophobicContact CG-CE2 3.77Å; Y301-E303 VanDerWaalsContact C-N 3.3Å; Y301-E303 PolarHBondContact O-N 3.33Å; Y301-E304 WeakPolarHBondContact CD2-OE2 3.43Å; Y301-E304 PolarHBondContact N-OE2 3.07Å; Y301-E304 WeakPolarHBondContact O-CB 3.36Å; Y301-E304 PolarHBondContact O-N 3.43Å; Y301-F305 WeakPolarHBondContact O-CD2 3.2Å; Y301-R322 PolarHBondContact OH-NH1 3.15Å
302	E	80.6	Confident	94.1	Very high	119 Å²	119	50.7 Å²	50.7	56%	0.556	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-54.4	-41.5	-171	179.4	164.2	-166.7	0	0	113.9	E304 S325	E302-E304 PolarHBondContact O-N 3.4Å; E302-S325 WeakPolarHBondContact OE1-CB 3.12Å
303	E	84.1	Confident	93.9	Very high	164 Å²	164	51.2 Å²	51.2	77%	0.766	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-69.5	-17.3	-177.3	-59	177.1	-175.4	0	0	113.5	Y301	Y301-E303 VanDerWaalsContact C-N 3.3Å; Y301-E303 PolarHBondContact O-N 3.33Å
304	E	91.4	Very high	93.8	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.056	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-89.5	-4.7	-172.5	-58.9	174.7	135.2	0	0	112.8	S266 F274 L300 Y301 E302 D306 P307	S266-E304 WeakPolarHBondContact CB-OE1 3.49Å; S266-E304 WeakPolarHBondContact CB-OE2 3.41Å; S266-E304 PolarHBondContact OG-OE1 2.77Å; S266-E304 PolarHBondContact OG-OE2 2.94Å; F274-E304 HydrophobicContact CD2-CB 4.26Å; F274-E304 HydrophobicContact CE2-CB 3.97Å; F274-E304 HydrophobicContact CE2-CG 4.5Å; L300-E304 HydrophobicContact CB-CB 4.32Å; L300-E304 HydrophobicContact CD1-CB 4.32Å; Y301-E304 WeakPolarHBondContact CD2-OE2 3.43Å; Y301-E304 PolarHBondContact N-OE2 3.07Å; Y301-E304 WeakPolarHBondContact O-CB 3.36Å; Y301-E304 PolarHBondContact O-N 3.43Å; E302-E304 PolarHBondContact O-N 3.4Å; E304-D306 PolarHBondContact O-N 3.39Å; E304-P307 WeakPolarHBondContact O-CD 3.5Å
305	F	93	Very high	93.8	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.013	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-80.6	1.2	-177.7	-78.1	-79.7	0	0	0	114.5	F298 L300 Y301 P307 F308 F320 V324 V328 R331	F298-F305 HydrophobicContact CB-CE1 4.03Å; F298-F305 HydrophobicContact CB-CZ 4.16Å; F298-F305 HydrophobicContact CD1-CD1 4.3Å; F298-F305 AromaticContact CD1-CE1 3.59Å; F298-F305 HydrophobicContact CD1-CE1 3.59Å; F298-F305 HydrophobicContact CD1-CZ 4.42Å; F298-F305 HydrophobicContact CE1-CE1 4.24Å; F298-F305 AromaticContact CG-CE1 3.95Å; F298-F305 HydrophobicContact CG-CE1 3.95Å; L300-F305 HydrophobicContact CB-CD2 4.33Å; L300-F305 HydrophobicContact CB-CE1 4.38Å; L300-F305 HydrophobicContact CB-CE2 3.74Å; L300-F305 HydrophobicContact CB-CZ 3.77Å; L300-F305 HydrophobicContact CD1-CD1 4.1Å; L300-F305 HydrophobicContact CD1-CE1 3.97Å; L300-F305 HydrophobicContact CD1-CG 4.45Å; L300-F305 HydrophobicContact CD1-CZ 4.21Å; L300-F305 HydrophobicContact CG-CE1 4.48Å; L300-F305 HydrophobicContact CG-CZ 4.3Å; Y301-F305 WeakPolarHBondContact O-CD2 3.2Å; F305-P307 VanDerWaalsContact C-CD 3.49Å; F305-F308 HydrophobicContact CD1-CD2 4.44Å; F305-F308 PolarHBondContact O-N 3.34Å; F305-F320 AromaticContact CE1-CD1 3.94Å; F305-F320 HydrophobicContact CE1-CD1 3.94Å; F305-F320 AromaticContact CE1-CE1 3.68Å; F305-F320 HydrophobicContact CE1-CE1 3.68Å; F305-F320 AromaticContact CZ-CD1 3.91Å; F305-F320 HydrophobicContact CZ-CD1 3.91Å; F305-F320 HydrophobicContact CZ-CE1 4.11Å; F305-V324 HydrophobicContact CZ-CG2 4.42Å; F305-V328 HydrophobicContact CB-CG2 3.45Å; F305-V328 VanDerWaalsContact CB-CG2 3.45Å; F305-V328 HydrophobicContact CD1-CG1 3.97Å; F305-V328 HydrophobicContact CD1-CG2 4.31Å; F305-V328 HydrophobicContact CD2-CG2 4.24Å; F305-V328 HydrophobicContact CE1-CG1 4.41Å; F305-V328 HydrophobicContact CG-CG1 4.25Å; F305-V328 HydrophobicContact CG-CG2 3.77Å; F305-R331 PolarHBondContact O-NH1 3.09Å; F305-R331 PolarHBondContact O-NH2 2.92Å
306	D	91.4	Very high	93.8	Very high	100 Å²	100	48.2 Å²	48.2	54%	0.535	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-44.4	-177	-98.5	-15.7	0	0	0	114.9	E304 F308 R310 R331	E304-D306 PolarHBondContact O-N 3.39Å; D306-F308 PolarHBondContact O-N 3.39Å; D306-R310 PolarHBondContact O-NE 3.1Å; D306-R310 PolarHBondContact O-NH2 2.91Å; D306-R310 IonicContact OD1-NH2 3.42Å; D306-R310 PolarHBondContact OD1-NH2 2.97Å; D306-R331 PolarHBondContact O-NH1 3.3Å
307	P	93.6	Very high	93.8	Very high	26 Å²	26	49.8 Å²	49.8	17%	0.169	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-11.2	-178.5	24.6	-26.3	0	0	0	113.9	F274 T276 E304 F305	F274-P307 HydrophobicContact CB-CG 3.74Å; T276-P307 WeakPolarHBondContact OG1-CB 3.39Å; E304-P307 WeakPolarHBondContact O-CD 3.5Å; F305-P307 VanDerWaalsContact C-CD 3.49Å
308	F	96.2	Very high	93.8	Very high	9 Å²	9	46.5 Å²	46.5	4%	0.039	21%	0.212	C	C	.	.	S	Bend	trans	-94.3	156.7	-172.3	-58	-78.4	0	0	0	113.1	Y238 V264 F274 F298 L300 F305 D306 R310 R331	Y238-F308 HydrophobicContact CD1-CE1 4.49Å; Y238-F308 HydrophobicContact CD1-CZ 4.31Å; Y238-F308 HydrophobicContact CD2-CE1 4.03Å; Y238-F308 HydrophobicContact CE1-CE1 4.06Å; Y238-F308 HydrophobicContact CE1-CZ 4.02Å; Y238-F308 AromaticContact CE2-CE1 3.58Å; Y238-F308 HydrophobicContact CE2-CE1 3.58Å; Y238-F308 HydrophobicContact CE2-CZ 4.32Å; Y238-F308 HydrophobicContact CG-CE1 4.47Å; Y238-F308 AromaticContact CZ-CE1 3.58Å; V264-F308 HydrophobicContact CG1-CE1 4.09Å; V264-F308 HydrophobicContact CG1-CE2 4.25Å; V264-F308 HydrophobicContact CG1-CZ 3.54Å; F274-F308 HydrophobicContact CB-CE2 4.01Å; F274-F308 HydrophobicContact CB-CZ 3.9Å; F274-F308 HydrophobicContact CD1-CZ 4.19Å; F274-F308 HydrophobicContact CD2-CE2 4.08Å; F274-F308 HydrophobicContact CD2-CZ 4.43Å; F274-F308 AromaticContact CG-CE2 3.98Å; F274-F308 HydrophobicContact CG-CE2 3.98Å; F274-F308 AromaticContact CG-CZ 3.91Å; F274-F308 HydrophobicContact CG-CZ 3.91Å; F298-F308 HydrophobicContact CE1-CB 4.42Å; F298-F308 AromaticContact CE1-CD1 3.64Å; F298-F308 HydrophobicContact CE1-CD1 3.64Å; F298-F308 HydrophobicContact CE1-CD2 4.11Å; F298-F308 AromaticContact CE1-CE1 3.83Å; F298-F308 HydrophobicContact CE1-CE1 3.83Å; F298-F308 HydrophobicContact CE1-CE2 4.28Å; F298-F308 AromaticContact CE1-CG 3.79Å; F298-F308 HydrophobicContact CE1-CG 3.79Å; F298-F308 HydrophobicContact CE1-CZ 4.15Å; F298-F308 AromaticContact CZ-CD1 3.98Å; F298-F308 HydrophobicContact CZ-CD1 3.98Å; F298-F308 HydrophobicContact CZ-CE1 4.38Å; F298-F308 HydrophobicContact CZ-CG 4.34Å; L300-F308 HydrophobicContact CD1-CD2 4.19Å; L300-F308 HydrophobicContact CD1-CE2 3.68Å; L300-F308 HydrophobicContact CD1-CZ 4.39Å; F305-F308 HydrophobicContact CD1-CD2 4.44Å; F305-F308 PolarHBondContact O-N 3.34Å; D306-F308 PolarHBondContact O-N 3.39Å; F308-R310 PolarHBondContact O-N 3.13Å; F308-R310 VanDerWaalsContact O-N 3.11Å; F308-R331 PolarHBondContact O-NH1 3.21Å
309	F	96.4	Very high	93.9	Very high	3 Å²	3	49.8 Å²	49.8	1%	0.013	22%	0.224	C	C	.	.	S	Bend	trans	52.3	35.5	174.1	-48.9	-70.9	0	0	0	114.6	F298 I313 L318 F320 V328 R331 V332 T335	F298-F309 HydrophobicContact CE1-CE2 4.49Å; F298-F309 HydrophobicContact CE2-CE2 4.29Å; F298-F309 AromaticContact CE2-CZ 3.77Å; F298-F309 HydrophobicContact CE2-CZ 3.77Å; F298-F309 HydrophobicContact CZ-CE2 4.03Å; F298-F309 AromaticContact CZ-CZ 3.8Å; F298-F309 HydrophobicContact CZ-CZ 3.8Å; F309-I313 HydrophobicContact CD1-CD1 4.1Å; F309-L318 HydrophobicContact CE1-CD1 3.95Å; F309-L318 HydrophobicContact CE1-CD2 4.04Å; F309-L318 HydrophobicContact CZ-CD1 4.15Å; F309-L318 HydrophobicContact CZ-CD2 3.83Å; F309-F320 HydrophobicContact CE2-CE1 4.13Å; F309-F320 HydrophobicContact CE2-CZ 4.02Å; F309-F320 HydrophobicContact CZ-CE1 4.39Å; F309-F320 AromaticContact CZ-CZ 3.98Å; F309-F320 HydrophobicContact CZ-CZ 3.98Å; F309-V328 HydrophobicContact CD2-CG1 3.97Å; F309-V328 HydrophobicContact CE2-CG1 4.1Å; F309-R331 HydrophobicContact CB-CB 3.82Å; F309-V332 HydrophobicContact CD1-CG2 3.88Å; F309-V332 HydrophobicContact CD2-CG2 4.08Å; F309-V332 HydrophobicContact CE1-CG2 3.83Å; F309-V332 HydrophobicContact CE2-CG2 4.03Å; F309-V332 HydrophobicContact CG-CG2 4Å; F309-V332 HydrophobicContact CZ-CG2 3.91Å; F309-T335 WeakPolarHBondContact O-CG2 3.4Å
310	R	94.8	Very high	94	Very high	141 Å²	141	46.9 Å²	46.9	53%	0.532	21%	0.211	S	C	.	.	S	Bend	trans	-83.3	-22.4	179.4	-69.1	-68.9	-175.7	-173.7	-5.6	113.7	D306 F308	D306-R310 PolarHBondContact O-NE 3.1Å; D306-R310 PolarHBondContact O-NH2 2.91Å; D306-R310 IonicContact OD1-NH2 3.42Å; D306-R310 PolarHBondContact OD1-NH2 2.97Å; F308-R310 PolarHBondContact O-N 3.13Å; F308-R310 VanDerWaalsContact O-N 3.11Å
311	Y	95.1	Very high	94.1	Very high	53 Å²	53	47.8 Å²	47.8	21%	0.208	22%	0.221	C	C	.	.	S	Bend	trans	-150.4	176.8	-179.3	50.7	-106.1	0	0	0	108.4	I277 K279 W282 I313 T335	I277-Y311 PolarHBondContact O-OH 3.03Å; K279-Y311 HydrophobicContact CB-CD1 4.21Å; K279-Y311 HydrophobicContact CB-CD2 3.81Å; K279-Y311 HydrophobicContact CB-CE1 4.25Å; K279-Y311 HydrophobicContact CB-CE2 3.88Å; K279-Y311 HydrophobicContact CB-CG 4Å; K279-Y311 HydrophobicContact CD-CD2 4.38Å; K279-Y311 HydrophobicContact CD-CG 4.37Å; K279-Y311 HydrophobicContact CG-CD2 3.66Å; K279-Y311 HydrophobicContact CG-CE2 4.09Å; K279-Y311 HydrophobicContact CG-CG 4.04Å; W282-Y311 AromaticContact CD1-CE2 3.62Å; W282-Y311 AromaticContact CD1-CZ 3.98Å; W282-Y311 PolarHBondContact NE1-OH 3.41Å; Y311-I313 HydrophobicContact CD2-CG1 4.27Å; Y311-I313 HydrophobicContact CE2-CG1 4.04Å; Y311-I313 WeakPolarHBondContact O-CG1 3.3Å; Y311-I313 PolarHBondContact O-N 2.71Å; Y311-T335 VanDerWaalsContact O-CB 3.24Å; Y311-T335 WeakPolarHBondContact O-CB 3.21Å; Y311-T335 WeakPolarHBondContact O-CG2 3.35Å
312	E	94.8	Very high	94.2	Very high	114 Å²	114	47.2 Å²	47.2	53%	0.533	22%	0.218	S	C	.	.			trans	-61	123.5	-179.2	-169.7	177.3	142.1	0	0	112.7	T335 P337	E312-T335 VanDerWaalsContact CA-O 3.31Å; E312-T335 WeakPolarHBondContact CA-O 3.37Å; E312-P337 HydrophobicContact CG-CG 3.86Å
313	I	94	Very high	94.6	Very high	12 Å²	12	43.9 Å²	43.9	6%	0.062	21%	0.208	C	C	.	.			trans	-119.3	138.2	-179.7	-59.8	164.3	0	0	0	108.1	W282 L294 F309 Y311 V315 T335	W282-I313 HydrophobicContact CD2-CG2 4.4Å; L294-I313 HydrophobicContact CD2-CG2 4.1Å; F309-I313 HydrophobicContact CD1-CD1 4.1Å; Y311-I313 HydrophobicContact CD2-CG1 4.27Å; Y311-I313 HydrophobicContact CE2-CG1 4.04Å; Y311-I313 WeakPolarHBondContact O-CG1 3.3Å; Y311-I313 PolarHBondContact O-N 2.71Å; I313-V315 HydrophobicContact CG2-CB 4.2Å; I313-V315 PolarHBondContact O-N 3.34Å; I313-T335 PolarHBondContact N-O 3.05Å
314	P	96.3	Very high	95.1	Very high	9 Å²	9	36.1 Å²	36.1	6%	0.058	17%	0.172	C	C	.	.			trans	-75.7	27.2	-177.2	32.1	-36.9	0	0	0	113.8	W282 F285 I286 L294 R338	W282-P314 HydrophobicContact CE3-CG 3.82Å; F285-P314 HydrophobicContact CD1-CG 4.41Å; I286-P314 HydrophobicContact CB-CB 4.11Å; I286-P314 HydrophobicContact CB-CG 4.47Å; I286-P314 HydrophobicContact CD1-CB 3.9Å; I286-P314 HydrophobicContact CG1-CB 4.11Å; L294-P314 HydrophobicContact CD2-CG 4.06Å; P314-R338 PolarHBondContact O-NH1 3.08Å
315	V	98.2	Very high	95.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.			trans	-66	139.1	-176.6	72.1	0	0	0	0	111.1	L294 M296 I313 L318 C336 R338 L339	L294-V315 HydrophobicContact CD2-CB 4.18Å; L294-V315 HydrophobicContact CG-CB 4.36Å; L294-V315 HydrophobicContact CG-CG2 4.28Å; M296-V315 HydrophobicContact CB-CG2 4.31Å; M296-V315 HydrophobicContact CG-CG2 3.97Å; M296-V315 HydrophobicContact SD-CG2 4.19Å; I313-V315 HydrophobicContact CG2-CB 4.2Å; I313-V315 PolarHBondContact O-N 3.34Å; V315-L318 HydrophobicContact CG1-CD1 4.07Å; V315-L318 HydrophobicContact CG1-CD2 4.34Å; V315-L318 HydrophobicContact CG1-CG 4.13Å; V315-L318 HydrophobicContact CG2-CD2 3.62Å; V315-L318 HydrophobicContact CG2-CG 3.8Å; V315-C336 HydrophobicContact CG1-CB 3.71Å; V315-C336 WeakPolarHBondContact CG1-SG 3.45Å; V315-R338 CarbonylContact O-C 3.06Å; V315-L339 PolarHBondContact O-N 3.2Å
316	T	98.7	Very high	95.3	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.018	18%	0.182	C	C	.	.			trans	-116.2	-34	-176.6	56.5	0	0	0	0	111.9	N293 L294 R338 V340 E341	N293-T316 WeakPolarHBondContact CA-OG1 3.46Å; L294-T316 PolarHBondContact N-OG1 3.4Å; L294-T316 PolarHBondContact O-N 3.45Å; L294-T316 PolarHBondContact O-OG1 2.68Å; T316-R338 HydrophobicContact CG2-CB 4.31Å; T316-V340 WeakPolarHBondContact O-CA 3.4Å; T316-V340 WeakPolarHBondContact O-CB 3.31Å; T316-V340 PolarHBondContact O-N 3.18Å; T316-E341 PolarHBondContact O-N 3.3Å; T316-E341 VanDerWaalsContact O-N 3.13Å
317	H	98.8	Very high	95.4	Very high	40 Å²	40	38.9 Å²	38.9	19%	0.185	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	124.9	180	-55.2	71.1	0	0	0	108.5	L294 V295 M296 E341	L294-H317 PolarHBondContact O-N 2.89Å; L294-H317 VanDerWaalsContact O-N 3.09Å; V295-H317 WeakPolarHBondContact CA-O 3.3Å; V295-H317 HydrophobicContact CB-CB 4.28Å; V295-H317 HydrophobicContact CG1-CB 4.07Å; V295-H317 HydrophobicContact CG2-CB 3.99Å; M296-H317 PolarHBondContact N-O 2.87Å; H317-E341 WeakPolarHBondContact CA-O 3.36Å; H317-E341 HydrophobicContact CB-CB 4.36Å; H317-E341 IonicContact CD2-OE2 3.96Å; H317-E341 PolarHBondContact CD2-OE2 3.33Å
318	L	98.7	Very high	95.5	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.9	179.2	-77	175.7	0	0	0	110.3	M296 F298 F309 V315 F320 V332 L339 E341 L342 V343	M296-L318 HydrophobicContact CB-CD2 4.05Å; F298-L318 HydrophobicContact CD2-CD2 4.32Å; F298-L318 HydrophobicContact CE2-CD2 3.79Å; F309-L318 HydrophobicContact CE1-CD1 3.95Å; F309-L318 HydrophobicContact CE1-CD2 4.04Å; F309-L318 HydrophobicContact CZ-CD1 4.15Å; F309-L318 HydrophobicContact CZ-CD2 3.83Å; V315-L318 HydrophobicContact CG1-CD1 4.07Å; V315-L318 HydrophobicContact CG1-CD2 4.34Å; V315-L318 HydrophobicContact CG1-CG 4.13Å; V315-L318 HydrophobicContact CG2-CD2 3.62Å; V315-L318 HydrophobicContact CG2-CG 3.8Å; L318-F320 HydrophobicContact CB-CE2 4.17Å; L318-F320 HydrophobicContact CD1-CE2 4.36Å; L318-F320 HydrophobicContact CD1-CZ 4.46Å; L318-V332 HydrophobicContact CD1-CG1 3.69Å; L318-V332 HydrophobicContact CD1-CG2 4.09Å; L318-L339 HydrophobicContact CB-CD1 4.03Å; L318-L339 HydrophobicContact CD1-CD1 3.72Å; L318-L339 HydrophobicContact CD1-CD2 4.5Å; L318-L339 HydrophobicContact CG-CD1 3.77Å; L318-E341 PolarHBondContact N-O 3.12Å; L318-L342 HydrophobicContact CB-CD1 3.89Å; L318-L342 WeakPolarHBondContact O-CA 3.43Å; L318-V343 PolarHBondContact O-N 3.23Å
319	Y	98.4	Very high	95.6	Very high	70 Å²	70	37.4 Å²	37.4	28%	0.275	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	118.9	172.5	179.4	-96.7	0	0	0	109.3	M296 Y297 F298 F299 V343 C345	M296-Y319 PolarHBondContact O-N 3.11Å; Y297-Y319 CarbonylContact C-O 3.59Å; Y297-Y319 WeakPolarHBondContact CA-O 3.39Å; Y297-Y319 VanDerWaalsContact CD1-CB 3.45Å; Y297-Y319 HydrophobicContact CD1-CD1 4.43Å; Y297-Y319 HydrophobicContact CD1-CG 4.26Å; Y297-Y319 HydrophobicContact CD2-CD1 4.3Å; Y297-Y319 HydrophobicContact CE1-CG 4.41Å; Y297-Y319 HydrophobicContact CG-CD1 4.14Å; Y297-Y319 HydrophobicContact CG-CG 4.42Å; F298-Y319 PolarHBondContact N-O 3.49Å; F299-Y319 AromaticContact CE1-CE1 3.93Å; F299-Y319 HydrophobicContact CE1-CE1 3.93Å; F299-Y319 HydrophobicContact CZ-CD1 4.15Å; F299-Y319 AromaticContact CZ-CE1 3.73Å; F299-Y319 HydrophobicContact CZ-CE1 3.73Å; Y319-V343 WeakPolarHBondContact CA-O 3.34Å; Y319-V343 HydrophobicContact CD2-CB 3.66Å; Y319-V343 HydrophobicContact CD2-CG1 3.58Å; Y319-V343 HydrophobicContact CD2-CG2 4.44Å; Y319-V343 HydrophobicContact CE2-CB 4.26Å; Y319-V343 HydrophobicContact CE2-CG1 3.65Å; Y319-C345 VanDerWaalsContact CZ-SG 3.58Å; Y319-C345 PolarHBondContact OH-SG 3.06Å
320	F	97.6	Very high	95.6	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	97.6	170.6	-61.5	-84.5	0	0	0	108.1	F298 F305 F309 L318 R322 V324 V328 L329 V332 L342 V343 V344 C345	F298-F320 HydrophobicContact CB-CD1 3.88Å; F298-F320 HydrophobicContact CB-CE1 4.29Å; F298-F320 HydrophobicContact CD2-CD1 4.4Å; F298-F320 HydrophobicContact CD2-CE1 4.09Å; F298-F320 HydrophobicContact CG-CD1 4.29Å; F298-F320 HydrophobicContact CG-CE1 4.19Å; F305-F320 AromaticContact CE1-CD1 3.94Å; F305-F320 HydrophobicContact CE1-CD1 3.94Å; F305-F320 AromaticContact CE1-CE1 3.68Å; F305-F320 HydrophobicContact CE1-CE1 3.68Å; F305-F320 AromaticContact CZ-CD1 3.91Å; F305-F320 HydrophobicContact CZ-CD1 3.91Å; F305-F320 HydrophobicContact CZ-CE1 4.11Å; F309-F320 HydrophobicContact CE2-CE1 4.13Å; F309-F320 HydrophobicContact CE2-CZ 4.02Å; F309-F320 HydrophobicContact CZ-CE1 4.39Å; F309-F320 AromaticContact CZ-CZ 3.98Å; F309-F320 HydrophobicContact CZ-CZ 3.98Å; L318-F320 HydrophobicContact CB-CE2 4.17Å; L318-F320 HydrophobicContact CD1-CE2 4.36Å; L318-F320 HydrophobicContact CD1-CZ 4.46Å; F320-R322 VanDerWaalsContact C-N 3.26Å; F320-R322 PolarHBondContact O-N 2.75Å; F320-V324 HydrophobicContact CB-CB 4.09Å; F320-V324 HydrophobicContact CB-CG1 4.21Å; F320-V324 HydrophobicContact CD1-CB 3.76Å; F320-V324 HydrophobicContact CD1-CG1 4.46Å; F320-V324 HydrophobicContact CD1-CG2 3.6Å; F320-V324 HydrophobicContact CD2-CG1 4.43Å; F320-V324 HydrophobicContact CE1-CB 4.33Å; F320-V324 HydrophobicContact CE1-CG2 3.64Å; F320-V324 HydrophobicContact CG-CB 3.89Å; F320-V324 HydrophobicContact CG-CG1 4.12Å; F320-V324 HydrophobicContact CG-CG2 4.06Å; F320-V324 HydrophobicContact CZ-CG2 4.14Å; F320-V328 HydrophobicContact CE1-CG1 4.25Å; F320-V328 HydrophobicContact CZ-CG1 4.46Å; F320-L329 HydrophobicContact CE2-CD2 4.15Å; F320-V332 HydrophobicContact CZ-CG2 4.04Å; F320-L342 HydrophobicContact CD2-CD1 4.02Å; F320-L342 HydrophobicContact CE2-CD1 3.73Å; F320-V343 PolarHBondContact N-O 2.99Å; F320-V344 HydrophobicContact CD2-CG2 3.96Å; F320-C345 WeakPolarHBondContact O-CB 3.44Å; F320-C345 PolarHBondContact O-N 3.45Å; F320-C345 PolarHBondContact O-SG 2.84Å
321	G	94.7	Very high	95.7	Very high	20 Å²	20	33.5 Å²	33.5	21%	0.206	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-2.7	-178.1	0	0	0	0	0	114.5	F298	F298-G321 PolarHBondContact O-N 2.97Å
322	R	91.6	Very high	95.8	Very high	89 Å²	89	31 Å²	31	34%	0.336	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	179	170.5	-71.6	-169.4	176.5	165.5	0.8	108.5	F299 L300 Y301 F320 V324	F299-R322 PolarHBondContact O-NH1 2.81Å; L300-R322 VanDerWaalsContact O-CB 3.27Å; L300-R322 WeakPolarHBondContact O-CB 3.25Å; L300-R322 WeakPolarHBondContact O-CD 2.95Å; Y301-R322 PolarHBondContact OH-NH1 3.15Å; F320-R322 VanDerWaalsContact C-N 3.26Å; F320-R322 PolarHBondContact O-N 2.75Å; R322-V324 PolarHBondContact O-N 2.99Å
323	S	89.6	Confident	95.9	Very high	50 Å²	50	25.6 Å²	25.6	35%	0.35	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	130.6	176	-173.3	0	0	0	0	111.6	A346	S323-A346 WeakPolarHBondContact CA-O 3.33Å
324	V	93.9	Very high	96.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	145.1	172.1	65.8	0	0	0	0	108.9	F305 F320 R322 V328 L329 V344 A346 N347	F305-V324 HydrophobicContact CZ-CG2 4.42Å; F320-V324 HydrophobicContact CB-CB 4.09Å; F320-V324 HydrophobicContact CB-CG1 4.21Å; F320-V324 HydrophobicContact CD1-CB 3.76Å; F320-V324 HydrophobicContact CD1-CG1 4.46Å; F320-V324 HydrophobicContact CD1-CG2 3.6Å; F320-V324 HydrophobicContact CD2-CG1 4.43Å; F320-V324 HydrophobicContact CE1-CB 4.33Å; F320-V324 HydrophobicContact CE1-CG2 3.64Å; F320-V324 HydrophobicContact CG-CB 3.89Å; F320-V324 HydrophobicContact CG-CG1 4.12Å; F320-V324 HydrophobicContact CG-CG2 4.06Å; F320-V324 HydrophobicContact CZ-CG2 4.14Å; R322-V324 PolarHBondContact O-N 2.99Å; V324-V328 HydrophobicContact CG2-CB 3.69Å; V324-V328 HydrophobicContact CG2-CG1 3.48Å; V324-V328 VanDerWaalsContact CG2-CG1 3.48Å; V324-L329 HydrophobicContact CG1-CD1 3.88Å; V324-L329 HydrophobicContact CG1-CD2 4.1Å; V324-L329 HydrophobicContact CG1-CG 3.92Å; V324-L329 HydrophobicContact CG2-CD2 4.41Å; V324-L329 HydrophobicContact CG2-CG 4.21Å; V324-V344 HydrophobicContact CG1-CG1 3.52Å; V324-V344 HydrophobicContact CG1-CG2 4.27Å; V324-A346 PolarHBondContact N-O 2.87Å; V324-A346 VanDerWaalsContact N-O 3.08Å; V324-N347 PolarHBondContact O-ND2 3.39Å
325	S	93.1	Very high	96.1	Very high	12 Å²	12	29.7 Å²	29.7	8%	0.084	15%	0.151	C	C	.	.			trans	-83.3	157.6	179	77.1	0	0	0	0	113.3	E302 D327 V328 L329	E302-S325 WeakPolarHBondContact OE1-CB 3.12Å; S325-D327 PolarHBondContact O-N 2.78Å; S325-V328 PolarHBondContact O-N 2.92Å; S325-V328 VanDerWaalsContact OG-CG2 3.27Å; S325-V328 WeakPolarHBondContact OG-CG2 3.12Å; S325-V328 PolarHBondContact OG-N 2.78Å; S325-L329 PolarHBondContact O-N 3.33Å; S325-L329 VanDerWaalsContact O-N 3.09Å
326	K	95.1	Very high	96.1	Very high	48 Å²	48	29.7 Å²	29.7	21%	0.209	15%	0.151	C	C	.	.	H	α-helix	trans	-55.2	-41.3	172.8	-178.6	-178.7	171.5	83.5	0	111.5	V328 L329 G330 N347 R350 P351 L352 E355	K326-V328 PolarHBondContact O-N 2.79Å; K326-L329 PolarHBondContact O-N 3.48Å; K326-G330 PolarHBondContact O-N 3.38Å; K326-N347 PolarHBondContact N-ND2 3.09Å; K326-R350 HydrophobicContact CD-CB 4.03Å; K326-P351 PolarHBondContact NZ-O 3.04Å; K326-L352 HydrophobicContact CB-CD2 4.06Å; K326-L352 HydrophobicContact CG-CD2 4.02Å; K326-E355 VanDerWaalsContact CE-OE2 3.29Å; K326-E355 WeakPolarHBondContact CE-OE2 3.47Å; K326-E355 HydrophobicContact CG-CG 4.14Å; K326-E355 WeakPolarHBondContact CG-OE2 3.4Å; K326-E355 IonicContact NZ-OE1 2.69Å; K326-E355 IonicContact NZ-OE2 3.63Å; K326-E355 PolarHBondContact NZ-OE2 3.14Å
327	D	94.4	Very high	96	Very high	113 Å²	113	31.6 Å²	31.6	60%	0.604	16%	0.163	S	C	*	.	H	α-helix	trans	-66	-37.3	-179.7	-63.4	-37.9	0	0	0	112.3	S325 G330 R331	S325-D327 PolarHBondContact O-N 2.78Å; D327-G330 PolarHBondContact O-N 3.1Å; D327-R331 WeakPolarHBondContact O-CG 3.39Å; D327-R331 PolarHBondContact O-N 2.71Å
328	V	96	Very high	96	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-46.6	174.1	174	0	0	0	0	110.6	F305 F309 F320 V324 S325 K326 G330 R331 V332	F305-V328 HydrophobicContact CB-CG2 3.45Å; F305-V328 VanDerWaalsContact CB-CG2 3.45Å; F305-V328 HydrophobicContact CD1-CG1 3.97Å; F305-V328 HydrophobicContact CD1-CG2 4.31Å; F305-V328 HydrophobicContact CD2-CG2 4.24Å; F305-V328 HydrophobicContact CE1-CG1 4.41Å; F305-V328 HydrophobicContact CG-CG1 4.25Å; F305-V328 HydrophobicContact CG-CG2 3.77Å; F309-V328 HydrophobicContact CD2-CG1 3.97Å; F309-V328 HydrophobicContact CE2-CG1 4.1Å; F320-V328 HydrophobicContact CE1-CG1 4.25Å; F320-V328 HydrophobicContact CZ-CG1 4.46Å; V324-V328 HydrophobicContact CG2-CB 3.69Å; V324-V328 HydrophobicContact CG2-CG1 3.48Å; V324-V328 VanDerWaalsContact CG2-CG1 3.48Å; S325-V328 PolarHBondContact O-N 2.92Å; S325-V328 VanDerWaalsContact OG-CG2 3.27Å; S325-V328 WeakPolarHBondContact OG-CG2 3.12Å; S325-V328 PolarHBondContact OG-N 2.78Å; K326-V328 PolarHBondContact O-N 2.79Å; V328-G330 VanDerWaalsContact C-N 3.27Å; V328-G330 PolarHBondContact O-N 2.69Å; V328-R331 WeakPolarHBondContact O-CB 3.47Å; V328-R331 PolarHBondContact O-N 3.31Å; V328-R331 VanDerWaalsContact O-N 3.12Å; V328-V332 WeakPolarHBondContact O-CG2 3.5Å; V328-V332 PolarHBondContact O-N 3.18Å
329	L	96.8	Very high	96	Very high	4 Å²	4	32 Å²	32	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-63.1	-35.1	175.9	-70.5	175.1	0	0	0	112.2	F320 V324 S325 K326 R331 V332 G333 V344 L352 E355	F320-L329 HydrophobicContact CE2-CD2 4.15Å; V324-L329 HydrophobicContact CG1-CD1 3.88Å; V324-L329 HydrophobicContact CG1-CD2 4.1Å; V324-L329 HydrophobicContact CG1-CG 3.92Å; V324-L329 HydrophobicContact CG2-CD2 4.41Å; V324-L329 HydrophobicContact CG2-CG 4.21Å; S325-L329 PolarHBondContact O-N 3.33Å; S325-L329 VanDerWaalsContact O-N 3.09Å; K326-L329 PolarHBondContact O-N 3.48Å; L329-R331 PolarHBondContact O-N 3.12Å; L329-V332 WeakPolarHBondContact O-CB 3.05Å; L329-V332 PolarHBondContact O-N 2.85Å; L329-G333 PolarHBondContact O-N 2.69Å; L329-V344 HydrophobicContact CD1-CG2 4.44Å; L329-V344 HydrophobicContact CD2-CG2 3.9Å; L329-L352 HydrophobicContact CD1-CD1 3.59Å; L329-L352 HydrophobicContact CD1-CD2 3.77Å; L329-L352 HydrophobicContact CD1-CG 4.31Å; L329-E355 HydrophobicContact CB-CB 4.18Å; L329-E355 HydrophobicContact CB-CG 3.99Å
330	G	96.4	Very high	96	Very high	10 Å²	10	30.4 Å²	30.4	10%	0.103	16%	0.16	C	C	.	.	H	α-helix	trans	-60	-45	171.7	0	0	0	0	0	112	K326 D327 V328 G333 M334	K326-G330 PolarHBondContact O-N 3.38Å; D327-G330 PolarHBondContact O-N 3.1Å; V328-G330 VanDerWaalsContact C-N 3.27Å; V328-G330 PolarHBondContact O-N 2.69Å; G330-G333 PolarHBondContact O-N 3.38Å; G330-M334 WeakPolarHBondContact O-CG 3.29Å; G330-M334 PolarHBondContact O-N 2.67Å
331	R	97.3	Very high	96.1	Very high	51 Å²	51	34 Å²	34	19%	0.192	18%	0.177	C	C	.	.	H	α-helix	trans	-62.7	-41.4	172.7	-72.4	-172.2	-71.9	169.5	-8.1	112.3	F305 D306 F308 F309 D327 V328 L329 G333 M334 T335	F305-R331 PolarHBondContact O-NH1 3.09Å; F305-R331 PolarHBondContact O-NH2 2.92Å; D306-R331 PolarHBondContact O-NH1 3.3Å; F308-R331 PolarHBondContact O-NH1 3.21Å; F309-R331 HydrophobicContact CB-CB 3.82Å; D327-R331 WeakPolarHBondContact O-CG 3.39Å; D327-R331 PolarHBondContact O-N 2.71Å; V328-R331 WeakPolarHBondContact O-CB 3.47Å; V328-R331 PolarHBondContact O-N 3.31Å; V328-R331 VanDerWaalsContact O-N 3.12Å; L329-R331 PolarHBondContact O-N 3.12Å; R331-G333 PolarHBondContact O-N 3.44Å; R331-M334 PolarHBondContact O-N 2.87Å; R331-T335 WeakPolarHBondContact O-CB 3.44Å; R331-T335 WeakPolarHBondContact O-CG2 3.45Å; R331-T335 PolarHBondContact O-N 2.98Å; R331-T335 PolarHBondContact O-OG1 3.29Å
332	V	97.8	Very high	96.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-55.7	-50.2	175.8	168.3	0	0	0	0	110.5	F309 L318 F320 V328 L329 M334 T335 C336 L339	F309-V332 HydrophobicContact CD1-CG2 3.88Å; F309-V332 HydrophobicContact CD2-CG2 4.08Å; F309-V332 HydrophobicContact CE1-CG2 3.83Å; F309-V332 HydrophobicContact CE2-CG2 4.03Å; F309-V332 HydrophobicContact CG-CG2 4Å; F309-V332 HydrophobicContact CZ-CG2 3.91Å; L318-V332 HydrophobicContact CD1-CG1 3.69Å; L318-V332 HydrophobicContact CD1-CG2 4.09Å; F320-V332 HydrophobicContact CZ-CG2 4.04Å; V328-V332 WeakPolarHBondContact O-CG2 3.5Å; V328-V332 PolarHBondContact O-N 3.18Å; L329-V332 WeakPolarHBondContact O-CB 3.05Å; L329-V332 PolarHBondContact O-N 2.85Å; V332-M334 PolarHBondContact O-N 2.79Å; V332-M334 VanDerWaalsContact O-N 3.14Å; V332-T335 PolarHBondContact O-N 3.28Å; V332-T335 VanDerWaalsContact O-N 3.1Å; V332-C336 HydrophobicContact CG1-CB 4.18Å; V332-C336 WeakPolarHBondContact O-CB 3.39Å; V332-C336 PolarHBondContact O-N 3.48Å; V332-L339 HydrophobicContact CG1-CD2 4.06Å
333	G	97	Very high	96.6	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-57.5	-30.2	177.5	0	0	0	0	0	113.5	L329 G330 R331 R362	L329-G333 PolarHBondContact O-N 2.69Å; G330-G333 PolarHBondContact O-N 3.38Å; R331-G333 PolarHBondContact O-N 3.44Å; G333-R362 WeakPolarHBondContact O-CB 3.38Å; G333-R362 WeakPolarHBondContact O-CD 3.47Å
334	M	97.3	Very high	96.9	Very high	95 Å²	95	28.1 Å²	28.1	47%	0.468	15%	0.145	S	C	.	.	H	α-helix	trans	-84.2	-26.3	178.3	-67.1	-58.5	-64.4	0	0	114.4	G330 R331 V332 R358 R362	G330-M334 WeakPolarHBondContact O-CG 3.29Å; G330-M334 PolarHBondContact O-N 2.67Å; R331-M334 PolarHBondContact O-N 2.87Å; V332-M334 PolarHBondContact O-N 2.79Å; V332-M334 VanDerWaalsContact O-N 3.14Å; M334-R358 HydrophobicContact SD-CG 4.24Å; M334-R362 VanDerWaalsContact CE-CZ 3.48Å; M334-R362 VanDerWaalsContact SD-CZ 3.58Å; M334-R362 PolarHBondContact SD-NE 3.31Å
335	T	97.5	Very high	96.8	Very high	12 Å²	12	30.1 Å²	30.1	7%	0.074	16%	0.158	C	C	.	.	H	α-helix	trans	-117.7	-8.3	-164.5	56.9	0	0	0	0	115	F309 Y311 E312 I313 R331 V332 P337	F309-T335 WeakPolarHBondContact O-CG2 3.4Å; Y311-T335 VanDerWaalsContact O-CB 3.24Å; Y311-T335 WeakPolarHBondContact O-CB 3.21Å; Y311-T335 WeakPolarHBondContact O-CG2 3.35Å; E312-T335 VanDerWaalsContact CA-O 3.31Å; E312-T335 WeakPolarHBondContact CA-O 3.37Å; I313-T335 PolarHBondContact N-O 3.05Å; R331-T335 WeakPolarHBondContact O-CB 3.44Å; R331-T335 WeakPolarHBondContact O-CG2 3.45Å; R331-T335 PolarHBondContact O-N 2.98Å; R331-T335 PolarHBondContact O-OG1 3.29Å; V332-T335 PolarHBondContact O-N 3.28Å; V332-T335 VanDerWaalsContact O-N 3.1Å; T335-P337 WeakPolarHBondContact O-CD 3.42Å
336	C	97.9	Very high	96.7	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.007	16%	0.159	C	C	.	.			trans	-117.9	63.7	-172.5	-57.5	0	0	0	0	112.4	V315 V332 R338 L339 C363	V315-C336 HydrophobicContact CG1-CB 3.71Å; V315-C336 WeakPolarHBondContact CG1-SG 3.45Å; V332-C336 HydrophobicContact CG1-CB 4.18Å; V332-C336 WeakPolarHBondContact O-CB 3.39Å; V332-C336 PolarHBondContact O-N 3.48Å; C336-R338 PolarHBondContact O-N 2.65Å; C336-L339 HydrophobicContact CB-CB 4.26Å; C336-L339 WeakPolarHBondContact O-CB 3.32Å; C336-L339 PolarHBondContact O-N 3.01Å; C336-C363 PolarHBondContact O-SG 2.83Å
337	P	97	Very high	96.4	Very high	42 Å²	42	28.4 Å²	28.4	27%	0.273	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.4	-175	28	-35.2	0	0	0	113.8	E312 T335	E312-P337 HydrophobicContact CG-CG 3.86Å; T335-P337 WeakPolarHBondContact O-CD 3.42Å
338	R	97.9	Very high	95.6	Very high	52 Å²	52	24.9 Å²	24.9	20%	0.196	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	6.1	179.4	-63.1	-177.7	73.5	-131.5	6	113.8	I286 P290 V292 P314 V315 T316 C336 V340	I286-R338 VanDerWaalsContact CD1-CZ 3.42Å; I286-R338 VanDerWaalsContact CD1-NH1 3.3Å; P290-R338 PolarHBondContact O-NH2 3.47Å; V292-R338 PolarHBondContact O-NH1 3.08Å; V292-R338 VanDerWaalsContact O-NH1 3.11Å; V292-R338 PolarHBondContact O-NH2 3.46Å; P314-R338 PolarHBondContact O-NH1 3.08Å; V315-R338 CarbonylContact O-C 3.06Å; T316-R338 HydrophobicContact CG2-CB 4.31Å; C336-R338 PolarHBondContact O-N 2.65Å; R338-V340 PolarHBondContact O-N 3.3Å
339	L	98.6	Very high	94.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.			trans	-60.9	126.9	-176.5	-166	65	0	0	0	111.1	V315 L318 V332 C336 E341 L342 I359 C363 Y365 L366	V315-L339 PolarHBondContact O-N 3.2Å; L318-L339 HydrophobicContact CB-CD1 4.03Å; L318-L339 HydrophobicContact CD1-CD1 3.72Å; L318-L339 HydrophobicContact CD1-CD2 4.5Å; L318-L339 HydrophobicContact CG-CD1 3.77Å; V332-L339 HydrophobicContact CG1-CD2 4.06Å; C336-L339 HydrophobicContact CB-CB 4.26Å; C336-L339 WeakPolarHBondContact O-CB 3.32Å; C336-L339 PolarHBondContact O-N 3.01Å; L339-E341 VanDerWaalsContact CD1-O 3.32Å; L339-E341 WeakPolarHBondContact CD1-O 3.4Å; L339-L342 HydrophobicContact CD2-CB 4.07Å; L339-L342 HydrophobicContact CD2-CD2 4.41Å; L339-I359 HydrophobicContact CD2-CG2 4.44Å; L339-C363 HydrophobicContact CB-CB 4Å; L339-Y365 CarbonylContact O-C 3.57Å; L339-Y365 VanDerWaalsContact O-C 3.26Å; L339-L366 HydrophobicContact CD2-CD1 4.19Å; L339-L366 HydrophobicContact CG-CD1 4.04Å; L339-L366 VanDerWaalsContact O-CA 3.26Å; L339-L366 WeakPolarHBondContact O-CA 3.34Å; L339-L366 PolarHBondContact O-N 3.49Å
340	V	98.6	Very high	94.4	Very high	36 Å²	36	40 Å²	40	22%	0.218	21%	0.21	C	C	.	.			trans	-110.1	-42.9	179.6	177.6	0	0	0	0	109.8	T316 R338 S367 A368	T316-V340 WeakPolarHBondContact O-CA 3.4Å; T316-V340 WeakPolarHBondContact O-CB 3.31Å; T316-V340 PolarHBondContact O-N 3.18Å; R338-V340 PolarHBondContact O-N 3.3Å; V340-S367 WeakPolarHBondContact CG1-OG 3.45Å; V340-S367 PolarHBondContact O-N 2.89Å; V340-S367 PolarHBondContact O-OG 3.24Å; V340-A368 PolarHBondContact O-N 3.05Å; V340-A368 VanDerWaalsContact O-N 3.08Å
341	E	98.8	Very high	94.3	Very high	77 Å²	77	42.1 Å²	42.1	36%	0.36	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.8	179.3	-177	166.4	-162.9	0	0	111.3	T316 H317 L318 L339 V343 A368	T316-E341 PolarHBondContact O-N 3.3Å; T316-E341 VanDerWaalsContact O-N 3.13Å; H317-E341 WeakPolarHBondContact CA-O 3.36Å; H317-E341 HydrophobicContact CB-CB 4.36Å; H317-E341 IonicContact CD2-OE2 3.96Å; H317-E341 PolarHBondContact CD2-OE2 3.33Å; L318-E341 PolarHBondContact N-O 3.12Å; L339-E341 VanDerWaalsContact CD1-O 3.32Å; L339-E341 WeakPolarHBondContact CD1-O 3.4Å; E341-V343 HydrophobicContact CG-CG2 4.18Å; E341-A368 WeakPolarHBondContact CA-O 3.36Å; E341-A368 HydrophobicContact CB-CB 3.97Å; E341-A368 HydrophobicContact CG-CB 3.7Å
342	L	98.6	Very high	94.3	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	121.8	173.2	175.9	61.2	0	0	0	109.8	L318 F320 L339 V344 I359 L366 A368 V369 G370	L318-L342 HydrophobicContact CB-CD1 3.89Å; L318-L342 WeakPolarHBondContact O-CA 3.43Å; F320-L342 HydrophobicContact CD2-CD1 4.02Å; F320-L342 HydrophobicContact CE2-CD1 3.73Å; L339-L342 HydrophobicContact CD2-CB 4.07Å; L339-L342 HydrophobicContact CD2-CD2 4.41Å; L342-V344 HydrophobicContact CD1-CG2 4.06Å; L342-V344 HydrophobicContact CG-CG2 4.22Å; L342-I359 HydrophobicContact CD2-CD1 3.81Å; L342-L366 HydrophobicContact CB-CD1 4.26Å; L342-A368 PolarHBondContact N-O 3.13Å; L342-V369 CarbonylContact O-C 3.58Å; L342-V369 VanDerWaalsContact O-CA 3.29Å; L342-V369 WeakPolarHBondContact O-CA 3.26Å; L342-G370 PolarHBondContact O-N 2.76Å
343	V	98.3	Very high	94.3	Very high	32 Å²	32	41.5 Å²	41.5	19%	0.194	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	125.4	173.2	-179.4	0	0	0	0	109.2	L318 Y319 F320 E341 G370	L318-V343 PolarHBondContact O-N 3.23Å; Y319-V343 WeakPolarHBondContact CA-O 3.34Å; Y319-V343 HydrophobicContact CD2-CB 3.66Å; Y319-V343 HydrophobicContact CD2-CG1 3.58Å; Y319-V343 HydrophobicContact CD2-CG2 4.44Å; Y319-V343 HydrophobicContact CE2-CB 4.26Å; Y319-V343 HydrophobicContact CE2-CG1 3.65Å; F320-V343 PolarHBondContact N-O 2.99Å; E341-V343 HydrophobicContact CG-CG2 4.18Å; V343-G370 CarbonylContact C-O 3.5Å; V343-G370 VanDerWaalsContact CA-O 3.32Å; V343-G370 WeakPolarHBondContact CA-O 3.39Å
344	V	97	Very high	94.3	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	113.4	177.1	177.6	0	0	0	0	107.9	F320 V324 L329 L342 A346 G370 L371 G372	F320-V344 HydrophobicContact CD2-CG2 3.96Å; V324-V344 HydrophobicContact CG1-CG1 3.52Å; V324-V344 HydrophobicContact CG1-CG2 4.27Å; L329-V344 HydrophobicContact CD1-CG2 4.44Å; L329-V344 HydrophobicContact CD2-CG2 3.9Å; L342-V344 HydrophobicContact CD1-CG2 4.06Å; L342-V344 HydrophobicContact CG-CG2 4.22Å; V344-A346 WeakPolarHBondContact CG1-O 3.23Å; V344-G370 PolarHBondContact N-O 3.33Å; V344-L371 HydrophobicContact CB-CD2 3.9Å; V344-L371 HydrophobicContact CG2-CD2 4.1Å; V344-G372 PolarHBondContact O-N 2.99Å
345	C	92.6	Very high	94.3	Very high	42 Å²	42	43.2 Å²	43.2	28%	0.284	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	-34.1	179.6	-62.5	0	0	0	0	112.6	Y319 F320 G372 E373	Y319-C345 VanDerWaalsContact CZ-SG 3.58Å; Y319-C345 PolarHBondContact OH-SG 3.06Å; F320-C345 WeakPolarHBondContact O-CB 3.44Å; F320-C345 PolarHBondContact O-N 3.45Å; F320-C345 PolarHBondContact O-SG 2.84Å; C345-G372 CarbonylContact C-O 3.38Å; C345-G372 CarbonylContact O-C 3.58Å; C345-E373 WeakPolarHBondContact O-CB 3.41Å
346	A	90.6	Very high	94.3	Very high	13 Å²	13	42.8 Å²	42.8	11%	0.107	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	150.2	179	0	0	0	0	0	111.9	S323 V324 V344 E373	S323-A346 WeakPolarHBondContact CA-O 3.33Å; V324-A346 PolarHBondContact N-O 2.87Å; V324-A346 VanDerWaalsContact N-O 3.08Å; V344-A346 WeakPolarHBondContact CG1-O 3.23Å; A346-E373 CarbonylContact C-O 3.57Å; A346-E373 WeakPolarHBondContact CA-O 3.4Å; A346-E373 HydrophobicContact CB-CB 3.77Å
347	N	87.4	Confident	94.3	Very high	12 Å²	12	44.8 Å²	44.8	6%	0.064	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	155.1	169.5	-179.8	-99.8	0	0	0	108.9	V324 K326 R350 L352 E373 C374	V324-N347 PolarHBondContact O-ND2 3.39Å; K326-N347 PolarHBondContact N-ND2 3.09Å; N347-R350 PolarHBondContact OD1-O 3.34Å; N347-L352 HydrophobicContact CB-CD1 3.93Å; N347-L352 WeakPolarHBondContact OD1-CD2 3.5Å; N347-E373 PolarHBondContact N-O 3.25Å; N347-C374 HydrophobicContact CB-CB 3.48Å; N347-C374 VanDerWaalsContact CB-CB 3.48Å
348	G	79.4	Confident	94.4	Very high	39 Å²	39	45.8 Å²	45.8	40%	0.402	24%	0.235	S	C	.	.			trans	-60.8	-173.2	177.2	0	0	0	0	0	114.6	R350	G348-R350 PolarHBondContact O-N 3.43Å
349	L	78	Confident	94.4	Very high	154 Å²	154	43.4 Å²	43.4	81%	0.806	23%	0.226	S	C	*	.	S	Bend	trans	-74.1	17.7	-172.2	-56.1	172.3	0	0	0	115.4
350	R	89.4	Confident	94.4	Very high	168 Å²	168	43.4 Å²	43.4	63%	0.634	23%	0.226	S	C	*	.	S	Bend	trans	-109.9	127.7	-176.6	-71	-171.5	-177.8	178.3	3.6	109.6	K326 N347 G348 L352	K326-R350 HydrophobicContact CD-CB 4.03Å; N347-R350 PolarHBondContact OD1-O 3.34Å; G348-R350 PolarHBondContact O-N 3.43Å; R350-L352 PolarHBondContact O-N 3.06Å
351	P	93.7	Very high	94.3	Very high	54 Å²	54	46.9 Å²	46.9	35%	0.351	24%	0.24	S	C	.	.			trans	-55.8	136.5	176.3	-27.3	34.1	0	0	0	112.9	K326 E375 I403	K326-P351 PolarHBondContact NZ-O 3.04Å; P351-E375 CarbonylContact C-O 3.55Å; P351-E375 VanDerWaalsContact CA-O 3.26Å; P351-E375 WeakPolarHBondContact CA-O 3.26Å; P351-E375 HydrophobicContact CG-CB 4.41Å; P351-I403 HydrophobicContact CG-CD1 4.43Å
352	L	96.8	Very high	94.2	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.244	C	C	.	.			trans	-94	16.6	-175.4	-66.5	179.4	0	0	0	114.1	K326 L329 N347 R350 E354 E355 L356 C374 E375 V376	K326-L352 HydrophobicContact CB-CD2 4.06Å; K326-L352 HydrophobicContact CG-CD2 4.02Å; L329-L352 HydrophobicContact CD1-CD1 3.59Å; L329-L352 HydrophobicContact CD1-CD2 3.77Å; L329-L352 HydrophobicContact CD1-CG 4.31Å; N347-L352 HydrophobicContact CB-CD1 3.93Å; N347-L352 WeakPolarHBondContact OD1-CD2 3.5Å; R350-L352 PolarHBondContact O-N 3.06Å; L352-E354 PolarHBondContact O-N 3.34Å; L352-E355 HydrophobicContact CD2-CG 4.48Å; L352-E355 PolarHBondContact O-N 3Å; L352-E355 VanDerWaalsContact O-N 3.11Å; L352-L356 PolarHBondContact O-N 3.04Å; L352-C374 HydrophobicContact CD1-CB 3.97Å; L352-E375 PolarHBondContact N-O 3.45Å; L352-V376 HydrophobicContact CB-CG2 4.27Å
353	D	97.5	Very high	94.2	Very high	37 Å²	37	48.8 Å²	48.8	20%	0.198	24%	0.244	C	C	.	.	H	α-helix	trans	-47.5	-56.7	-174.8	-65.7	13.6	0	0	0	113.2	E355 L356 I357 S377 A380	D353-E355 VanDerWaalsContact C-N 3.34Å; D353-E355 PolarHBondContact O-N 3.14Å; D353-L356 PolarHBondContact O-N 3.14Å; D353-I357 VanDerWaalsContact O-CG1 3.3Å; D353-I357 WeakPolarHBondContact O-CG1 3.49Å; D353-I357 PolarHBondContact O-N 3.43Å; D353-I357 VanDerWaalsContact O-N 3.08Å; D353-S377 VanDerWaalsContact CG-OG 3.3Å; D353-S377 PolarHBondContact OD1-N 2.9Å; D353-S377 VanDerWaalsContact OD2-CB 3.25Å; D353-S377 WeakPolarHBondContact OD2-CB 3.47Å; D353-S377 PolarHBondContact OD2-OG 3.45Å; D353-A380 HydrophobicContact CB-CB 3.46Å; D353-A380 VanDerWaalsContact CB-CB 3.46Å
354	E	97.7	Very high	94.1	Very high	121 Å²	121	53.6 Å²	53.6	57%	0.565	26%	0.262	S	S	*	.	H	α-helix	trans	-66.4	-35.7	-178.5	-65.9	-175.7	-173.3	0	0	112.7	L352 R358	L352-E354 PolarHBondContact O-N 3.34Å; E354-R358 WeakPolarHBondContact O-CB 3.48Å; E354-R358 PolarHBondContact O-N 2.94Å; E354-R358 IonicContact OE2-NH2 3.95Å
355	E	97.9	Very high	94.1	Very high	11 Å²	11	61.3 Å²	61.3	5%	0.051	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-45.6	-179.6	-75.8	58	-120.9	0	0	110.4	K326 L329 L352 D353 R358 I359	K326-E355 VanDerWaalsContact CE-OE2 3.29Å; K326-E355 WeakPolarHBondContact CE-OE2 3.47Å; K326-E355 HydrophobicContact CG-CG 4.14Å; K326-E355 WeakPolarHBondContact CG-OE2 3.4Å; K326-E355 IonicContact NZ-OE1 2.69Å; K326-E355 IonicContact NZ-OE2 3.63Å; K326-E355 PolarHBondContact NZ-OE2 3.14Å; L329-E355 HydrophobicContact CB-CB 4.18Å; L329-E355 HydrophobicContact CB-CG 3.99Å; L352-E355 HydrophobicContact CD2-CG 4.48Å; L352-E355 PolarHBondContact O-N 3Å; L352-E355 VanDerWaalsContact O-N 3.11Å; D353-E355 VanDerWaalsContact C-N 3.34Å; D353-E355 PolarHBondContact O-N 3.14Å; E355-R358 PolarHBondContact O-N 3.16Å; E355-R358 IonicContact OE1-CZ 2.68Å; E355-R358 IonicContact OE1-NH1 2.65Å; E355-R358 PolarHBondContact OE1-NH1 2.65Å; E355-R358 IonicContact OE1-NH2 3.87Å; E355-I359 WeakPolarHBondContact O-CB 3.26Å; E355-I359 WeakPolarHBondContact O-CD1 3.38Å; E355-I359 WeakPolarHBondContact O-CG1 3.39Å; E355-I359 PolarHBondContact O-N 3.15Å
356	L	97.5	Very high	94.4	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-64.8	-44.9	176.5	-74.4	-177.8	0	0	0	112	L352 D353 R358 I359 A360 L371 V376 F384	L352-L356 PolarHBondContact O-N 3.04Å; D353-L356 PolarHBondContact O-N 3.14Å; L356-R358 VanDerWaalsContact C-N 3.31Å; L356-R358 PolarHBondContact O-N 2.85Å; L356-I359 PolarHBondContact O-N 3.34Å; L356-A360 WeakPolarHBondContact O-CB 3.01Å; L356-A360 PolarHBondContact O-N 3.33Å; L356-L371 HydrophobicContact CD1-CD1 3.76Å; L356-L371 HydrophobicContact CD2-CD1 4.12Å; L356-V376 HydrophobicContact CD1-CB 4.39Å; L356-V376 HydrophobicContact CD1-CG1 3.79Å; L356-V376 HydrophobicContact CD1-CG2 3.61Å; L356-F384 HydrophobicContact CB-CB 4.45Å; L356-F384 HydrophobicContact CB-CD2 3.9Å; L356-F384 HydrophobicContact CB-CG 4.27Å; L356-F384 HydrophobicContact CD2-CE2 4.45Å; L356-F384 VanDerWaalsContact O-CD2 3.31Å; L356-F384 WeakPolarHBondContact O-CD2 3.41Å
357	I	98.3	Very high	94.7	Very high	43 Å²	43	60.1 Å²	60.1	22%	0.221	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-45.4	176.9	-69.3	169.9	0	0	0	110.2	D353 I359 A360 E361 A380 E383 M387	D353-I357 VanDerWaalsContact O-CG1 3.3Å; D353-I357 WeakPolarHBondContact O-CG1 3.49Å; D353-I357 PolarHBondContact O-N 3.43Å; D353-I357 VanDerWaalsContact O-N 3.08Å; I357-I359 PolarHBondContact O-N 2.91Å; I357-A360 PolarHBondContact O-N 3.45Å; I357-E361 WeakPolarHBondContact O-CB 3.35Å; I357-E361 PolarHBondContact O-N 3.24Å; I357-A380 HydrophobicContact CD1-CB 4.43Å; I357-E383 HydrophobicContact CD1-CG 4.44Å; I357-M387 HydrophobicContact CG2-CE 4.39Å; I357-M387 HydrophobicContact CG2-SD 3.96Å
358	R	98.1	Very high	95.3	Very high	63 Å²	63	59.9 Å²	59.9	24%	0.238	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-41.8	177.2	-173.1	-177.3	-61	125.6	5.1	112.1	M334 E354 E355 L356 E361 R362	M334-R358 HydrophobicContact SD-CG 4.24Å; E354-R358 WeakPolarHBondContact O-CB 3.48Å; E354-R358 PolarHBondContact O-N 2.94Å; E354-R358 IonicContact OE2-NH2 3.95Å; E355-R358 PolarHBondContact O-N 3.16Å; E355-R358 IonicContact OE1-CZ 2.68Å; E355-R358 IonicContact OE1-NH1 2.65Å; E355-R358 PolarHBondContact OE1-NH1 2.65Å; E355-R358 IonicContact OE1-NH2 3.87Å; L356-R358 VanDerWaalsContact C-N 3.31Å; L356-R358 PolarHBondContact O-N 2.85Å; R358-E361 PolarHBondContact O-N 2.85Å; R358-R362 PolarHBondContact O-N 3.17Å
359	I	98.1	Very high	96.2	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-46.1	175.1	-73	163.5	0	0	0	110.4	L339 L342 E355 L356 I357 E361 R362 C363 L366	L339-I359 HydrophobicContact CD2-CG2 4.44Å; L342-I359 HydrophobicContact CD2-CD1 3.81Å; E355-I359 WeakPolarHBondContact O-CB 3.26Å; E355-I359 WeakPolarHBondContact O-CD1 3.38Å; E355-I359 WeakPolarHBondContact O-CG1 3.39Å; E355-I359 PolarHBondContact O-N 3.15Å; L356-I359 PolarHBondContact O-N 3.34Å; I357-I359 PolarHBondContact O-N 2.91Å; I359-E361 VanDerWaalsContact C-N 3.27Å; I359-E361 PolarHBondContact O-N 3.15Å; I359-R362 PolarHBondContact O-N 2.83Å; I359-C363 HydrophobicContact CG2-CB 4.28Å; I359-C363 WeakPolarHBondContact O-CA 3.43Å; I359-C363 WeakPolarHBondContact O-CB 3.45Å; I359-C363 PolarHBondContact O-N 3.44Å; I359-C363 PolarHBondContact O-SG 3.49Å; I359-L366 HydrophobicContact CG2-CD2 3.76Å
360	A	97.5	Very high	97.1	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-38.5	175.2	0	0	0	0	0	112.5	L356 I357 F384 M387 C388 R391	L356-A360 WeakPolarHBondContact O-CB 3.01Å; L356-A360 PolarHBondContact O-N 3.33Å; I357-A360 PolarHBondContact O-N 3.45Å; A360-F384 HydrophobicContact CB-CD2 3.59Å; A360-F384 HydrophobicContact CB-CE2 3.81Å; A360-M387 HydrophobicContact CB-CB 3.93Å; A360-M387 HydrophobicContact CB-CE 4.26Å; A360-M387 HydrophobicContact CB-SD 4.18Å; A360-C388 VanDerWaalsContact CB-SG 3.5Å; A360-R391 PolarHBondContact O-NH2 3.27Å
361	E	97.3	Very high	97.5	Very high	108 Å²	108	43.8 Å²	43.8	51%	0.505	20%	0.204	S	C	.	.	H	α-helix	trans	-66.6	-46.5	178.8	-167.1	-176.8	-166.5	0	0	111.7	I357 R358 I359 K364 M387	I357-E361 WeakPolarHBondContact O-CB 3.35Å; I357-E361 PolarHBondContact O-N 3.24Å; R358-E361 PolarHBondContact O-N 2.85Å; I359-E361 VanDerWaalsContact C-N 3.27Å; I359-E361 PolarHBondContact O-N 3.15Å; E361-K364 WeakPolarHBondContact O-CD 3.43Å; E361-K364 WeakPolarHBondContact O-CE 3.16Å; E361-K364 PolarHBondContact O-NZ 3.08Å; E361-M387 HydrophobicContact CB-CE 3.82Å; E361-M387 HydrophobicContact CG-CE 4.34Å
362	R	97.3	Very high	97.5	Very high	120 Å²	120	41.8 Å²	41.8	45%	0.453	19%	0.193	S	C	.	.	H	α-helix	trans	-94.9	-34.1	-170.1	-69	-179.6	168.3	-109.3	-2.7	113.9	G333 M334 R358 I359 K364	G333-R362 WeakPolarHBondContact O-CB 3.38Å; G333-R362 WeakPolarHBondContact O-CD 3.47Å; M334-R362 VanDerWaalsContact CE-CZ 3.48Å; M334-R362 VanDerWaalsContact SD-CZ 3.58Å; M334-R362 PolarHBondContact SD-NE 3.31Å; R358-R362 PolarHBondContact O-N 3.17Å; I359-R362 PolarHBondContact O-N 2.83Å; R362-K364 PolarHBondContact O-N 3.35Å; R362-K364 VanDerWaalsContact O-N 3.13Å
363	C	97.5	Very high	97.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.223	C	C	.	.			trans	-89	76.3	-177.2	-53.7	0	0	0	0	110.6	C336 L339 I359 Y365 L366 R391	C336-C363 PolarHBondContact O-SG 2.83Å; L339-C363 HydrophobicContact CB-CB 4Å; I359-C363 HydrophobicContact CG2-CB 4.28Å; I359-C363 WeakPolarHBondContact O-CA 3.43Å; I359-C363 WeakPolarHBondContact O-CB 3.45Å; I359-C363 PolarHBondContact O-N 3.44Å; I359-C363 PolarHBondContact O-SG 3.49Å; C363-Y365 PolarHBondContact O-N 2.88Å; C363-Y365 VanDerWaalsContact O-N 3.13Å; C363-L366 HydrophobicContact CB-CB 4.12Å; C363-L366 VanDerWaalsContact O-CB 3.32Å; C363-L366 WeakPolarHBondContact O-CB 3.41Å; C363-L366 PolarHBondContact O-N 2.86Å; C363-R391 VanDerWaalsContact O-CZ 3.3Å; C363-R391 PolarHBondContact O-NH1 3Å; C363-R391 PolarHBondContact O-NH2 2.82Å
364	K	96.5	Very high	97.1	Very high	133 Å²	133	46.8 Å²	46.8	58%	0.578	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-9.5	-175.6	-60.5	-52.3	-165.7	-166.7	0	115.1	E361 R362 R391	E361-K364 WeakPolarHBondContact O-CD 3.43Å; E361-K364 WeakPolarHBondContact O-CE 3.16Å; E361-K364 PolarHBondContact O-NZ 3.08Å; R362-K364 PolarHBondContact O-N 3.35Å; R362-K364 VanDerWaalsContact O-N 3.13Å; K364-R391 PolarHBondContact O-NH1 3.38Å
365	Y	97	Very high	97	Very high	162 Å²	162	44 Å²	44	64%	0.635	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-6	176.7	-60.2	-74.4	0	0	0	114.3	L339 C363 S367	L339-Y365 CarbonylContact O-C 3.57Å; L339-Y365 VanDerWaalsContact O-C 3.26Å; C363-Y365 PolarHBondContact O-N 2.88Å; C363-Y365 VanDerWaalsContact O-N 3.13Å; Y365-S367 PolarHBondContact O-N 3.01Å
366	L	98.4	Very high	97	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.2	C	C	.	.			trans	-53.7	120	178.3	-169.6	73.1	0	0	0	111.8	L339 L342 I359 C363 V369 F384 R391 L392	L339-L366 HydrophobicContact CD2-CD1 4.19Å; L339-L366 HydrophobicContact CG-CD1 4.04Å; L339-L366 VanDerWaalsContact O-CA 3.26Å; L339-L366 WeakPolarHBondContact O-CA 3.34Å; L339-L366 PolarHBondContact O-N 3.49Å; L342-L366 HydrophobicContact CB-CD1 4.26Å; I359-L366 HydrophobicContact CG2-CD2 3.76Å; C363-L366 HydrophobicContact CB-CB 4.12Å; C363-L366 VanDerWaalsContact O-CB 3.32Å; C363-L366 WeakPolarHBondContact O-CB 3.41Å; C363-L366 PolarHBondContact O-N 2.86Å; L366-V369 HydrophobicContact CD1-CG2 3.98Å; L366-V369 HydrophobicContact CD2-CG2 3.63Å; L366-V369 HydrophobicContact CG-CG2 3.88Å; L366-F384 HydrophobicContact CD2-CE2 4.16Å; L366-F384 HydrophobicContact CD2-CZ 4.06Å; L366-R391 WeakPolarHBondContact O-CG 3.37Å; L366-R391 PolarHBondContact O-NH1 2.89Å; L366-L392 HydrophobicContact CG-CD2 4.44Å
367	S	98.3	Very high	97	Very high	31 Å²	31	44.3 Å²	44.3	22%	0.217	21%	0.207	C	C	.	.			trans	-129.9	-9.5	-177.9	61.5	0	0	0	0	113.7	V340 Y365 R391 L392 S393 Q394	V340-S367 WeakPolarHBondContact CG1-OG 3.45Å; V340-S367 PolarHBondContact O-N 2.89Å; V340-S367 PolarHBondContact O-OG 3.24Å; Y365-S367 PolarHBondContact O-N 3.01Å; S367-R391 VanDerWaalsContact CA-O 3.28Å; S367-R391 WeakPolarHBondContact CA-O 3.29Å; S367-R391 VanDerWaalsContact CB-O 3.32Å; S367-R391 WeakPolarHBondContact CB-O 3.49Å; S367-L392 CarbonylContact O-C 3.36Å; S367-S393 WeakPolarHBondContact O-CA 3.45Å; S367-S393 PolarHBondContact O-N 3.44Å; S367-S393 PolarHBondContact O-OG 2.89Å; S367-Q394 PolarHBondContact O-N 3.47Å
368	A	98.6	Very high	96.9	Very high	7 Å²	7	42.3 Å²	42.3	6%	0.058	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	128.5	178.5	0	0	0	0	0	110.2	V340 E341 L342 Q394	V340-A368 PolarHBondContact O-N 3.05Å; V340-A368 VanDerWaalsContact O-N 3.08Å; E341-A368 WeakPolarHBondContact CA-O 3.36Å; E341-A368 HydrophobicContact CB-CB 3.97Å; E341-A368 HydrophobicContact CG-CB 3.7Å; L342-A368 PolarHBondContact N-O 3.13Å; A368-Q394 WeakPolarHBondContact CA-O 3.41Å; A368-Q394 HydrophobicContact CB-CB 3.86Å; A368-Q394 HydrophobicContact CB-CG 4.47Å
369	V	98.4	Very high	96.9	Very high	5 Å²	5	41 Å²	41	3%	0.03	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.6	172.9	175.8	0	0	0	0	110.3	L342 L366 L371 F384 L392 Q394 L395 S396	L342-V369 CarbonylContact O-C 3.58Å; L342-V369 VanDerWaalsContact O-CA 3.29Å; L342-V369 WeakPolarHBondContact O-CA 3.26Å; L366-V369 HydrophobicContact CD1-CG2 3.98Å; L366-V369 HydrophobicContact CD2-CG2 3.63Å; L366-V369 HydrophobicContact CG-CG2 3.88Å; V369-L371 HydrophobicContact CG1-CD1 4.4Å; V369-L371 HydrophobicContact CG1-CD2 4.18Å; V369-L371 HydrophobicContact CG1-CG 3.9Å; V369-F384 HydrophobicContact CG2-CZ 3.92Å; V369-L392 HydrophobicContact CG2-CD2 4.32Å; V369-Q394 PolarHBondContact N-O 3.32Å; V369-Q394 VanDerWaalsContact N-O 3.11Å; V369-L395 HydrophobicContact CB-CD1 4.1Å; V369-L395 HydrophobicContact CG1-CD1 4.48Å; V369-L395 WeakPolarHBondContact O-CA 3.25Å; V369-S396 PolarHBondContact O-N 3.02Å
370	G	98	Very high	96.9	Very high	10 Å²	10	41.3 Å²	41.3	10%	0.103	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.4	172	0	0	0	0	0	110.3	L342 V343 V344 S396	L342-G370 PolarHBondContact O-N 2.76Å; V343-G370 CarbonylContact C-O 3.5Å; V343-G370 VanDerWaalsContact CA-O 3.32Å; V343-G370 WeakPolarHBondContact CA-O 3.39Å; V344-G370 PolarHBondContact N-O 3.33Å; G370-S396 CarbonylContact C-O 3.26Å; G370-S396 WeakPolarHBondContact CA-O 3.45Å
371	L	96.9	Very high	96.9	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.042	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.3	175	-57.6	178.8	0	0	0	110.5	V344 L356 V369 V376 S396 I397 M398 V401	V344-L371 HydrophobicContact CB-CD2 3.9Å; V344-L371 HydrophobicContact CG2-CD2 4.1Å; L356-L371 HydrophobicContact CD1-CD1 3.76Å; L356-L371 HydrophobicContact CD2-CD1 4.12Å; V369-L371 HydrophobicContact CG1-CD1 4.4Å; V369-L371 HydrophobicContact CG1-CD2 4.18Å; V369-L371 HydrophobicContact CG1-CG 3.9Å; L371-V376 HydrophobicContact CD1-CG2 4.23Å; L371-S396 PolarHBondContact N-O 3.45Å; L371-I397 HydrophobicContact CB-CD1 3.67Å; L371-I397 HydrophobicContact CD1-CD1 3.79Å; L371-I397 HydrophobicContact CG-CD1 3.7Å; L371-M398 PolarHBondContact O-N 3.35Å; L371-M398 VanDerWaalsContact O-N 3.16Å; L371-V401 HydrophobicContact CB-CG1 4.32Å
372	G	93.9	Very high	97	Very high	11 Å²	11	36.4 Å²	36.4	11%	0.113	18%	0.177	C	C	.	.			trans	-129.3	162.1	169.6	0	0	0	0	0	110.9	V344 C345 C374	V344-G372 PolarHBondContact O-N 2.99Å; C345-G372 CarbonylContact C-O 3.38Å; C345-G372 CarbonylContact O-C 3.58Å; G372-C374 VanDerWaalsContact C-N 3.26Å; G372-C374 PolarHBondContact O-N 3.3Å; G372-C374 PolarHBondContact O-SG 3.48Å; G372-C374 VanDerWaalsContact O-SG 3.36Å
373	E	92.4	Very high	97	Very high	136 Å²	136	35.4 Å²	35.4	64%	0.636	18%	0.177	S	C	*	.	S	Bend	trans	37	51.9	175.4	-59.2	-176.9	-169.4	0	0	114	C345 A346 N347	C345-E373 WeakPolarHBondContact O-CB 3.41Å; A346-E373 CarbonylContact C-O 3.57Å; A346-E373 WeakPolarHBondContact CA-O 3.4Å; A346-E373 HydrophobicContact CB-CB 3.77Å; N347-E373 PolarHBondContact N-O 3.25Å
374	C	93.9	Very high	97	Very high	8 Å²	8	35.5 Å²	35.5	5%	0.054	18%	0.177	C	C	.	.			trans	-146.1	-178.8	178	60	0	0	0	0	109.8	N347 L352 G372 V401	N347-C374 HydrophobicContact CB-CB 3.48Å; N347-C374 VanDerWaalsContact CB-CB 3.48Å; L352-C374 HydrophobicContact CD1-CB 3.97Å; G372-C374 VanDerWaalsContact C-N 3.26Å; G372-C374 PolarHBondContact O-N 3.3Å; G372-C374 PolarHBondContact O-SG 3.48Å; G372-C374 VanDerWaalsContact O-SG 3.36Å; C374-V401 VanDerWaalsContact O-CA 3.25Å; C374-V401 WeakPolarHBondContact O-CA 3.43Å; C374-V401 VanDerWaalsContact SG-CG1 3.55Å
375	E	95.6	Very high	97.1	Very high	62 Å²	62	29.1 Å²	29.1	29%	0.29	15%	0.15	S	C	.	.			trans	-127.1	133.8	-177.3	-72.9	-173.1	174.9	0	0	111.2	P351 L352 I403	P351-E375 CarbonylContact C-O 3.55Å; P351-E375 VanDerWaalsContact CA-O 3.26Å; P351-E375 WeakPolarHBondContact CA-O 3.26Å; P351-E375 HydrophobicContact CG-CB 4.41Å; L352-E375 PolarHBondContact N-O 3.45Å; E375-I403 HydrophobicContact CB-CD1 3.59Å; E375-I403 HydrophobicContact CB-CG1 4.35Å; E375-I403 HydrophobicContact CG-CD1 3.72Å; E375-I403 HydrophobicContact CG-CG1 4.44Å
376	V	97.2	Very high	97.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	130.4	173.6	-172.9	0	0	0	0	108.9	L352 L356 L371 A380 F381 V401 I403	L352-V376 HydrophobicContact CB-CG2 4.27Å; L356-V376 HydrophobicContact CD1-CB 4.39Å; L356-V376 HydrophobicContact CD1-CG1 3.79Å; L356-V376 HydrophobicContact CD1-CG2 3.61Å; L371-V376 HydrophobicContact CD1-CG2 4.23Å; V376-A380 HydrophobicContact CG1-CB 4.37Å; V376-F381 HydrophobicContact CG1-CB 3.91Å; V376-V401 HydrophobicContact CB-CG1 4.35Å; V376-V401 HydrophobicContact CG2-CG1 3.87Å; V376-V401 PolarHBondContact N-O 2.55Å; V376-I403 PolarHBondContact O-N 2.78Å
377	S	97.4	Very high	97.1	Very high	22 Å²	22	31.8 Å²	31.8	15%	0.154	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	143.6	173.2	73.4	0	0	0	0	111.5	D353 S379 A380 F381 I403	D353-S377 VanDerWaalsContact CG-OG 3.3Å; D353-S377 PolarHBondContact OD1-N 2.9Å; D353-S377 VanDerWaalsContact OD2-CB 3.25Å; D353-S377 WeakPolarHBondContact OD2-CB 3.47Å; D353-S377 PolarHBondContact OD2-OG 3.45Å; S377-S379 PolarHBondContact O-N 2.68Å; S377-A380 PolarHBondContact O-N 3.21Å; S377-A380 VanDerWaalsContact O-N 3.14Å; S377-A380 VanDerWaalsContact OG-CB 3.24Å; S377-A380 WeakPolarHBondContact OG-CB 3.33Å; S377-A380 PolarHBondContact OG-N 2.88Å; S377-F381 PolarHBondContact O-N 3.45Å; S377-I403 WeakPolarHBondContact CA-O 3.48Å
378	C	97.6	Very high	97.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.5	-38.3	179.6	-70.2	0	0	0	0	111.7	F381 V382 I403 I413	C378-F381 PolarHBondContact O-N 2.87Å; C378-V382 VanDerWaalsContact O-CG2 3.31Å; C378-V382 WeakPolarHBondContact O-CG2 3.32Å; C378-V382 PolarHBondContact O-N 2.95Å; C378-I403 PolarHBondContact N-O 3.45Å; C378-I403 VanDerWaalsContact SG-C 3.54Å; C378-I403 PolarHBondContact SG-O 2.96Å; C378-I413 HydrophobicContact CB-CD1 3.84Å; C378-I413 HydrophobicContact CB-CG1 4.48Å
379	S	97.4	Very high	96.8	Very high	37 Å²	37	31.1 Å²	31.1	26%	0.259	16%	0.164	S	C	.	.	H	α-helix	trans	-62.4	-47.3	175.7	-70	0	0	0	0	112.7	S377 F381 V382 E383 D405	S377-S379 PolarHBondContact O-N 2.68Å; S379-F381 VanDerWaalsContact C-N 3.34Å; S379-V382 PolarHBondContact O-N 3.33Å; S379-E383 WeakPolarHBondContact O-CB 3.5Å; S379-E383 PolarHBondContact O-N 3.15Å; S379-D405 WeakPolarHBondContact CA-OD2 3.48Å; S379-D405 WeakPolarHBondContact CB-OD2 3.5Å; S379-D405 PolarHBondContact N-OD2 2.98Å; S379-D405 PolarHBondContact OG-OD1 2.79Å; S379-D405 VanDerWaalsContact OG-OD1 3.14Å; S379-D405 PolarHBondContact OG-OD2 3.02Å
380	A	97.9	Very high	96.5	Very high	6 Å²	6	34 Å²	34	5%	0.05	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-37.9	178.4	0	0	0	0	0	111.6	D353 I357 V376 S377 E383 F384	D353-A380 HydrophobicContact CB-CB 3.46Å; D353-A380 VanDerWaalsContact CB-CB 3.46Å; I357-A380 HydrophobicContact CD1-CB 4.43Å; V376-A380 HydrophobicContact CG1-CB 4.37Å; S377-A380 PolarHBondContact O-N 3.21Å; S377-A380 VanDerWaalsContact O-N 3.14Å; S377-A380 VanDerWaalsContact OG-CB 3.24Å; S377-A380 WeakPolarHBondContact OG-CB 3.33Å; S377-A380 PolarHBondContact OG-N 2.88Å; A380-E383 PolarHBondContact O-N 3.19Å; A380-F384 WeakPolarHBondContact O-CB 3.35Å; A380-F384 PolarHBondContact O-N 3.46Å
381	F	98.2	Very high	96.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-44.3	176.4	-172.6	-108.1	0	0	0	112.2	V376 S377 C378 S379 E383 F384 V385 L395 I397 L402 I413 V417 W425	V376-F381 HydrophobicContact CG1-CB 3.91Å; S377-F381 PolarHBondContact O-N 3.45Å; C378-F381 PolarHBondContact O-N 2.87Å; S379-F381 VanDerWaalsContact C-N 3.34Å; F381-E383 VanDerWaalsContact C-N 3.3Å; F381-E383 PolarHBondContact O-N 3.28Å; F381-F384 HydrophobicContact CD2-CD1 4.35Å; F381-F384 HydrophobicContact CE2-CD1 4.27Å; F381-F384 WeakPolarHBondContact O-CB 3.45Å; F381-F384 PolarHBondContact O-N 2.94Å; F381-V385 HydrophobicContact CD1-CG2 4.29Å; F381-V385 HydrophobicContact CE1-CG2 3.92Å; F381-V385 HydrophobicContact CE2-CG2 4.3Å; F381-V385 HydrophobicContact CZ-CG2 3.9Å; F381-V385 WeakPolarHBondContact O-CG2 3.18Å; F381-V385 PolarHBondContact O-N 3.18Å; F381-L395 HydrophobicContact CE1-CD2 4.47Å; F381-L395 HydrophobicContact CE2-CD1 4.29Å; F381-L395 HydrophobicContact CZ-CD1 4.1Å; F381-L395 HydrophobicContact CZ-CD2 3.8Å; F381-L395 HydrophobicContact CZ-CG 4.2Å; F381-I397 HydrophobicContact CE2-CD1 3.84Å; F381-I397 HydrophobicContact CE2-CG1 3.86Å; F381-I397 HydrophobicContact CZ-CD1 4.15Å; F381-I397 HydrophobicContact CZ-CG1 3.65Å; F381-L402 HydrophobicContact CB-CD2 4.06Å; F381-L402 HydrophobicContact CD1-CD2 3.77Å; F381-L402 HydrophobicContact CD2-CD2 4.29Å; F381-L402 HydrophobicContact CE1-CD2 4.28Å; F381-L402 HydrophobicContact CG-CD2 3.77Å; F381-I413 HydrophobicContact CB-CD1 4.38Å; F381-I413 HydrophobicContact CD1-CD1 3.67Å; F381-I413 HydrophobicContact CD1-CG1 4.41Å; F381-I413 HydrophobicContact CE1-CD1 4.48Å; F381-I413 HydrophobicContact CG-CD1 4.43Å; F381-V417 HydrophobicContact CD1-CG2 3.87Å; F381-V417 HydrophobicContact CE1-CG1 4.33Å; F381-V417 HydrophobicContact CE1-CG2 3.64Å; F381-W425 AromaticContact CE1-CH2 3.78Å; F381-W425 HydrophobicContact CE1-CH2 3.78Å; F381-W425 HydrophobicContact CE1-CZ2 4.19Å; F381-W425 HydrophobicContact CE1-CZ3 4.32Å; F381-W425 HydrophobicContact CZ-CH2 4.21Å; F381-W425 HydrophobicContact CZ-CZ2 4.17Å
382	V	97.9	Very high	96.5	Very high	6 Å²	6	36.4 Å²	36.4	4%	0.036	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-39.9	174.5	171	0	0	0	0	110.9	C378 S379 V385 K386 Y408 I413 E416 V417	C378-V382 VanDerWaalsContact O-CG2 3.31Å; C378-V382 WeakPolarHBondContact O-CG2 3.32Å; C378-V382 PolarHBondContact O-N 2.95Å; S379-V382 PolarHBondContact O-N 3.33Å; V382-V385 PolarHBondContact O-N 3.41Å; V382-K386 VanDerWaalsContact O-CB 3.24Å; V382-K386 WeakPolarHBondContact O-CB 3.24Å; V382-K386 PolarHBondContact O-N 2.98Å; V382-Y408 HydrophobicContact CB-CE2 4.01Å; V382-Y408 HydrophobicContact CG1-CE2 4.11Å; V382-Y408 HydrophobicContact CG2-CD2 4.16Å; V382-Y408 HydrophobicContact CG2-CE2 3.97Å; V382-I413 HydrophobicContact CG2-CD1 4.49Å; V382-I413 HydrophobicContact CG2-CG1 3.87Å; V382-E416 HydrophobicContact CG1-CB 4.31Å; V382-E416 HydrophobicContact CG2-CB 4.31Å; V382-V417 HydrophobicContact CG2-CG2 4.43Å
383	E	98.1	Very high	96.6	Very high	100 Å²	100	38.5 Å²	38.5	47%	0.467	21%	0.213	S	C	.	.	H	α-helix	trans	-63.1	-46	174.7	-177.8	165.9	-165.9	0	0	112.1	I357 S379 A380 F381 V385 K386 M387	I357-E383 HydrophobicContact CD1-CG 4.44Å; S379-E383 WeakPolarHBondContact O-CB 3.5Å; S379-E383 PolarHBondContact O-N 3.15Å; A380-E383 PolarHBondContact O-N 3.19Å; F381-E383 VanDerWaalsContact C-N 3.3Å; F381-E383 PolarHBondContact O-N 3.28Å; E383-V385 PolarHBondContact O-N 3.12Å; E383-K386 WeakPolarHBondContact O-CB 3.37Å; E383-K386 PolarHBondContact O-N 2.79Å; E383-K386 VanDerWaalsContact O-N 3.16Å; E383-M387 HydrophobicContact CG-SD 4.29Å; E383-M387 VanDerWaalsContact O-CG 3.31Å; E383-M387 WeakPolarHBondContact O-CG 3.38Å; E383-M387 PolarHBondContact O-N 3.02Å
384	F	98.4	Very high	96.8	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	21%	0.212	C	C	.	.	H	α-helix	trans	-54.7	-50.8	174	166.4	-97.2	0	0	0	111.8	L356 A360 L366 V369 A380 F381 K386 M387 C388 L392 L395	L356-F384 HydrophobicContact CB-CB 4.45Å; L356-F384 HydrophobicContact CB-CD2 3.9Å; L356-F384 HydrophobicContact CB-CG 4.27Å; L356-F384 HydrophobicContact CD2-CE2 4.45Å; L356-F384 VanDerWaalsContact O-CD2 3.31Å; L356-F384 WeakPolarHBondContact O-CD2 3.41Å; A360-F384 HydrophobicContact CB-CD2 3.59Å; A360-F384 HydrophobicContact CB-CE2 3.81Å; L366-F384 HydrophobicContact CD2-CE2 4.16Å; L366-F384 HydrophobicContact CD2-CZ 4.06Å; V369-F384 HydrophobicContact CG2-CZ 3.92Å; A380-F384 WeakPolarHBondContact O-CB 3.35Å; A380-F384 PolarHBondContact O-N 3.46Å; F381-F384 HydrophobicContact CD2-CD1 4.35Å; F381-F384 HydrophobicContact CE2-CD1 4.27Å; F381-F384 WeakPolarHBondContact O-CB 3.45Å; F381-F384 PolarHBondContact O-N 2.94Å; F384-K386 VanDerWaalsContact C-N 3.31Å; F384-K386 PolarHBondContact O-N 3.15Å; F384-M387 PolarHBondContact O-N 3.02Å; F384-C388 PolarHBondContact O-N 3.34Å; F384-C388 PolarHBondContact O-SG 3.43Å; F384-C388 VanDerWaalsContact O-SG 3.36Å; F384-L392 HydrophobicContact CE1-CD1 3.82Å; F384-L392 HydrophobicContact CZ-CD1 4.24Å; F384-L395 HydrophobicContact CE1-CD1 4.43Å
385	V	98.1	Very high	97	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.7	-36.6	178.5	178.1	0	0	0	0	110.7	F381 V382 E383 C388 G389 L395 V417 H420 L421	F381-V385 HydrophobicContact CD1-CG2 4.29Å; F381-V385 HydrophobicContact CE1-CG2 3.92Å; F381-V385 HydrophobicContact CE2-CG2 4.3Å; F381-V385 HydrophobicContact CZ-CG2 3.9Å; F381-V385 WeakPolarHBondContact O-CG2 3.18Å; F381-V385 PolarHBondContact O-N 3.18Å; V382-V385 PolarHBondContact O-N 3.41Å; E383-V385 PolarHBondContact O-N 3.12Å; V385-C388 PolarHBondContact O-N 3.22Å; V385-G389 VanDerWaalsContact O-CA 3.3Å; V385-G389 WeakPolarHBondContact O-CA 3.44Å; V385-G389 PolarHBondContact O-N 2.77Å; V385-L395 HydrophobicContact CG2-CD2 3.92Å; V385-V417 HydrophobicContact CG1-CG1 4.16Å; V385-V417 HydrophobicContact CG2-CG1 4.22Å; V385-V417 HydrophobicContact CG2-CG2 4.35Å; V385-H420 HydrophobicContact CG1-CB 3.75Å; V385-L421 HydrophobicContact CG1-CD2 3.9Å; V385-L421 HydrophobicContact CG1-CG 3.9Å
386	K	97.6	Very high	97.1	Very high	141 Å²	141	38.5 Å²	38.5	61%	0.613	22%	0.219	S	C	*	.	H	α-helix	trans	-64.2	-40	175.4	179.7	-178	175.6	-172.6	0	112.2	V382 E383 F384	V382-K386 VanDerWaalsContact O-CB 3.24Å; V382-K386 WeakPolarHBondContact O-CB 3.24Å; V382-K386 PolarHBondContact O-N 2.98Å; E383-K386 WeakPolarHBondContact O-CB 3.37Å; E383-K386 PolarHBondContact O-N 2.79Å; E383-K386 VanDerWaalsContact O-N 3.16Å; F384-K386 VanDerWaalsContact C-N 3.31Å; F384-K386 PolarHBondContact O-N 3.15Å
387	M	97.7	Very high	97.1	Very high	77 Å²	77	38.5 Å²	38.5	38%	0.379	22%	0.219	S	C	.	.	H	α-helix	trans	-67.9	-37.4	177.7	-70.8	176.3	76.3	0	0	112	I357 A360 E361 E383 F384	I357-M387 HydrophobicContact CG2-CE 4.39Å; I357-M387 HydrophobicContact CG2-SD 3.96Å; A360-M387 HydrophobicContact CB-CB 3.93Å; A360-M387 HydrophobicContact CB-CE 4.26Å; A360-M387 HydrophobicContact CB-SD 4.18Å; E361-M387 HydrophobicContact CB-CE 3.82Å; E361-M387 HydrophobicContact CG-CE 4.34Å; E383-M387 HydrophobicContact CG-SD 4.29Å; E383-M387 VanDerWaalsContact O-CG 3.31Å; E383-M387 WeakPolarHBondContact O-CG 3.38Å; E383-M387 PolarHBondContact O-N 3.02Å; F384-M387 PolarHBondContact O-N 3.02Å
388	C	96.9	Very high	97	Very high	10 Å²	10	39.4 Å²	39.4	7%	0.068	22%	0.221	C	C	.	.	H	α-helix	trans	-82.7	-43.1	178.9	-58	0	0	0	0	112.4	A360 F384 V385 R391 L392	A360-C388 VanDerWaalsContact CB-SG 3.5Å; F384-C388 PolarHBondContact O-N 3.34Å; F384-C388 PolarHBondContact O-SG 3.43Å; F384-C388 VanDerWaalsContact O-SG 3.36Å; V385-C388 PolarHBondContact O-N 3.22Å; C388-R391 HydrophobicContact CB-CG 4.18Å; C388-R391 WeakPolarHBondContact O-CD 3.46Å; C388-R391 WeakPolarHBondContact O-CG 3.44Å; C388-R391 PolarHBondContact SG-NH2 2.94Å; C388-R391 VanDerWaalsContact SG-NH2 3.42Å; C388-L392 HydrophobicContact CB-CD1 3.59Å; C388-L392 HydrophobicContact CB-CD2 4.11Å; C388-L392 HydrophobicContact CB-CG 3.56Å
389	G	93.9	Very high	96.8	Very high	14 Å²	14	43 Å²	43	14%	0.144	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	59.6	-143.6	-179	0	0	0	0	0	112.6	V385 R391 L392 H420	V385-G389 VanDerWaalsContact O-CA 3.3Å; V385-G389 WeakPolarHBondContact O-CA 3.44Å; V385-G389 PolarHBondContact O-N 2.77Å; G389-R391 PolarHBondContact O-N 2.56Å; G389-L392 PolarHBondContact O-N 2.98Å; G389-H420 CarbonylContact C-O 3.58Å; G389-H420 WeakPolarHBondContact CA-O 3.49Å
390	G	91.7	Very high	96.6	Very high	64 Å²	64	46 Å²	46	66%	0.66	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-64.8	-1.7	-177.6	0	0	0	0	0	115.9	L392	G390-L392 VanDerWaalsContact C-N 3.29Å
391	R	95.9	Very high	96.5	Very high	68 Å²	68	45.8 Å²	45.8	26%	0.257	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-74.6	-21.1	173	83.5	-163.6	-177.5	96.5	-4.7	112.5	A360 C363 K364 L366 S367 C388 G389 S393	A360-R391 PolarHBondContact O-NH2 3.27Å; C363-R391 VanDerWaalsContact O-CZ 3.3Å; C363-R391 PolarHBondContact O-NH1 3Å; C363-R391 PolarHBondContact O-NH2 2.82Å; K364-R391 PolarHBondContact O-NH1 3.38Å; L366-R391 WeakPolarHBondContact O-CG 3.37Å; L366-R391 PolarHBondContact O-NH1 2.89Å; S367-R391 VanDerWaalsContact CA-O 3.28Å; S367-R391 WeakPolarHBondContact CA-O 3.29Å; S367-R391 VanDerWaalsContact CB-O 3.32Å; S367-R391 WeakPolarHBondContact CB-O 3.49Å; C388-R391 HydrophobicContact CB-CG 4.18Å; C388-R391 WeakPolarHBondContact O-CD 3.46Å; C388-R391 WeakPolarHBondContact O-CG 3.44Å; C388-R391 PolarHBondContact SG-NH2 2.94Å; C388-R391 VanDerWaalsContact SG-NH2 3.42Å; G389-R391 PolarHBondContact O-N 2.56Å; R391-S393 PolarHBondContact O-N 3.24Å
392	L	97.7	Very high	96.4	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	25%	0.248	C	C	.	.			trans	-73.7	93.7	172.7	-67.4	176.3	0	0	0	109.8	L366 S367 V369 F384 C388 G389 G390 L395 L421 R423	L366-L392 HydrophobicContact CG-CD2 4.44Å; S367-L392 CarbonylContact O-C 3.36Å; V369-L392 HydrophobicContact CG2-CD2 4.32Å; F384-L392 HydrophobicContact CE1-CD1 3.82Å; F384-L392 HydrophobicContact CZ-CD1 4.24Å; C388-L392 HydrophobicContact CB-CD1 3.59Å; C388-L392 HydrophobicContact CB-CD2 4.11Å; C388-L392 HydrophobicContact CB-CG 3.56Å; G389-L392 PolarHBondContact O-N 2.98Å; G390-L392 VanDerWaalsContact C-N 3.29Å; L392-L395 HydrophobicContact CD1-CD1 4.45Å; L392-L421 HydrophobicContact CB-CD2 3.77Å; L392-L421 HydrophobicContact CD1-CD2 4.24Å; L392-R423 PolarHBondContact O-NH2 3.49Å
393	S	96.9	Very high	96.3	Very high	55 Å²	55	48.6 Å²	48.6	39%	0.385	26%	0.26	S	S	.	.	S	Bend	trans	-74.3	-26.4	174	69.1	0	0	0	0	113.2	S367 R391 R423	S367-S393 WeakPolarHBondContact O-CA 3.45Å; S367-S393 PolarHBondContact O-N 3.44Å; S367-S393 PolarHBondContact O-OG 2.89Å; R391-S393 PolarHBondContact O-N 3.24Å; S393-R423 PolarHBondContact O-NH1 3.4Å; S393-R423 PolarHBondContact O-NH2 3.09Å
394	Q	97.2	Very high	96.3	Very high	131 Å²	131	47.1 Å²	47.1	61%	0.612	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.1	174.5	-61.9	-64.1	-17.2	0	0	109.6	S367 A368 V369	S367-Q394 PolarHBondContact O-N 3.47Å; A368-Q394 WeakPolarHBondContact CA-O 3.41Å; A368-Q394 HydrophobicContact CB-CB 3.86Å; A368-Q394 HydrophobicContact CB-CG 4.47Å; V369-Q394 PolarHBondContact N-O 3.32Å; V369-Q394 VanDerWaalsContact N-O 3.11Å
395	L	97.9	Very high	96.2	Very high	12 Å²	12	49.6 Å²	49.6	6%	0.063	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	99.2	176.8	-176.1	64	0	0	0	108.1	V369 F381 F384 V385 L392 I397 V417 L421 W425	V369-L395 HydrophobicContact CB-CD1 4.1Å; V369-L395 HydrophobicContact CG1-CD1 4.48Å; V369-L395 WeakPolarHBondContact O-CA 3.25Å; F381-L395 HydrophobicContact CE1-CD2 4.47Å; F381-L395 HydrophobicContact CE2-CD1 4.29Å; F381-L395 HydrophobicContact CZ-CD1 4.1Å; F381-L395 HydrophobicContact CZ-CD2 3.8Å; F381-L395 HydrophobicContact CZ-CG 4.2Å; F384-L395 HydrophobicContact CE1-CD1 4.43Å; V385-L395 HydrophobicContact CG2-CD2 3.92Å; L392-L395 HydrophobicContact CD1-CD1 4.45Å; L395-I397 HydrophobicContact CD1-CD1 3.9Å; L395-I397 HydrophobicContact CD1-CG1 3.93Å; L395-I397 HydrophobicContact CG-CG1 4.06Å; L395-V417 HydrophobicContact CD2-CG1 4.04Å; L395-L421 HydrophobicContact CD2-CD1 3.88Å; L395-L421 HydrophobicContact CD2-CD2 4.4Å; L395-W425 HydrophobicContact CD2-CZ2 4.36Å; L395-W425 HydrophobicContact CG-CZ2 4.43Å; L395-W425 PolarHBondContact O-NE1 3.25Å
396	S	97.3	Very high	96	Very high	62 Å²	62	59.6 Å²	59.6	43%	0.434	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.3	179.9	170	0	0	0	0	108.1	V369 G370 L371 D428	V369-S396 PolarHBondContact O-N 3.02Å; G370-S396 CarbonylContact C-O 3.26Å; G370-S396 WeakPolarHBondContact CA-O 3.45Å; L371-S396 PolarHBondContact N-O 3.45Å; S396-D428 WeakPolarHBondContact CA-OD2 3.3Å; S396-D428 WeakPolarHBondContact CB-OD2 3.48Å; S396-D428 PolarHBondContact OG-OD2 3.14Å
397	I	97.3	Very high	95.9	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	122.6	-173	-52.5	-69.8	0	0	0	106.4	L371 F381 L395 V401 L402 W425 P427 D428	L371-I397 HydrophobicContact CB-CD1 3.67Å; L371-I397 HydrophobicContact CD1-CD1 3.79Å; L371-I397 HydrophobicContact CG-CD1 3.7Å; F381-I397 HydrophobicContact CE2-CD1 3.84Å; F381-I397 HydrophobicContact CE2-CG1 3.86Å; F381-I397 HydrophobicContact CZ-CD1 4.15Å; F381-I397 HydrophobicContact CZ-CG1 3.65Å; L395-I397 HydrophobicContact CD1-CD1 3.9Å; L395-I397 HydrophobicContact CD1-CG1 3.93Å; L395-I397 HydrophobicContact CG-CG1 4.06Å; I397-V401 HydrophobicContact CG2-CB 3.86Å; I397-V401 HydrophobicContact CG2-CG1 4.01Å; I397-V401 HydrophobicContact CG2-CG2 4.42Å; I397-L402 HydrophobicContact CG2-CD2 4.32Å; I397-L402 HydrophobicContact CG2-CG 4.29Å; I397-W425 HydrophobicContact CB-CZ2 4Å; I397-W425 HydrophobicContact CG1-CZ2 3.97Å; I397-P427 CarbonylContact O-C 3.4Å; I397-P427 VanDerWaalsContact O-CA 3.29Å; I397-P427 WeakPolarHBondContact O-CA 3.14Å; I397-P427 WeakPolarHBondContact O-CB 3.41Å; I397-D428 PolarHBondContact N-OD2 2.78Å; I397-D428 PolarHBondContact O-N 3.49Å
398	M	95.2	Very high	95.8	Very high	41 Å²	41	57.2 Å²	57.2	20%	0.202	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-68.5	142.8	174.3	-61.7	-129	55.2	0	0	110.9	L371 E400 V401 D428 M430	L371-M398 PolarHBondContact O-N 3.35Å; L371-M398 VanDerWaalsContact O-N 3.16Å; M398-E400 HydrophobicContact CB-CG 4.38Å; M398-E400 WeakPolarHBondContact CB-OE1 3.24Å; M398-E400 WeakPolarHBondContact CB-OE2 3.43Å; M398-E400 PolarHBondContact O-N 2.9Å; M398-E400 VanDerWaalsContact SD-OE1 3.39Å; M398-V401 HydrophobicContact CB-CG2 4.17Å; M398-V401 VanDerWaalsContact O-CB 3.27Å; M398-V401 WeakPolarHBondContact O-CB 3.32Å; M398-V401 WeakPolarHBondContact O-CG2 3.35Å; M398-V401 PolarHBondContact O-N 3.24Å; M398-D428 WeakPolarHBondContact CA-O 3.44Å; M398-M430 HydrophobicContact CE-CG 3.42Å; M398-M430 VanDerWaalsContact CE-CG 3.42Å; M398-M430 HydrophobicContact SD-CG 4.44Å
399	E	94.2	Very high	95.7	Very high	75 Å²	75	58.8 Å²	58.8	35%	0.35	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-55.7	-39.2	-175.6	-174.4	179.2	-166.2	0	0	112.5	V401 L402 L410 P427 D428 M429	E399-V401 PolarHBondContact O-N 3.44Å; E399-V401 VanDerWaalsContact O-N 3.09Å; E399-L402 PolarHBondContact O-N 2.69Å; E399-L410 HydrophobicContact CG-CD1 4.42Å; E399-P427 HydrophobicContact CB-CB 4.17Å; E399-P427 HydrophobicContact CB-CG 4.31Å; E399-P427 HydrophobicContact CG-CG 4.34Å; E399-D428 PolarHBondContact N-O 3.37Å; E399-M429 HydrophobicContact CB-CG 4.44Å; E399-M429 WeakPolarHBondContact OE2-CG 3.31Å
400	E	92.7	Very high	95.5	Very high	102 Å²	102	61 Å²	61	48%	0.477	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-63.6	-14.2	179	67.2	-85.8	-167.6	0	0	114.3	M398 L402	M398-E400 HydrophobicContact CB-CG 4.38Å; M398-E400 WeakPolarHBondContact CB-OE1 3.24Å; M398-E400 WeakPolarHBondContact CB-OE2 3.43Å; M398-E400 PolarHBondContact O-N 2.9Å; M398-E400 VanDerWaalsContact SD-OE1 3.39Å; E400-L402 VanDerWaalsContact C-N 3.29Å
401	V	95.6	Very high	95.4	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-71.9	-27.7	177.5	175.1	0	0	0	0	112.1	L371 C374 V376 I397 M398 E399	L371-V401 HydrophobicContact CB-CG1 4.32Å; C374-V401 VanDerWaalsContact O-CA 3.25Å; C374-V401 WeakPolarHBondContact O-CA 3.43Å; C374-V401 VanDerWaalsContact SG-CG1 3.55Å; V376-V401 HydrophobicContact CB-CG1 4.35Å; V376-V401 HydrophobicContact CG2-CG1 3.87Å; V376-V401 PolarHBondContact N-O 2.55Å; I397-V401 HydrophobicContact CG2-CB 3.86Å; I397-V401 HydrophobicContact CG2-CG1 4.01Å; I397-V401 HydrophobicContact CG2-CG2 4.42Å; M398-V401 HydrophobicContact CB-CG2 4.17Å; M398-V401 VanDerWaalsContact O-CB 3.27Å; M398-V401 WeakPolarHBondContact O-CB 3.32Å; M398-V401 WeakPolarHBondContact O-CG2 3.35Å; M398-V401 PolarHBondContact O-N 3.24Å; E399-V401 PolarHBondContact O-N 3.44Å; E399-V401 VanDerWaalsContact O-N 3.09Å
402	L	96.6	Very high	95.1	Very high	7 Å²	7	67.5 Å²	67.5	4%	0.037	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117.7	-170.6	-62.3	172.1	0	0	0	110.8	F381 I397 E399 E400 P404 L410 I413 W425 P427	F381-L402 HydrophobicContact CB-CD2 4.06Å; F381-L402 HydrophobicContact CD1-CD2 3.77Å; F381-L402 HydrophobicContact CD2-CD2 4.29Å; F381-L402 HydrophobicContact CE1-CD2 4.28Å; F381-L402 HydrophobicContact CG-CD2 3.77Å; I397-L402 HydrophobicContact CG2-CD2 4.32Å; I397-L402 HydrophobicContact CG2-CG 4.29Å; E399-L402 PolarHBondContact O-N 2.69Å; E400-L402 VanDerWaalsContact C-N 3.29Å; L402-P404 WeakPolarHBondContact O-CD 3.5Å; L402-L410 HydrophobicContact CB-CD2 3.61Å; L402-L410 HydrophobicContact CD1-CD2 4.47Å; L402-I413 HydrophobicContact CD1-CD1 3.86Å; L402-I413 HydrophobicContact CD1-CG2 3.99Å; L402-I413 HydrophobicContact CD2-CD1 3.72Å; L402-I413 HydrophobicContact CG-CD1 4.27Å; L402-W425 HydrophobicContact CD1-CH2 4.29Å; L402-P427 HydrophobicContact CD1-CB 4.26Å
403	I	96.5	Very high	95	Very high	58 Å²	58	67.4 Å²	67.4	30%	0.297	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	116.4	176.6	-56.7	-177.9	0	0	0	109.6	P351 E375 V376 S377 C378	P351-I403 HydrophobicContact CG-CD1 4.43Å; E375-I403 HydrophobicContact CB-CD1 3.59Å; E375-I403 HydrophobicContact CB-CG1 4.35Å; E375-I403 HydrophobicContact CG-CD1 3.72Å; E375-I403 HydrophobicContact CG-CG1 4.44Å; V376-I403 PolarHBondContact O-N 2.78Å; S377-I403 WeakPolarHBondContact CA-O 3.48Å; C378-I403 PolarHBondContact N-O 3.45Å; C378-I403 VanDerWaalsContact SG-C 3.54Å; C378-I403 PolarHBondContact SG-O 2.96Å
404	P	96.3	Very high	94.9	Very high	70 Å²	70	67.2 Å²	67.2	46%	0.455	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-60.3	147	174.2	-26.8	38.2	0	0	0	112.5	L402 L410	L402-P404 WeakPolarHBondContact O-CD 3.5Å; P404-L410 HydrophobicContact CG-CD1 4.49Å; P404-L410 HydrophobicContact CG-CD2 4.2Å; P404-L410 HydrophobicContact CG-CG 3.84Å
405	D	96.1	Very high	94.8	Very high	52 Å²	52	68.7 Å²	68.7	28%	0.278	33%	0.334	S	S	.	.			trans	-135	-172.4	177	60.6	41.6	0	0	0	110.9	S379 K407 Y408	S379-D405 WeakPolarHBondContact CA-OD2 3.48Å; S379-D405 WeakPolarHBondContact CB-OD2 3.5Å; S379-D405 PolarHBondContact N-OD2 2.98Å; S379-D405 PolarHBondContact OG-OD1 2.79Å; S379-D405 VanDerWaalsContact OG-OD1 3.14Å; S379-D405 PolarHBondContact OG-OD2 3.02Å; D405-K407 PolarHBondContact O-N 2.93Å; D405-K407 VanDerWaalsContact O-N 3.09Å; D405-K407 WeakPolarHBondContact OD1-CA 3.41Å; D405-K407 WeakPolarHBondContact OD1-CB 3.35Å; D405-K407 PolarHBondContact OD1-N 2.89Å; D405-Y408 PolarHBondContact N-O 3.08Å; D405-Y408 VanDerWaalsContact N-O 3.14Å; D405-Y408 PolarHBondContact OD1-N 3.11Å
406	Q	94.7	Very high	94.7	Very high	211 Å²	211	70 Å²	70	99%	0.986	34%	0.339	S	S	*	.	S	Bend	trans	-62.5	-17.8	-177.6	-63	178.8	7.6	0	0	113.5
407	K	95.1	Very high	94.7	Very high	134 Å²	134	67 Å²	67	58%	0.583	32%	0.319	S	S	*	.	S	Bend	trans	-103.9	-37.1	-172.7	-170.1	176.8	179.5	-176.9	0	112.6	D405	D405-K407 PolarHBondContact O-N 2.93Å; D405-K407 VanDerWaalsContact O-N 3.09Å; D405-K407 WeakPolarHBondContact OD1-CA 3.41Å; D405-K407 WeakPolarHBondContact OD1-CB 3.35Å; D405-K407 PolarHBondContact OD1-N 2.89Å
408	Y	95.7	Very high	94.7	Very high	34 Å²	34	68 Å²	68	13%	0.133	33%	0.325	C	S	.	.			trans	-134.3	132.5	-175.5	-61.3	-64.7	0	0	0	112.1	V382 D405 E416	V382-Y408 HydrophobicContact CB-CE2 4.01Å; V382-Y408 HydrophobicContact CG1-CE2 4.11Å; V382-Y408 HydrophobicContact CG2-CD2 4.16Å; V382-Y408 HydrophobicContact CG2-CE2 3.97Å; D405-Y408 PolarHBondContact N-O 3.08Å; D405-Y408 VanDerWaalsContact N-O 3.14Å; D405-Y408 PolarHBondContact OD1-N 3.11Å; Y408-E416 HydrophobicContact CE1-CG 3.91Å
409	S	94.3	Very high	94.8	Very high	42 Å²	42	71.5 Å²	71.5	29%	0.294	34%	0.34	S	S	.	.			trans	-92.1	166	163.7	69.8	0	0	0	0	111.7	E411 Q412 I413	S409-E411 PolarHBondContact O-N 3.13Å; S409-Q412 PolarHBondContact O-N 3.32Å; S409-Q412 WeakPolarHBondContact OG-CG 3.45Å; S409-Q412 PolarHBondContact OG-N 3.01Å; S409-I413 PolarHBondContact O-N 3.27Å; S409-I413 VanDerWaalsContact O-N 3.12Å
410	L	90.8	Very high	95	Very high	62 Å²	62	70.3 Å²	70.3	33%	0.325	33%	0.334	S	S	.	.	H	α-helix	trans	-57.6	-36.3	173.7	-66.8	-179.9	0	0	0	112.4	E399 L402 P404 Q412 I413	E399-L410 HydrophobicContact CG-CD1 4.42Å; L402-L410 HydrophobicContact CB-CD2 3.61Å; L402-L410 HydrophobicContact CD1-CD2 4.47Å; P404-L410 HydrophobicContact CG-CD1 4.49Å; P404-L410 HydrophobicContact CG-CD2 4.2Å; P404-L410 HydrophobicContact CG-CG 3.84Å; L410-Q412 PolarHBondContact O-N 3.32Å; L410-I413 WeakPolarHBondContact O-CG2 3.43Å
411	E	88.9	Confident	95.2	Very high	164 Å²	164	66.1 Å²	66.1	77%	0.766	32%	0.315	S	S	*	.	H	α-helix	trans	-67.4	-24.5	177.2	-64.8	-178	177.5	0	0	112.7	S409 H414	S409-E411 PolarHBondContact O-N 3.13Å; E411-H414 PolarHBondContact O-CE1 2.93Å; E411-H414 PolarHBondContact O-ND1 3.11Å
412	Q	90.9	Very high	95.2	Very high	103 Å²	103	69.5 Å²	69.5	48%	0.481	35%	0.35	S	S	.	.	H	α-helix	trans	-93.1	-29.9	-176.9	-70	171.8	-21.3	0	0	113	S409 L410 H414 W415	S409-Q412 PolarHBondContact O-N 3.32Å; S409-Q412 WeakPolarHBondContact OG-CG 3.45Å; S409-Q412 PolarHBondContact OG-N 3.01Å; L410-Q412 PolarHBondContact O-N 3.32Å; Q412-H414 VanDerWaalsContact C-N 3.32Å; Q412-H414 PolarHBondContact O-N 3.19Å; Q412-W415 PolarHBondContact O-N 2.93Å
413	I	94.7	Very high	95.2	Very high	0 Å²	0	74 Å²	74	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.9	-39	-169.2	-158.1	179.9	0	0	0	112.8	C378 F381 V382 L402 S409 L410 W415 E416 V417	C378-I413 HydrophobicContact CB-CD1 3.84Å; C378-I413 HydrophobicContact CB-CG1 4.48Å; F381-I413 HydrophobicContact CB-CD1 4.38Å; F381-I413 HydrophobicContact CD1-CD1 3.67Å; F381-I413 HydrophobicContact CD1-CG1 4.41Å; F381-I413 HydrophobicContact CE1-CD1 4.48Å; F381-I413 HydrophobicContact CG-CD1 4.43Å; V382-I413 HydrophobicContact CG2-CD1 4.49Å; V382-I413 HydrophobicContact CG2-CG1 3.87Å; L402-I413 HydrophobicContact CD1-CD1 3.86Å; L402-I413 HydrophobicContact CD1-CG2 3.99Å; L402-I413 HydrophobicContact CD2-CD1 3.72Å; L402-I413 HydrophobicContact CG-CD1 4.27Å; S409-I413 PolarHBondContact O-N 3.27Å; S409-I413 VanDerWaalsContact O-N 3.12Å; L410-I413 WeakPolarHBondContact O-CG2 3.43Å; I413-W415 PolarHBondContact O-N 3.4Å; I413-E416 PolarHBondContact O-N 3.3Å; I413-V417 HydrophobicContact CG1-CG2 3.98Å; I413-V417 WeakPolarHBondContact O-CB 3.42Å; I413-V417 VanDerWaalsContact O-CG2 3.26Å; I413-V417 WeakPolarHBondContact O-CG2 3.37Å; I413-V417 PolarHBondContact O-N 3.1Å
414	H	94.4	Very high	95.2	Very high	51 Å²	51	76.8 Å²	76.8	24%	0.236	39%	0.386	C	S	.	.	H	α-helix	trans	-58.2	-34.5	-178.9	79	-67.6	0	0	0	112.2	E411 Q412 S418 F426	E411-H414 PolarHBondContact O-CE1 2.93Å; E411-H414 PolarHBondContact O-ND1 3.11Å; Q412-H414 VanDerWaalsContact C-N 3.32Å; Q412-H414 PolarHBondContact O-N 3.19Å; H414-S418 WeakPolarHBondContact O-CB 3.43Å; H414-S418 PolarHBondContact O-N 3.18Å; H414-S418 PolarHBondContact O-OG 3.34Å; H414-F426 HydrophobicContact CB-CD1 3.95Å; H414-F426 HydrophobicContact CB-CE1 4.16Å; H414-F426 AromaticContact CD2-CD1 3.91Å; H414-F426 AromaticContact CD2-CE1 3.21Å; H414-F426 WeakPolarHBondContact CD2-CE1 3.34Å; H414-F426 AromaticContact CD2-CZ 3.74Å; H414-F426 AromaticContact CG-CE1 3.82Å; H414-F426 AromaticContact NE2-CE1 3.98Å
415	W	95.6	Very high	95.3	Very high	163 Å²	163	74.2 Å²	74.2	62%	0.617	37%	0.367	S	S	*	.	H	α-helix	trans	-72.8	-46.5	-178.6	-159.5	90.4	0	0	0	111.8	Q412 I413 S418 K419	Q412-W415 PolarHBondContact O-N 2.93Å; I413-W415 PolarHBondContact O-N 3.4Å; W415-S418 PolarHBondContact O-N 3.27Å; W415-K419 HydrophobicContact CE3-CD 4.41Å; W415-K419 HydrophobicContact CZ3-CD 3.85Å; W415-K419 WeakPolarHBondContact O-CB 3.47Å; W415-K419 PolarHBondContact O-N 3Å
416	E	96.6	Very high	95.3	Very high	38 Å²	38	77.3 Å²	77.3	18%	0.178	38%	0.378	C	S	.	.	H	α-helix	trans	-68.2	-39.9	177.2	-76.5	-61.3	149.8	0	0	112.1	V382 Y408 I413 K419 H420	V382-E416 HydrophobicContact CG1-CB 4.31Å; V382-E416 HydrophobicContact CG2-CB 4.31Å; Y408-E416 HydrophobicContact CE1-CG 3.91Å; I413-E416 PolarHBondContact O-N 3.3Å; E416-K419 PolarHBondContact O-N 3.3Å; E416-K419 IonicContact OE1-NZ 3.24Å; E416-K419 PolarHBondContact OE1-NZ 3.06Å; E416-K419 IonicContact OE2-NZ 2.87Å; E416-K419 PolarHBondContact OE2-NZ 3.04Å; E416-H420 PolarHBondContact O-CD2 2.88Å; E416-H420 PolarHBondContact O-N 2.73Å; E416-H420 VanDerWaalsContact O-N 3.11Å; E416-H420 IonicContact OE2-NE2 3.45Å
417	V	97.3	Very high	95.4	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-47.8	174.9	172.5	0	0	0	0	110.3	F381 V382 V385 L395 I413 K419 H420 L421 W425	F381-V417 HydrophobicContact CD1-CG2 3.87Å; F381-V417 HydrophobicContact CE1-CG1 4.33Å; F381-V417 HydrophobicContact CE1-CG2 3.64Å; V382-V417 HydrophobicContact CG2-CG2 4.43Å; V385-V417 HydrophobicContact CG1-CG1 4.16Å; V385-V417 HydrophobicContact CG2-CG1 4.22Å; V385-V417 HydrophobicContact CG2-CG2 4.35Å; L395-V417 HydrophobicContact CD2-CG1 4.04Å; I413-V417 HydrophobicContact CG1-CG2 3.98Å; I413-V417 WeakPolarHBondContact O-CB 3.42Å; I413-V417 VanDerWaalsContact O-CG2 3.26Å; I413-V417 WeakPolarHBondContact O-CG2 3.37Å; I413-V417 PolarHBondContact O-N 3.1Å; V417-K419 VanDerWaalsContact C-N 3.28Å; V417-K419 PolarHBondContact O-N 3.27Å; V417-H420 PolarHBondContact O-N 3.18Å; V417-H420 VanDerWaalsContact O-N 3.17Å; V417-L421 HydrophobicContact CG1-CD1 3.69Å; V417-L421 HydrophobicContact CG1-CG 4.2Å; V417-L421 WeakPolarHBondContact O-CB 3.24Å; V417-L421 WeakPolarHBondContact O-CG 3.33Å; V417-L421 PolarHBondContact O-N 3.43Å; V417-W425 HydrophobicContact CB-CD2 4.31Å; V417-W425 HydrophobicContact CB-CE3 3.65Å; V417-W425 HydrophobicContact CB-CZ3 3.97Å; V417-W425 HydrophobicContact CG1-CB 4.27Å; V417-W425 HydrophobicContact CG1-CD2 3.45Å; V417-W425 VanDerWaalsContact CG1-CD2 3.45Å; V417-W425 HydrophobicContact CG1-CE3 3.29Å; V417-W425 HydrophobicContact CG1-CG 3.89Å; V417-W425 HydrophobicContact CG1-CH2 4.44Å; V417-W425 HydrophobicContact CG1-CZ3 3.83Å; V417-W425 HydrophobicContact CG2-CE3 4.27Å; V417-W425 HydrophobicContact CG2-CZ3 4.08Å
418	S	97.4	Very high	95.3	Very high	20 Å²	20	65.2 Å²	65.2	14%	0.14	33%	0.328	C	S	.	.	H	α-helix	trans	-57.4	-41.8	178	-66.4	0	0	0	0	112.4	H414 W415 L421 G422 R423 W425	H414-S418 WeakPolarHBondContact O-CB 3.43Å; H414-S418 PolarHBondContact O-N 3.18Å; H414-S418 PolarHBondContact O-OG 3.34Å; W415-S418 PolarHBondContact O-N 3.27Å; S418-L421 PolarHBondContact O-N 3.44Å; S418-G422 PolarHBondContact O-N 3Å; S418-R423 CarbonylContact C-O 3.53Å; S418-R423 WeakPolarHBondContact CA-O 3.38Å; S418-R423 VanDerWaalsContact CB-O 3.26Å; S418-R423 WeakPolarHBondContact CB-O 3.4Å; S418-R423 PolarHBondContact O-N 2.92Å; S418-W425 PolarHBondContact OG-N 3.2Å; S418-W425 PolarHBondContact OG-O 3.48Å
419	K	97.1	Very high	95.2	Very high	116 Å²	116	69.9 Å²	69.9	50%	0.504	35%	0.353	S	S	.	.	H	α-helix	trans	-62.4	-42.9	177.4	171.6	-177	162.4	-154.9	0	112.5	W415 E416 V417	W415-K419 HydrophobicContact CE3-CD 4.41Å; W415-K419 HydrophobicContact CZ3-CD 3.85Å; W415-K419 WeakPolarHBondContact O-CB 3.47Å; W415-K419 PolarHBondContact O-N 3Å; E416-K419 PolarHBondContact O-N 3.3Å; E416-K419 IonicContact OE1-NZ 3.24Å; E416-K419 PolarHBondContact OE1-NZ 3.06Å; E416-K419 IonicContact OE2-NZ 2.87Å; E416-K419 PolarHBondContact OE2-NZ 3.04Å; V417-K419 VanDerWaalsContact C-N 3.28Å; V417-K419 PolarHBondContact O-N 3.27Å
420	H	97.1	Very high	94.8	Very high	50 Å²	50	74.5 Å²	74.5	23%	0.231	37%	0.371	C	S	.	.	H	α-helix	trans	-74.6	-29.9	178.1	-71.9	-51	0	0	0	113.4	V385 G389 E416 V417	V385-H420 HydrophobicContact CG1-CB 3.75Å; G389-H420 CarbonylContact C-O 3.58Å; G389-H420 WeakPolarHBondContact CA-O 3.49Å; E416-H420 PolarHBondContact O-CD2 2.88Å; E416-H420 PolarHBondContact O-N 2.73Å; E416-H420 VanDerWaalsContact O-N 3.11Å; E416-H420 IonicContact OE2-NE2 3.45Å; V417-H420 PolarHBondContact O-N 3.18Å; V417-H420 VanDerWaalsContact O-N 3.17Å
421	L	97	Very high	94.7	Very high	14 Å²	14	75.4 Å²	75.4	7%	0.073	38%	0.381	C	S	.	.	H	α-helix	trans	-78.8	-26.4	174.5	-67.6	177.4	0	0	0	113.5	V385 L392 L395 V417 S418 R423 W425	V385-L421 HydrophobicContact CG1-CD2 3.9Å; V385-L421 HydrophobicContact CG1-CG 3.9Å; L392-L421 HydrophobicContact CB-CD2 3.77Å; L392-L421 HydrophobicContact CD1-CD2 4.24Å; L395-L421 HydrophobicContact CD2-CD1 3.88Å; L395-L421 HydrophobicContact CD2-CD2 4.4Å; V417-L421 HydrophobicContact CG1-CD1 3.69Å; V417-L421 HydrophobicContact CG1-CG 4.2Å; V417-L421 WeakPolarHBondContact O-CB 3.24Å; V417-L421 WeakPolarHBondContact O-CG 3.33Å; V417-L421 PolarHBondContact O-N 3.43Å; S418-L421 PolarHBondContact O-N 3.44Å; L421-R423 HydrophobicContact CB-CG 4.06Å; L421-W425 HydrophobicContact CD1-CB 3.8Å; L421-W425 HydrophobicContact CD1-CG 3.82Å
422	G	96.6	Very high	94.5	Very high	71 Å²	71	74.4 Å²	74.4	73%	0.732	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	19.7	-174	0	0	0	0	0	114.1	S418	S418-G422 PolarHBondContact O-N 3Å
423	R	96.6	Very high	94.1	Very high	101 Å²	101	82.7 Å²	82.7	38%	0.381	41%	0.413	S	S	.	.	S	Bend	trans	-153.8	157.9	178.2	63.9	-171.3	179.2	-169.3	7.5	110	L392 S393 S418 L421 W425	L392-R423 PolarHBondContact O-NH2 3.49Å; S393-R423 PolarHBondContact O-NH1 3.4Å; S393-R423 PolarHBondContact O-NH2 3.09Å; S418-R423 CarbonylContact C-O 3.53Å; S418-R423 WeakPolarHBondContact CA-O 3.38Å; S418-R423 VanDerWaalsContact CB-O 3.26Å; S418-R423 WeakPolarHBondContact CB-O 3.4Å; S418-R423 PolarHBondContact O-N 2.92Å; L421-R423 HydrophobicContact CB-CG 4.06Å; R423-W425 PolarHBondContact O-N 3.35Å
424	V	96.8	Very high	94.1	Very high	117 Å²	117	86.9 Å²	86.9	71%	0.709	43%	0.434	S	S	*	.			trans	-62.5	132	175.3	-179.1	0	0	0	0	109.5	F426	V424-F426 HydrophobicContact CG1-CD2 3.94Å; V424-F426 HydrophobicContact CG1-CE2 3.38Å; V424-F426 HydrophobicContact CG1-CZ 4.31Å
425	W	97.3	Very high	94.1	Very high	15 Å²	15	88.7 Å²	88.7	6%	0.057	44%	0.444	C	S	.	.			trans	-141.7	142.8	179.2	178.1	86.9	0	0	0	110.4	F381 L395 I397 L402 V417 S418 L421 R423 P427	F381-W425 AromaticContact CE1-CH2 3.78Å; F381-W425 HydrophobicContact CE1-CH2 3.78Å; F381-W425 HydrophobicContact CE1-CZ2 4.19Å; F381-W425 HydrophobicContact CE1-CZ3 4.32Å; F381-W425 HydrophobicContact CZ-CH2 4.21Å; F381-W425 HydrophobicContact CZ-CZ2 4.17Å; L395-W425 HydrophobicContact CD2-CZ2 4.36Å; L395-W425 HydrophobicContact CG-CZ2 4.43Å; L395-W425 PolarHBondContact O-NE1 3.25Å; I397-W425 HydrophobicContact CB-CZ2 4Å; I397-W425 HydrophobicContact CG1-CZ2 3.97Å; L402-W425 HydrophobicContact CD1-CH2 4.29Å; V417-W425 HydrophobicContact CB-CD2 4.31Å; V417-W425 HydrophobicContact CB-CE3 3.65Å; V417-W425 HydrophobicContact CB-CZ3 3.97Å; V417-W425 HydrophobicContact CG1-CB 4.27Å; V417-W425 HydrophobicContact CG1-CD2 3.45Å; V417-W425 VanDerWaalsContact CG1-CD2 3.45Å; V417-W425 HydrophobicContact CG1-CE3 3.29Å; V417-W425 HydrophobicContact CG1-CG 3.89Å; V417-W425 HydrophobicContact CG1-CH2 4.44Å; V417-W425 HydrophobicContact CG1-CZ3 3.83Å; V417-W425 HydrophobicContact CG2-CE3 4.27Å; V417-W425 HydrophobicContact CG2-CZ3 4.08Å; S418-W425 PolarHBondContact OG-N 3.2Å; S418-W425 PolarHBondContact OG-O 3.48Å; L421-W425 HydrophobicContact CD1-CB 3.8Å; L421-W425 HydrophobicContact CD1-CG 3.82Å; R423-W425 PolarHBondContact O-N 3.35Å; W425-P427 HydrophobicContact CH2-CB 4.13Å
426	F	96.6	Very high	94	Very high	117 Å²	117	84.6 Å²	84.6	51%	0.513	44%	0.435	S	S	.	.			trans	-139.7	151.5	173.2	-68.4	-84.3	0	0	0	108.8	H414 V424	H414-F426 HydrophobicContact CB-CD1 3.95Å; H414-F426 HydrophobicContact CB-CE1 4.16Å; H414-F426 AromaticContact CD2-CD1 3.91Å; H414-F426 AromaticContact CD2-CE1 3.21Å; H414-F426 WeakPolarHBondContact CD2-CE1 3.34Å; H414-F426 AromaticContact CD2-CZ 3.74Å; H414-F426 AromaticContact CG-CE1 3.82Å; H414-F426 AromaticContact NE2-CE1 3.98Å; V424-F426 HydrophobicContact CG1-CD2 3.94Å; V424-F426 HydrophobicContact CG1-CE2 3.38Å; V424-F426 HydrophobicContact CG1-CZ 4.31Å
427	P	96.1	Very high	93.9	Very high	21 Å²	21	87.4 Å²	87.4	14%	0.136	45%	0.45	C	S	.	.			trans	-64.8	153.6	168	29.7	-34.1	0	0	0	110.7	I397 E399 L402 W425	I397-P427 CarbonylContact O-C 3.4Å; I397-P427 VanDerWaalsContact O-CA 3.29Å; I397-P427 WeakPolarHBondContact O-CA 3.14Å; I397-P427 WeakPolarHBondContact O-CB 3.41Å; E399-P427 HydrophobicContact CB-CB 4.17Å; E399-P427 HydrophobicContact CB-CG 4.31Å; E399-P427 HydrophobicContact CG-CG 4.34Å; L402-P427 HydrophobicContact CD1-CB 4.26Å; W425-P427 HydrophobicContact CH2-CB 4.13Å
428	D	94.6	Very high	93.6	Very high	70 Å²	70	92.8 Å²	92.8	37%	0.374	48%	0.478	S	S	.	.	B	Isolated β-bridge	trans	-74.8	132.8	174.4	-63.6	-50.7	0	0	0	109.4	S396 I397 M398 E399	S396-D428 WeakPolarHBondContact CA-OD2 3.3Å; S396-D428 WeakPolarHBondContact CB-OD2 3.48Å; S396-D428 PolarHBondContact OG-OD2 3.14Å; I397-D428 PolarHBondContact N-OD2 2.78Å; I397-D428 PolarHBondContact O-N 3.49Å; M398-D428 WeakPolarHBondContact CA-O 3.44Å; E399-D428 PolarHBondContact N-O 3.37Å
429	M	92.1	Very high	93.4	Very high	133 Å²	133	97.7 Å²	97.7	66%	0.655	50%	0.5	S	S	*	.			trans	-112.9	136	-179.9	-69	-179.5	-80.1	0	0	110.4	E399	E399-M429 HydrophobicContact CB-CG 4.44Å; E399-M429 WeakPolarHBondContact OE2-CG 3.31Å
430	M	86.2	Confident	93.1	Very high	138 Å²	138	96.4 Å²	96.4	68%	0.68	50%	0.5	S	S	*	.			trans	-80.9	137.8	166.8	-69.6	-135.5	105	0	0	110.7	M398 T432	M398-M430 HydrophobicContact CE-CG 3.42Å; M398-M430 VanDerWaalsContact CE-CG 3.42Å; M398-M430 HydrophobicContact SD-CG 4.44Å; M430-T432 PolarHBondContact O-N 2.74Å
431	P	88.1	Confident	92.8	Very high	82 Å²	82	99.9 Å²	99.9	53%	0.532	52%	0.521	S	S	.	.			trans	-57.6	135.8	170.2	-21.6	32.3	0	0	0	111.3	W433	P431-W433 VanDerWaalsContact C-N 3.3Å; P431-W433 HydrophobicContact CB-CD2 4Å; P431-W433 HydrophobicContact CB-CG 4.43Å; P431-W433 HydrophobicContact CB-CH2 4.32Å; P431-W433 HydrophobicContact CB-CZ2 3.79Å; P431-W433 HydrophobicContact CG-CZ2 4.41Å; P431-W433 PolarHBondContact O-N 2.85Å
432	T	85.9	Confident	92.5	Very high	142 Å²	142	107.1 Å²	107.1	87%	0.871	56%	0.558	S	S	*	*			trans	-92.2	21.1	-178.3	62.6	0	0	0	0	113.3	M430	M430-T432 PolarHBondContact O-N 2.74Å
433	W	83	Confident	92.1	Very high	278 Å²	278	110.4 Å²	110.4	100%	1.053	54%	0.542	S	S	*	.			trans	-126.5	0	-172	56.5	66.7	0	0	0	114.1	P431	P431-W433 VanDerWaalsContact C-N 3.3Å; P431-W433 HydrophobicContact CB-CD2 4Å; P431-W433 HydrophobicContact CB-CG 4.43Å; P431-W433 HydrophobicContact CB-CH2 4.32Å; P431-W433 HydrophobicContact CB-CZ2 3.79Å; P431-W433 HydrophobicContact CG-CZ2 4.41Å; P431-W433 PolarHBondContact O-N 2.85Å

Retrieved 433 of 433 residues in 213.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).