A0A077Z3Y0_TRITR Loading...

ABC tran domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z3Y0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 417 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.9	Very low	31.8	Very low	239 Å²	239	121.7 Å²	121.7	100%	1.177	66%	0.658	S	S	*	*				0	76.1	0	-169.6	-178.4	-80.8	0	0	107.5
2	F	25.5	Very low	31.9	Very low	194 Å²	194	120.1 Å²	120.1	85%	0.851	65%	0.649	S	S	*	*			trans	-128.2	121.2	166.1	-93.3	-86	0	0	0	103.6
3	P	30.9	Very low	32.2	Very low	93 Å²	93	116.5 Å²	116.5	60%	0.604	65%	0.646	S	S	*	*			trans	-69.5	139.5	172.9	30.6	-29.6	0	0	0	107.7	F5	P3-F5 HydrophobicContact CG-CE2 4.29Å; P3-F5 WeakPolarHBondContact O-CD2 3.41Å; P3-F5 PolarHBondContact O-N 2.83Å
4	Q	36.3	Very low	32.1	Very low	123 Å²	123	118.7 Å²	118.7	58%	0.575	66%	0.655	S	S	*	*			trans	-57.7	107.6	167.4	-79.2	163.9	-44.7	0	0	108	G6 E286	Q4-G6 PolarHBondContact O-N 3.37Å; Q4-G6 VanDerWaalsContact O-N 3.08Å; Q4-E286 PolarHBondContact NE2-OE1 3.1Å; Q4-E286 PolarHBondContact OE1-OE1 3.12Å; Q4-E286 VanDerWaalsContact OE1-OE1 3.11Å
5	F	30.4	Very low	32.5	Very low	166 Å²	166	120.3 Å²	120.3	73%	0.728	67%	0.668	S	S	*	*			trans	-71.2	96.6	168.5	-82.9	-89.8	0	0	0	107.3	P3 V7	P3-F5 HydrophobicContact CG-CE2 4.29Å; P3-F5 WeakPolarHBondContact O-CD2 3.41Å; P3-F5 PolarHBondContact O-N 2.83Å; F5-V7 VanDerWaalsContact C-N 3.35Å; F5-V7 PolarHBondContact O-N 3.08Å
6	G	30.5	Very low	32.4	Very low	65 Å²	65	127 Å²	127	67%	0.67	68%	0.68	S	S	*	*			trans	-62.2	103.2	152.4	0	0	0	0	0	107	Q4 T8	Q4-G6 PolarHBondContact O-N 3.37Å; Q4-G6 VanDerWaalsContact O-N 3.08Å; G6-T8 VanDerWaalsContact C-N 3.28Å; G6-T8 PolarHBondContact O-N 3.03Å
7	V	32	Very low	32.4	Very low	111 Å²	111	128.3 Å²	128.3	67%	0.673	69%	0.687	S	S	*	*			trans	-70	91.9	175.3	-178.1	0	0	0	0	107	F5 I9	F5-V7 VanDerWaalsContact C-N 3.35Å; F5-V7 PolarHBondContact O-N 3.08Å; V7-I9 HydrophobicContact CG1-CG1 3.83Å; V7-I9 PolarHBondContact O-N 3.18Å
8	T	30.6	Very low	32.7	Very low	92 Å²	92	132.2 Å²	132.2	56%	0.564	70%	0.701	S	S	*	*			trans	-75	104.4	164.6	-55.8	0	0	0	0	106.8	G6 V10	G6-T8 VanDerWaalsContact C-N 3.28Å; G6-T8 PolarHBondContact O-N 3.03Å; T8-V10 HydrophobicContact CG2-CG2 3.94Å; T8-V10 PolarHBondContact O-N 3.2Å; T8-V10 VanDerWaalsContact O-N 3.13Å
9	I	33.5	Very low	32.9	Very low	101 Å²	101	135.4 Å²	135.4	52%	0.518	71%	0.711	S	S	.	*	B	Isolated β-bridge	trans	-77.8	98	169.7	-57.1	-179.1	0	0	0	106.6	V7 I11	V7-I9 HydrophobicContact CG1-CG1 3.83Å; V7-I9 PolarHBondContact O-N 3.18Å; I9-I11 HydrophobicContact CG2-CD1 4.42Å; I9-I11 HydrophobicContact CG2-CG1 3.67Å; I9-I11 PolarHBondContact O-N 3.09Å
10	V	31.8	Very low	32.9	Very low	91 Å²	91	140.2 Å²	140.2	55%	0.552	72%	0.719	S	S	*	*			trans	-78.7	97.7	165.9	-177.6	0	0	0	0	107.1	T8 N12	T8-V10 HydrophobicContact CG2-CG2 3.94Å; T8-V10 PolarHBondContact O-N 3.2Å; T8-V10 VanDerWaalsContact O-N 3.13Å; V10-N12 VanDerWaalsContact C-N 3.31Å; V10-N12 HydrophobicContact CG1-CB 4.49Å; V10-N12 PolarHBondContact O-N 3.11Å
11	I	38.9	Very low	32.9	Very low	64 Å²	64	142 Å²	142	33%	0.328	73%	0.725	S	S	.	*			trans	-76.9	90.4	170.2	-55.5	-179.7	0	0	0	106.6	I9 V376	I9-I11 HydrophobicContact CG2-CD1 4.42Å; I9-I11 HydrophobicContact CG2-CG1 3.67Å; I9-I11 PolarHBondContact O-N 3.09Å; I11-V376 HydrophobicContact CD1-CG1 4.26Å
12	N	33.6	Very low	33.1	Very low	102 Å²	102	137.7 Å²	137.7	55%	0.545	71%	0.706	S	S	.	*			trans	-90.9	126.1	168	-119.1	-6	0	0	0	108.5	V10 L14	V10-N12 VanDerWaalsContact C-N 3.31Å; V10-N12 HydrophobicContact CG1-CB 4.49Å; V10-N12 PolarHBondContact O-N 3.11Å; N12-L14 HydrophobicContact CB-CD1 4.24Å; N12-L14 HydrophobicContact CB-CG 4.49Å; N12-L14 PolarHBondContact O-N 2.85Å
13	A	35.7	Very low	33.5	Very low	74 Å²	74	133.1 Å²	133.1	61%	0.612	70%	0.696	S	S	*	*			trans	-66.3	58	176	0	0	0	0	0	112.7	V15	A13-V15 PolarHBondContact O-N 3.24Å
14	L	31.2	Very low	33.8	Very low	147 Å²	147	138.4 Å²	138.4	77%	0.77	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	12.5	-177.8	-96.4	161.4	0	0	0	114	N12	N12-L14 HydrophobicContact CB-CD1 4.24Å; N12-L14 HydrophobicContact CB-CG 4.49Å; N12-L14 PolarHBondContact O-N 2.85Å
15	V	37.1	Very low	33.5	Very low	142 Å²	142	135.2 Å²	135.2	86%	0.861	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	5.2	-175.6	-174.6	0	0	0	0	113.1	A13	A13-V15 PolarHBondContact O-N 3.24Å
16	R	31.8	Very low	34.1	Very low	228 Å²	228	133.9 Å²	133.9	86%	0.86	71%	0.709	S	S	*	*	S	Bend	trans	-129.4	12.3	-173.3	-94.5	-172.9	-173.3	-166.3	3.1	118.4
17	N	32.5	Very low	34.5	Very low	149 Å²	149	136 Å²	136	80%	0.797	71%	0.709	S	S	*	*			trans	-136.4	19.4	-177.3	-107.3	-14.5	0	0	0	116.6	E19	N17-E19 PolarHBondContact O-N 2.62Å
18	E	36.7	Very low	34.8	Very low	199 Å²	199	134.5 Å²	134.5	93%	0.93	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	7.8	177.4	-97.9	-176.7	166.2	0	0	115.4
19	E	36.2	Very low	35.3	Very low	192 Å²	192	136.9 Å²	136.9	90%	0.897	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	17.7	-176.9	-82.6	-166	164.6	0	0	116.2	N17	N17-E19 PolarHBondContact O-N 2.62Å
20	R	33.6	Very low	35.8	Very low	231 Å²	231	139 Å²	139	87%	0.872	72%	0.718	S	S	*	*			trans	-130.3	117.7	171.1	-73	-168.8	-176.2	-177.7	3.2	113.9
21	E	33	Very low	36.2	Very low	180 Å²	180	139.9 Å²	139.9	84%	0.841	72%	0.719	S	S	*	*			trans	-49.2	151.9	176.9	-62.4	175.9	145.5	0	0	115.1
22	N	32.5	Very low	36.3	Very low	147 Å²	147	142.2 Å²	142.2	79%	0.786	74%	0.739	S	S	*	*			trans	86.6	151.4	158.5	-77.4	-26.1	0	0	0	119.6
23	P	34.5	Very low	36.7	Very low	99 Å²	99	144 Å²	144	64%	0.643	75%	0.747	S	S	*	*				-138.3	88.2	-67.3	31.7	-8.9	0	0	0	109.9
24	F	38	Very low	37	Very low	204 Å²	204	148.5 Å²	148.5	90%	0.895	75%	0.75	S	S	*	*			trans	-145.8	117.6	166.8	-89.7	-81	0	0	0	109
25	G	29.9	Very low	37.7	Very low	55 Å²	55	149 Å²	149	57%	0.567	75%	0.753	S	S	*	*			trans	-70.1	124.8	-160.4	0	0	0	0	0	114.6
26	I	41.4	Very low	38	Very low	139 Å²	139	152 Å²	152	71%	0.713	75%	0.751	S	S	*	*	S	Bend	trans	-94.9	-3.4	160.2	-58.3	174.2	0	0	0	110	S28	I26-S28 VanDerWaalsContact C-N 3.28Å; I26-S28 PolarHBondContact O-N 3.44Å
27	T	40.1	Very low	38.5	Very low	110 Å²	110	144.5 Å²	144.5	68%	0.675	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-69.5	-16.8	176.1	39.2	0	0	0	0	114.3	L29	T27-L29 PolarHBondContact O-N 3.3Å
28	S	38.9	Very low	39.3	Very low	79 Å²	79	143.4 Å²	143.4	55%	0.552	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-82.4	-6.3	-177.3	62	0	0	0	0	115.8	I26 D31	I26-S28 VanDerWaalsContact C-N 3.28Å; I26-S28 PolarHBondContact O-N 3.44Å; S28-D31 WeakPolarHBondContact CA-OD2 3.47Å
29	L	40.8	Very low	40.2	Very low	141 Å²	141	139.5 Å²	139.5	74%	0.738	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-86.5	-11.2	176.6	-100.1	147.3	0	0	0	113.3	T27	T27-L29 PolarHBondContact O-N 3.3Å
30	F	42.4	Very low	41.9	Very low	147 Å²	147	133.3 Å²	133.3	65%	0.645	71%	0.706	S	S	*	*	S	Bend	trans	-114.6	-0.6	178.9	-70	-77.7	0	0	0	114.1	L33	F30-L33 PolarHBondContact O-N 3.44Å
31	D	41.4	Very low	44	Very low	108 Å²	108	130.2 Å²	130.2	58%	0.578	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-61.7	-26.7	177.9	-79.5	-28.3	0	0	0	115.9	S28 L33	S28-D31 WeakPolarHBondContact CA-OD2 3.47Å; D31-L33 VanDerWaalsContact C-N 3.26Å; D31-L33 PolarHBondContact O-N 3.44Å
32	P	40.9	Very low	46	Very low	114 Å²	114	125.3 Å²	125.3	74%	0.74	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-83	8.5	-179.1	29.5	-27.5	0	0	0	114.8
33	L	41.6	Very low	48	Very low	138 Å²	138	122 Å²	122	72%	0.723	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-106.6	-1.2	176.3	-79.7	163.5	0	0	0	114.1	F30 D31	F30-L33 PolarHBondContact O-N 3.44Å; D31-L33 VanDerWaalsContact C-N 3.26Å; D31-L33 PolarHBondContact O-N 3.44Å
34	Y	42.1	Very low	49.9	Very low	169 Å²	169	121.4 Å²	121.4	66%	0.663	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-0.7	-175.1	-111.1	-89.5	0	0	0	115.3	Y41	Y34-Y41 PolarHBondContact OH-OH 2.66Å
35	D	45.6	Very low	51.9	Low	158 Å²	158	116.4 Å²	116.4	85%	0.845	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	17.3	-172.3	-144.3	12.8	0	0	0	114.7
36	Y	44.7	Very low	54.3	Low	206 Å²	206	119 Å²	119	81%	0.808	64%	0.636	S	S	*	*	S	Bend	trans	-109.3	110	170.7	-88.4	-87.5	0	0	0	111
37	G	41.3	Very low	56.1	Low	69 Å²	69	118.2 Å²	118.2	71%	0.711	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.6	134.6	-177.7	0	0	0	0	0	114.4	F39	G37-F39 PolarHBondContact O-N 3.29Å
38	S	49.4	Very low	58.1	Low	127 Å²	127	119.3 Å²	119.3	89%	0.888	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.3	33.7	166.2	64.9	0	0	0	0	117.3	S40	S38-S40 PolarHBondContact O-N 3.28Å
39	F	56.4	Low	60.2	Low	116 Å²	116	120.5 Å²	120.5	51%	0.509	63%	0.63	S	S	.	*			trans	-68.3	106.7	165.2	-138.2	-95.2	0	0	0	109.2	G37 Y41 L43 L44	G37-F39 PolarHBondContact O-N 3.29Å; F39-Y41 PolarHBondContact O-N 3.41Å; F39-L43 HydrophobicContact CD1-CD2 4.39Å; F39-L43 HydrophobicContact CE1-CB 4.28Å; F39-L43 HydrophobicContact CE1-CD2 3.71Å; F39-L43 HydrophobicContact CE1-CG 4.14Å; F39-L43 HydrophobicContact CE2-CD2 4.08Å; F39-L43 HydrophobicContact CZ-CD2 3.53Å; F39-L43 HydrophobicContact CZ-CG 4.34Å; F39-L44 HydrophobicContact CD1-CD1 4.18Å; F39-L44 HydrophobicContact CE1-CD1 4.33Å
40	S	72.3	Confident	62.2	Low	63 Å²	63	120.6 Å²	120.6	44%	0.441	62%	0.624	S	S	.	*			trans	-65.6	127.4	-179.8	-174.3	0	0	0	0	109.5	S38 S42 L43	S38-S40 PolarHBondContact O-N 3.28Å; S40-S42 WeakPolarHBondContact CB-OG 3.32Å; S40-S42 PolarHBondContact O-N 2.91Å; S40-S42 PolarHBondContact OG-N 2.93Å; S40-S42 PolarHBondContact OG-OG 2.78Å; S40-L43 WeakPolarHBondContact O-CB 3.21Å; S40-L43 PolarHBondContact O-N 3.31Å
41	Y	76.7	Confident	63.9	Low	165 Å²	165	115 Å²	115	65%	0.647	61%	0.608	S	S	*	*	H	α-helix	trans	-48.8	-28.8	171.1	-70.9	-82.7	0	0	0	112.4	Y34 F39 L43 L44 I45	Y34-Y41 PolarHBondContact OH-OH 2.66Å; F39-Y41 PolarHBondContact O-N 3.41Å; Y41-L43 PolarHBondContact O-N 3.43Å; Y41-L44 PolarHBondContact O-N 2.92Å; Y41-I45 VanDerWaalsContact O-CG1 3.3Å; Y41-I45 WeakPolarHBondContact O-CG1 3.45Å; Y41-I45 PolarHBondContact O-N 3.17Å; Y41-I45 VanDerWaalsContact O-N 3.11Å
42	S	75.3	Confident	65.9	Low	78 Å²	78	112.1 Å²	112.1	55%	0.545	60%	0.599	S	S	.	*	H	α-helix	trans	-61.2	-38.3	174.3	68.1	0	0	0	0	113.8	S40 L46	S40-S42 WeakPolarHBondContact CB-OG 3.32Å; S40-S42 PolarHBondContact O-N 2.91Å; S40-S42 PolarHBondContact OG-N 2.93Å; S40-S42 PolarHBondContact OG-OG 2.78Å; S42-L46 WeakPolarHBondContact O-CB 3.41Å; S42-L46 PolarHBondContact O-N 3.32Å
43	L	75.2	Confident	67.9	Low	78 Å²	78	111 Å²	111	41%	0.408	59%	0.59	S	S	.	*	H	α-helix	trans	-71.6	-37.4	-179.6	-170.7	67.9	0	0	0	111.1	F39 S40 Y41 L46 M47	F39-L43 HydrophobicContact CD1-CD2 4.39Å; F39-L43 HydrophobicContact CE1-CB 4.28Å; F39-L43 HydrophobicContact CE1-CD2 3.71Å; F39-L43 HydrophobicContact CE1-CG 4.14Å; F39-L43 HydrophobicContact CE2-CD2 4.08Å; F39-L43 HydrophobicContact CZ-CD2 3.53Å; F39-L43 HydrophobicContact CZ-CG 4.34Å; S40-L43 WeakPolarHBondContact O-CB 3.21Å; S40-L43 PolarHBondContact O-N 3.31Å; Y41-L43 PolarHBondContact O-N 3.43Å; L43-L46 PolarHBondContact O-N 3.45Å; L43-M47 WeakPolarHBondContact O-CG 3.41Å; L43-M47 PolarHBondContact O-N 2.68Å
44	L	73.9	Confident	69.7	Low	85 Å²	85	108.5 Å²	108.5	45%	0.445	58%	0.576	S	S	.	*	H	α-helix	trans	-67.7	-42.5	178.2	-147	129.3	0	0	0	111.2	F39 Y41 L46 M47 M48	F39-L44 HydrophobicContact CD1-CD1 4.18Å; F39-L44 HydrophobicContact CE1-CD1 4.33Å; Y41-L44 PolarHBondContact O-N 2.92Å; L44-L46 VanDerWaalsContact C-N 3.35Å; L44-M47 PolarHBondContact O-N 3.39Å; L44-M48 HydrophobicContact CD2-CE 4.15Å; L44-M48 HydrophobicContact CD2-SD 4.36Å; L44-M48 WeakPolarHBondContact O-CG 3.41Å; L44-M48 PolarHBondContact O-N 3.38Å
45	I	79.6	Confident	71.3	Confident	99 Å²	99	107.3 Å²	107.3	51%	0.508	58%	0.577	S	S	.	*	H	α-helix	trans	-61.9	-43.1	172.6	-66.6	166.3	0	0	0	110.7	Y41 M47 M48 L49	Y41-I45 VanDerWaalsContact O-CG1 3.3Å; Y41-I45 WeakPolarHBondContact O-CG1 3.45Å; Y41-I45 PolarHBondContact O-N 3.17Å; Y41-I45 VanDerWaalsContact O-N 3.11Å; I45-M47 PolarHBondContact O-N 3.01Å; I45-M48 PolarHBondContact O-N 3.24Å; I45-L49 HydrophobicContact CG2-CD1 3.92Å; I45-L49 HydrophobicContact CG2-CG 4.41Å; I45-L49 WeakPolarHBondContact O-CB 3.36Å; I45-L49 WeakPolarHBondContact O-CG 3.37Å; I45-L49 PolarHBondContact O-N 3.22Å
46	L	81	Confident	73.1	Confident	110 Å²	110	105.7 Å²	105.7	58%	0.576	57%	0.568	S	S	*	*	H	α-helix	trans	-62.5	-42.4	177.5	-172.1	69.8	0	0	0	112	S42 L43 L44 L49 F50	S42-L46 WeakPolarHBondContact O-CB 3.41Å; S42-L46 PolarHBondContact O-N 3.32Å; L43-L46 PolarHBondContact O-N 3.45Å; L44-L46 VanDerWaalsContact C-N 3.35Å; L46-L49 PolarHBondContact O-N 2.96Å; L46-F50 WeakPolarHBondContact O-CB 3.49Å; L46-F50 PolarHBondContact O-N 3.46Å
47	M	78.8	Confident	74.7	Confident	122 Å²	122	101.9 Å²	101.9	60%	0.601	56%	0.555	S	S	*	*	H	α-helix	trans	-64.1	-41.6	176	-73	-177.9	72	0	0	112.2	L43 L44 I45 F50 G51	L43-M47 WeakPolarHBondContact O-CG 3.41Å; L43-M47 PolarHBondContact O-N 2.68Å; L44-M47 PolarHBondContact O-N 3.39Å; I45-M47 PolarHBondContact O-N 3.01Å; M47-F50 PolarHBondContact O-N 3.32Å; M47-G51 PolarHBondContact O-N 2.92Å
48	M	82.1	Confident	76.2	Confident	133 Å²	133	104.4 Å²	104.4	66%	0.655	55%	0.547	S	S	*	.	H	α-helix	trans	-63.5	-43.8	175.3	-75.6	-176.7	160.3	0	0	112	L44 I45 G51 A52	L44-M48 HydrophobicContact CD2-CE 4.15Å; L44-M48 HydrophobicContact CD2-SD 4.36Å; L44-M48 WeakPolarHBondContact O-CG 3.41Å; L44-M48 PolarHBondContact O-N 3.38Å; I45-M48 PolarHBondContact O-N 3.24Å; M48-G51 PolarHBondContact O-N 3.17Å; M48-A52 WeakPolarHBondContact O-CB 3.4Å; M48-A52 PolarHBondContact O-N 3.27Å
49	L	83.4	Confident	77.3	Confident	105 Å²	105	100.6 Å²	100.6	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-42.5	175.8	-73	170.1	0	0	0	111.6	I45 L46 A52 V53	I45-L49 HydrophobicContact CG2-CD1 3.92Å; I45-L49 HydrophobicContact CG2-CG 4.41Å; I45-L49 WeakPolarHBondContact O-CB 3.36Å; I45-L49 WeakPolarHBondContact O-CG 3.37Å; I45-L49 PolarHBondContact O-N 3.22Å; L46-L49 PolarHBondContact O-N 2.96Å; L49-A52 PolarHBondContact O-N 3.25Å; L49-V53 VanDerWaalsContact O-CG2 3.29Å; L49-V53 WeakPolarHBondContact O-CG2 3.34Å; L49-V53 PolarHBondContact O-N 3.4Å
50	F	81.7	Confident	78.4	Confident	142 Å²	142	102.1 Å²	102.1	62%	0.623	53%	0.526	S	S	*	.	H	α-helix	trans	-64.7	-42.5	177.7	-159.2	-103.8	0	0	0	111.7	L46 M47 V53 I54	L46-F50 WeakPolarHBondContact O-CB 3.49Å; L46-F50 PolarHBondContact O-N 3.46Å; M47-F50 PolarHBondContact O-N 3.32Å; F50-V53 PolarHBondContact O-N 2.96Å; F50-I54 HydrophobicContact CD1-CD1 3.57Å; F50-I54 HydrophobicContact CD1-CG1 4.36Å; F50-I54 HydrophobicContact CE1-CD1 3.55Å; F50-I54 HydrophobicContact CE1-CG1 4.32Å; F50-I54 HydrophobicContact CZ-CD1 4.5Å; F50-I54 WeakPolarHBondContact O-CG1 3.4Å; F50-I54 PolarHBondContact O-N 3.48Å
51	G	79.4	Confident	78.4	Confident	29 Å²	29	105 Å²	105	30%	0.299	53%	0.528	S	S	.	.	H	α-helix	trans	-61.1	-43.1	173.3	0	0	0	0	0	112.6	M47 M48 I54 H55	M47-G51 PolarHBondContact O-N 2.92Å; M48-G51 PolarHBondContact O-N 3.17Å; G51-I54 PolarHBondContact O-N 3.4Å; G51-H55 PolarHBondContact O-CD2 3.01Å; G51-H55 VanDerWaalsContact O-CD2 3.26Å; G51-H55 PolarHBondContact O-N 2.92Å
52	A	82	Confident	78.1	Confident	48 Å²	48	101.9 Å²	101.9	40%	0.397	52%	0.521	S	S	.	.	H	α-helix	trans	-64	-41.8	176.4	0	0	0	0	0	112.3	M48 L49 H55 L56	M48-A52 WeakPolarHBondContact O-CB 3.4Å; M48-A52 PolarHBondContact O-N 3.27Å; L49-A52 PolarHBondContact O-N 3.25Å; A52-H55 PolarHBondContact O-N 3.24Å; A52-L56 WeakPolarHBondContact O-CB 3.48Å; A52-L56 VanDerWaalsContact O-CG 3.32Å; A52-L56 WeakPolarHBondContact O-CG 3.24Å; A52-L56 PolarHBondContact O-N 2.91Å
53	V	82.5	Confident	77.7	Confident	91 Å²	91	103.3 Å²	103.3	55%	0.552	52%	0.522	S	S	*	.	H	α-helix	trans	-64.9	-42.7	176.3	171.8	0	0	0	0	111.2	L49 F50 L56 F57	L49-V53 VanDerWaalsContact O-CG2 3.29Å; L49-V53 WeakPolarHBondContact O-CG2 3.34Å; L49-V53 PolarHBondContact O-N 3.4Å; F50-V53 PolarHBondContact O-N 2.96Å; V53-L56 PolarHBondContact O-N 3.2Å; V53-F57 WeakPolarHBondContact O-CB 3.41Å; V53-F57 PolarHBondContact O-N 3.43Å
54	I	80.7	Confident	77.4	Confident	85 Å²	85	103 Å²	103	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-47.1	174.5	-70	167.7	0	0	0	110.1	F50 G51 L56 F57 F58	F50-I54 HydrophobicContact CD1-CD1 3.57Å; F50-I54 HydrophobicContact CD1-CG1 4.36Å; F50-I54 HydrophobicContact CE1-CD1 3.55Å; F50-I54 HydrophobicContact CE1-CG1 4.32Å; F50-I54 HydrophobicContact CZ-CD1 4.5Å; F50-I54 WeakPolarHBondContact O-CG1 3.4Å; F50-I54 PolarHBondContact O-N 3.48Å; G51-I54 PolarHBondContact O-N 3.4Å; I54-L56 PolarHBondContact O-N 3.35Å; I54-F57 PolarHBondContact O-N 3.32Å; I54-F58 WeakPolarHBondContact O-CB 3.43Å; I54-F58 PolarHBondContact O-N 3Å
55	H	75.9	Confident	76.8	Confident	144 Å²	144	102 Å²	102	67%	0.667	51%	0.514	S	S	*	.	H	α-helix	trans	-62.5	-41.3	178	-85.2	-62.5	0	0	0	112.7	G51 A52 F58 A59	G51-H55 PolarHBondContact O-CD2 3.01Å; G51-H55 VanDerWaalsContact O-CD2 3.26Å; G51-H55 PolarHBondContact O-N 2.92Å; A52-H55 PolarHBondContact O-N 3.24Å; H55-F58 PolarHBondContact O-N 2.89Å; H55-A59 WeakPolarHBondContact O-CB 3.31Å; H55-A59 PolarHBondContact O-N 2.64Å
56	L	81.9	Confident	75.6	Confident	125 Å²	125	103.8 Å²	103.8	65%	0.654	51%	0.514	S	S	*	.	H	α-helix	trans	-65.1	-42.1	175.5	-76	167.9	0	0	0	111.8	A52 V53 I54 A59 W60	A52-L56 WeakPolarHBondContact O-CB 3.48Å; A52-L56 VanDerWaalsContact O-CG 3.32Å; A52-L56 WeakPolarHBondContact O-CG 3.24Å; A52-L56 PolarHBondContact O-N 2.91Å; V53-L56 PolarHBondContact O-N 3.2Å; I54-L56 PolarHBondContact O-N 3.35Å; L56-A59 PolarHBondContact O-N 2.94Å; L56-W60 VanDerWaalsContact O-CB 3.26Å; L56-W60 WeakPolarHBondContact O-CB 3.37Å; L56-W60 PolarHBondContact O-N 2.79Å
57	F	79.9	Confident	74.4	Confident	125 Å²	125	100.6 Å²	100.6	55%	0.548	50%	0.501	S	S	.	.	H	α-helix	trans	-65.1	-42.7	176.1	-174.4	-95.8	0	0	0	111.3	V53 I54 W60 Y61	V53-F57 WeakPolarHBondContact O-CB 3.41Å; V53-F57 PolarHBondContact O-N 3.43Å; I54-F57 PolarHBondContact O-N 3.32Å; F57-W60 HydrophobicContact CD2-CE3 4.3Å; F57-W60 HydrophobicContact CE2-CE3 4.16Å; F57-W60 HydrophobicContact CE2-CZ3 4.07Å; F57-W60 PolarHBondContact O-N 2.67Å; F57-Y61 VanDerWaalsContact O-CB 3.22Å; F57-Y61 WeakPolarHBondContact O-CB 3.21Å; F57-Y61 PolarHBondContact O-N 3.23Å
58	F	71.6	Confident	73.2	Confident	123 Å²	123	101 Å²	101	54%	0.539	50%	0.499	S	S	.	.	H	α-helix	trans	-65.8	-42.2	176.6	-135.6	-92.9	0	0	0	111.4	I54 H55 Y61 L62	I54-F58 WeakPolarHBondContact O-CB 3.43Å; I54-F58 PolarHBondContact O-N 3Å; H55-F58 PolarHBondContact O-N 2.89Å; F58-Y61 PolarHBondContact O-N 3.16Å; F58-L62 HydrophobicContact CD1-CD1 3.94Å; F58-L62 HydrophobicContact CD1-CG 4.25Å; F58-L62 HydrophobicContact CE1-CD1 4.43Å; F58-L62 WeakPolarHBondContact O-CB 3.2Å; F58-L62 VanDerWaalsContact O-CG 3.24Å; F58-L62 WeakPolarHBondContact O-CG 3.4Å; F58-L62 PolarHBondContact O-N 3.19Å
59	A	72.2	Confident	71.5	Confident	47 Å²	47	99.3 Å²	99.3	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-44.1	175.2	0	0	0	0	0	111.7	H55 L56 L62 L63	H55-A59 WeakPolarHBondContact O-CB 3.31Å; H55-A59 PolarHBondContact O-N 2.64Å; L56-A59 PolarHBondContact O-N 2.94Å; A59-L62 PolarHBondContact O-N 3.04Å; A59-L63 WeakPolarHBondContact O-CB 3.43Å; A59-L63 VanDerWaalsContact O-CG 3.29Å; A59-L63 WeakPolarHBondContact O-CG 3.44Å; A59-L63 PolarHBondContact O-N 2.81Å
60	W	79.5	Confident	69.7	Low	148 Å²	148	99 Å²	99	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-62.6	-45.2	174.5	176.8	71.9	0	0	0	111.7	L56 F57 L62 L63 E64	L56-W60 VanDerWaalsContact O-CB 3.26Å; L56-W60 WeakPolarHBondContact O-CB 3.37Å; L56-W60 PolarHBondContact O-N 2.79Å; F57-W60 HydrophobicContact CD2-CE3 4.3Å; F57-W60 HydrophobicContact CE2-CE3 4.16Å; F57-W60 HydrophobicContact CE2-CZ3 4.07Å; F57-W60 PolarHBondContact O-N 2.67Å; W60-L62 PolarHBondContact O-N 3.33Å; W60-L63 PolarHBondContact O-N 3.13Å; W60-E64 WeakPolarHBondContact O-CB 3.48Å; W60-E64 PolarHBondContact O-N 3.46Å
61	Y	72.9	Confident	68	Low	124 Å²	124	99.6 Å²	99.6	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-41.6	177.3	-176.8	-106.1	0	0	0	112.2	F57 F58 E64 I65	F57-Y61 VanDerWaalsContact O-CB 3.22Å; F57-Y61 WeakPolarHBondContact O-CB 3.21Å; F57-Y61 PolarHBondContact O-N 3.23Å; F58-Y61 PolarHBondContact O-N 3.16Å; Y61-E64 PolarHBondContact O-N 3.17Å; Y61-I65 HydrophobicContact CD1-CD1 3.73Å; Y61-I65 HydrophobicContact CE1-CD1 3.23Å; Y61-I65 HydrophobicContact CE1-CG1 4.27Å; Y61-I65 HydrophobicContact CE2-CD1 4.31Å; Y61-I65 HydrophobicContact CG-CD1 4.45Å; Y61-I65 WeakPolarHBondContact O-CG1 3.16Å; Y61-I65 PolarHBondContact O-N 3.23Å
62	L	69.6	Low	66.1	Low	98 Å²	98	104.9 Å²	104.9	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-65.3	-39.9	173.9	-73.9	172.5	0	0	0	111.9	F58 A59 W60 R66	F58-L62 HydrophobicContact CD1-CD1 3.94Å; F58-L62 HydrophobicContact CD1-CG 4.25Å; F58-L62 HydrophobicContact CE1-CD1 4.43Å; F58-L62 WeakPolarHBondContact O-CB 3.2Å; F58-L62 VanDerWaalsContact O-CG 3.24Å; F58-L62 WeakPolarHBondContact O-CG 3.4Å; F58-L62 PolarHBondContact O-N 3.19Å; A59-L62 PolarHBondContact O-N 3.04Å; W60-L62 PolarHBondContact O-N 3.33Å; L62-R66 WeakPolarHBondContact O-CB 3.34Å; L62-R66 PolarHBondContact O-N 2.9Å
63	L	67.4	Low	64.2	Low	108 Å²	108	104.7 Å²	104.7	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-65.4	-37.2	174.6	-77.5	167	0	0	0	112.3	A59 W60 R66 S67	A59-L63 WeakPolarHBondContact O-CB 3.43Å; A59-L63 VanDerWaalsContact O-CG 3.29Å; A59-L63 WeakPolarHBondContact O-CG 3.44Å; A59-L63 PolarHBondContact O-N 2.81Å; W60-L63 PolarHBondContact O-N 3.13Å; L63-R66 CarbonylContact O-C 3.58Å; L63-R66 WeakPolarHBondContact O-CB 3.27Å; L63-R66 PolarHBondContact O-N 3.26Å; L63-S67 PolarHBondContact O-N 3.14Å
64	E	68.9	Low	61.7	Low	72 Å²	72	103.8 Å²	103.8	34%	0.336	52%	0.516	S	S	.	.	H	α-helix	trans	-72.4	-39.9	178.1	-169.8	66	-158.7	0	0	111.9	W60 Y61 R66 S67 K68	W60-E64 WeakPolarHBondContact O-CB 3.48Å; W60-E64 PolarHBondContact O-N 3.46Å; Y61-E64 PolarHBondContact O-N 3.17Å; E64-R66 VanDerWaalsContact C-N 3.26Å; E64-R66 PolarHBondContact O-N 2.91Å; E64-S67 PolarHBondContact O-N 3.27Å; E64-S67 PolarHBondContact O-OG 2.99Å; E64-S67 VanDerWaalsContact O-OG 3.09Å; E64-K68 WeakPolarHBondContact O-CG 3.41Å; E64-K68 PolarHBondContact O-N 2.97Å; E64-K68 VanDerWaalsContact O-N 3.09Å
65	I	61.7	Low	59.4	Low	65 Å²	65	103 Å²	103	33%	0.333	53%	0.53	S	S	.	.	H	α-helix	trans	-60.8	-42.9	169.1	-71.5	172.9	0	0	0	109.6	Y61 K68 F69	Y61-I65 HydrophobicContact CD1-CD1 3.73Å; Y61-I65 HydrophobicContact CE1-CD1 3.23Å; Y61-I65 HydrophobicContact CE1-CG1 4.27Å; Y61-I65 HydrophobicContact CE2-CD1 4.31Å; Y61-I65 HydrophobicContact CG-CD1 4.45Å; Y61-I65 WeakPolarHBondContact O-CG1 3.16Å; Y61-I65 PolarHBondContact O-N 3.23Å; I65-K68 PolarHBondContact O-N 3.43Å; I65-F69 HydrophobicContact CG2-CD2 3.92Å; I65-F69 HydrophobicContact CG2-CE2 4.32Å; I65-F69 WeakPolarHBondContact O-CB 3.48Å; I65-F69 PolarHBondContact O-N 3.26Å
66	R	55.5	Low	57.5	Low	135 Å²	135	103.4 Å²	103.4	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-63.4	-42.9	177.9	-172.6	177.4	171.2	165.9	-1.6	111.4	L62 L63 E64 K68 F69 F70	L62-R66 WeakPolarHBondContact O-CB 3.34Å; L62-R66 PolarHBondContact O-N 2.9Å; L63-R66 CarbonylContact O-C 3.58Å; L63-R66 WeakPolarHBondContact O-CB 3.27Å; L63-R66 PolarHBondContact O-N 3.26Å; E64-R66 VanDerWaalsContact C-N 3.26Å; E64-R66 PolarHBondContact O-N 2.91Å; R66-K68 PolarHBondContact O-N 3.02Å; R66-F69 PolarHBondContact O-N 2.92Å; R66-F70 HydrophobicContact CG-CD2 3.46Å; R66-F70 VanDerWaalsContact CG-CD2 3.46Å; R66-F70 HydrophobicContact CG-CE2 3.63Å; R66-F70 WeakPolarHBondContact O-CB 3.26Å; R66-F70 VanDerWaalsContact O-CD2 3.3Å; R66-F70 WeakPolarHBondContact O-CD2 3.39Å; R66-F70 PolarHBondContact O-N 3.36Å
67	S	54.9	Low	55.9	Low	44 Å²	44	105.5 Å²	105.5	31%	0.308	54%	0.537	S	S	.	.	H	α-helix	trans	-62.7	-45	177.9	80.9	0	0	0	0	111	L63 E64 F69 F70 E71	L63-S67 PolarHBondContact O-N 3.14Å; E64-S67 PolarHBondContact O-N 3.27Å; E64-S67 PolarHBondContact O-OG 2.99Å; E64-S67 VanDerWaalsContact O-OG 3.09Å; S67-F69 VanDerWaalsContact C-N 3.31Å; S67-F69 PolarHBondContact O-N 2.83Å; S67-F70 PolarHBondContact O-N 3.41Å; S67-E71 WeakPolarHBondContact O-CB 3.18Å; S67-E71 WeakPolarHBondContact O-CG 3.36Å; S67-E71 PolarHBondContact O-N 2.95Å
68	K	52.9	Low	54.6	Low	129 Å²	129	104 Å²	104	56%	0.561	54%	0.535	S	S	*	.	H	α-helix	trans	-64.1	-33.6	176.8	-71.8	179.8	-178.9	177.4	0	113.3	E64 I65 R66	E64-K68 WeakPolarHBondContact O-CG 3.41Å; E64-K68 PolarHBondContact O-N 2.97Å; E64-K68 VanDerWaalsContact O-N 3.09Å; I65-K68 PolarHBondContact O-N 3.43Å; R66-K68 PolarHBondContact O-N 3.02Å
69	F	47.4	Very low	54.6	Low	98 Å²	98	104.6 Å²	104.6	43%	0.43	54%	0.537	S	S	.	.	H	α-helix	trans	-73.1	-40	173.7	-103.1	-88.3	0	0	0	112.4	I65 R66 S67	I65-F69 HydrophobicContact CG2-CD2 3.92Å; I65-F69 HydrophobicContact CG2-CE2 4.32Å; I65-F69 WeakPolarHBondContact O-CB 3.48Å; I65-F69 PolarHBondContact O-N 3.26Å; R66-F69 PolarHBondContact O-N 2.92Å; S67-F69 VanDerWaalsContact C-N 3.31Å; S67-F69 PolarHBondContact O-N 2.83Å
70	F	46.1	Very low	54.8	Low	98 Å²	98	105.1 Å²	105.1	43%	0.43	53%	0.531	S	S	.	.	H	α-helix	trans	-79.6	-29.3	-177.4	-90	-89	0	0	0	113.6	R66 S67 N72 A73 A311	R66-F70 HydrophobicContact CG-CD2 3.46Å; R66-F70 VanDerWaalsContact CG-CD2 3.46Å; R66-F70 HydrophobicContact CG-CE2 3.63Å; R66-F70 WeakPolarHBondContact O-CB 3.26Å; R66-F70 VanDerWaalsContact O-CD2 3.3Å; R66-F70 WeakPolarHBondContact O-CD2 3.39Å; R66-F70 PolarHBondContact O-N 3.36Å; S67-F70 PolarHBondContact O-N 3.41Å; F70-N72 PolarHBondContact O-N 3.1Å; F70-A73 PolarHBondContact O-N 3.43Å; F70-A311 HydrophobicContact CE2-CB 4.33Å; F70-A311 HydrophobicContact CZ-CB 4.23Å
71	E	44.7	Very low	54.8	Low	156 Å²	156	99.1 Å²	99.1	73%	0.729	51%	0.509	S	S	*	.	H	α-helix	trans	-63.3	-25.3	175.4	-82.2	-176.2	163	0	0	112.5	S67	S67-E71 WeakPolarHBondContact O-CB 3.18Å; S67-E71 WeakPolarHBondContact O-CG 3.36Å; S67-E71 PolarHBondContact O-N 2.95Å
72	N	40	Very low	54.8	Low	139 Å²	139	98.6 Å²	98.6	74%	0.743	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-4.3	174	-72.2	-27	0	0	0	114.1	F70	F70-N72 PolarHBondContact O-N 3.1Å
73	A	42	Very low	55	Low	45 Å²	45	96 Å²	96	37%	0.372	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	12.8	-178.8	0	0	0	0	0	113.6	F70 G75	F70-A73 PolarHBondContact O-N 3.43Å; A73-G75 PolarHBondContact O-N 3.5Å
74	G	30.8	Very low	55.4	Low	71 Å²	71	100.5 Å²	100.5	73%	0.732	52%	0.518	S	S	*	.			trans	-79.2	107.9	179.3	0	0	0	0	0	113.4
75	G	31	Very low	55.9	Low	70 Å²	70	102.4 Å²	102.4	72%	0.722	53%	0.525	S	S	*	.	S	Bend	trans	90.5	115.1	165	0	0	0	0	0	114	A73	A73-G75 PolarHBondContact O-N 3.5Å
76	D	36.8	Very low	57.1	Low	152 Å²	152	103.3 Å²	103.3	81%	0.813	54%	0.536	S	S	*	.	S	Bend	trans	59.7	105.4	-170.4	-75.7	-21.8	0	0	0	114.7	L78	D76-L78 PolarHBondContact O-N 3.07Å
77	Y	47.4	Very low	58.9	Low	168 Å²	168	99.4 Å²	99.4	66%	0.659	53%	0.526	S	S	*	.			trans	-49.5	102.2	177	-58.3	-83	0	0	0	110.8	K79	Y77-K79 PolarHBondContact O-N 3Å
78	L	54.1	Low	60.8	Low	95 Å²	95	98.6 Å²	98.6	50%	0.497	52%	0.519	S	S	.	.			trans	-63.1	107.1	172.2	-71.5	175.5	0	0	0	107.2	D76 Q80 F308	D76-L78 PolarHBondContact O-N 3.07Å; L78-Q80 PolarHBondContact O-N 3.15Å; L78-F308 HydrophobicContact CB-CZ 4.16Å; L78-F308 WeakPolarHBondContact O-CZ 3.41Å
79	K	70.6	Confident	62.8	Low	135 Å²	135	92.5 Å²	92.5	59%	0.587	49%	0.492	S	S	*	.	S	Bend	trans	-63.3	-18.1	171.7	-72.4	-179.7	177.1	177.1	0	111.1	Y77 K301 C302 S303	Y77-K79 PolarHBondContact O-N 3Å; K79-K301 WeakPolarHBondContact CD-O 3.49Å; K79-C302 CarbonylContact O-C 3.53Å; K79-C302 WeakPolarHBondContact O-CA 3.48Å; K79-C302 WeakPolarHBondContact O-CB 3.35Å; K79-S303 PolarHBondContact O-N 2.85Å
80	Q	76.3	Confident	65	Low	58 Å²	58	88.4 Å²	88.4	27%	0.271	48%	0.476	S	S	.	.	B	Isolated β-bridge	trans	-130.9	127.4	-177.2	-59.7	-174.1	2.2	0	0	110.4	L78 I82 S112 S303	L78-Q80 PolarHBondContact O-N 3.15Å; Q80-I82 PolarHBondContact O-N 3.29Å; Q80-S112 PolarHBondContact NE2-O 2.59Å; Q80-S303 CarbonylContact C-O 3.55Å; Q80-S303 VanDerWaalsContact CA-O 3.24Å; Q80-S303 WeakPolarHBondContact CA-O 3.44Å
81	E	79.6	Confident	67.3	Low	21 Å²	21	83.9 Å²	83.9	10%	0.098	46%	0.456	C	S	.	.			trans	-74.7	114.3	168.3	-176.7	-179.1	-149.5	0	0	108.5	L83 R291 S303 S305 F308	E81-L83 HydrophobicContact CG-CD2 4.19Å; E81-L83 HydrophobicContact CG-CG 4.4Å; E81-R291 PolarHBondContact O-NH2 2.95Å; E81-R291 IonicContact OE2-CZ 3.21Å; E81-R291 IonicContact OE2-NH1 2.57Å; E81-R291 PolarHBondContact OE2-NH1 3.46Å; E81-R291 IonicContact OE2-NH2 3.56Å; E81-S303 PolarHBondContact N-O 2.95Å; E81-S305 PolarHBondContact OE1-OG 2.88Å; E81-S305 WeakPolarHBondContact OE2-CB 3.47Å; E81-S305 PolarHBondContact OE2-N 2.74Å; E81-S305 PolarHBondContact OE2-OG 2.64Å; E81-S305 VanDerWaalsContact OE2-OG 3.09Å; E81-F308 HydrophobicContact CB-CB 4.39Å; E81-F308 HydrophobicContact CB-CD1 3.73Å; E81-F308 HydrophobicContact CB-CD2 3.66Å; E81-F308 HydrophobicContact CB-CE1 3.74Å; E81-F308 HydrophobicContact CB-CE2 3.65Å; E81-F308 HydrophobicContact CB-CG 3.67Å; E81-F308 HydrophobicContact CB-CZ 3.68Å; E81-F308 HydrophobicContact CG-CB 4.44Å; E81-F308 HydrophobicContact CG-CD2 3.74Å; E81-F308 HydrophobicContact CG-CE2 4.01Å; E81-F308 HydrophobicContact CG-CG 4.03Å
82	I	73.6	Confident	69.7	Low	113 Å²	113	80.9 Å²	80.9	58%	0.579	44%	0.442	S	S	*	.			trans	-95.1	127.4	177.6	-59.7	172.9	0	0	0	108.2	Q80	Q80-I82 PolarHBondContact O-N 3.29Å
83	L	73.7	Confident	72.3	Confident	44 Å²	44	79.6 Å²	79.6	23%	0.23	43%	0.431	C	S	.	.			trans	-112.7	149.9	178.5	-62.6	174.5	0	0	0	110.4	E81 F85 Y116	E81-L83 HydrophobicContact CG-CD2 4.19Å; E81-L83 HydrophobicContact CG-CG 4.4Å; L83-F85 HydrophobicContact CB-CD2 3.65Å; L83-F85 HydrophobicContact CB-CE2 4.29Å; L83-F85 HydrophobicContact CB-CG 4.42Å; L83-F85 HydrophobicContact CD1-CD2 3.66Å; L83-F85 HydrophobicContact CD1-CE2 3.83Å; L83-F85 HydrophobicContact CG-CD2 4.22Å; L83-F85 HydrophobicContact CG-CE2 4.5Å; L83-F85 PolarHBondContact O-N 3.18Å; L83-F85 VanDerWaalsContact O-N 3.11Å; L83-Y116 HydrophobicContact CB-CE1 4.34Å; L83-Y116 HydrophobicContact CB-CE2 4.23Å; L83-Y116 HydrophobicContact CD1-CD2 4.49Å; L83-Y116 HydrophobicContact CD1-CE2 4.4Å; L83-Y116 PolarHBondContact N-OH 2.93Å
84	H	75.5	Confident	74.8	Confident	202 Å²	202	77.4 Å²	77.4	94%	0.935	41%	0.414	S	S	*	.	S	Bend	trans	-80.8	26.7	173.9	-64.1	-57.8	0	0	0	113.1
85	F	79.3	Confident	77.9	Confident	112 Å²	112	75 Å²	75	49%	0.491	39%	0.386	S	S	.	.	S	Bend	trans	-83.3	153.4	174.9	-71.1	-54.8	0	0	0	111	L83 V87 Y116	L83-F85 HydrophobicContact CB-CD2 3.65Å; L83-F85 HydrophobicContact CB-CE2 4.29Å; L83-F85 HydrophobicContact CB-CG 4.42Å; L83-F85 HydrophobicContact CD1-CD2 3.66Å; L83-F85 HydrophobicContact CD1-CE2 3.83Å; L83-F85 HydrophobicContact CG-CD2 4.22Å; L83-F85 HydrophobicContact CG-CE2 4.5Å; L83-F85 PolarHBondContact O-N 3.18Å; L83-F85 VanDerWaalsContact O-N 3.11Å; F85-V87 PolarHBondContact O-N 3.31Å; F85-Y116 HydrophobicContact CB-CD1 3.74Å; F85-Y116 HydrophobicContact CB-CG 4.02Å; F85-Y116 WeakPolarHBondContact O-CD1 3.21Å
86	P	87.6	Confident	80.9	Confident	85 Å²	85	72.6 Å²	72.6	55%	0.552	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-60.8	126.9	173.5	24.1	-32.4	0	0	0	110.5	Y116 A117	P86-Y116 WeakPolarHBondContact O-CA 3.34Å; P86-A117 HydrophobicContact CB-CB 4.36Å; P86-A117 HydrophobicContact CG-CB 3.78Å; P86-A117 PolarHBondContact O-N 3.42Å
87	V	92.4	Very high	83.5	Confident	52 Å²	52	67.1 Å²	67.1	32%	0.315	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	116.5	177.4	-179.5	0	0	0	0	108.9	F85 L89 E114 Y116	F85-V87 PolarHBondContact O-N 3.31Å; V87-L89 VanDerWaalsContact CG1-O 3.3Å; V87-L89 WeakPolarHBondContact CG1-O 3.4Å; V87-E114 HydrophobicContact CG1-CB 4.16Å; V87-E114 HydrophobicContact CG1-CG 4.37Å; V87-E114 HydrophobicContact CG2-CB 4.28Å; V87-E114 HydrophobicContact CG2-CG 4.4Å; V87-Y116 HydrophobicContact CG2-CD1 3.72Å; V87-Y116 HydrophobicContact CG2-CE1 3.52Å
88	D	94.1	Very high	85.6	Confident	28 Å²	28	63.6 Å²	63.6	15%	0.15	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-31.6	178.1	-95.2	-0	0	0	0	111.7	F115 L151 L152 V244 T274	D88-F115 PolarHBondContact N-O 3.47Å; D88-L151 WeakPolarHBondContact O-CD1 3.44Å; D88-L152 HydrophobicContact CB-CD2 4.23Å; D88-L152 PolarHBondContact O-N 3.42Å; D88-L152 WeakPolarHBondContact OD1-CD2 3.15Å; D88-V244 HydrophobicContact CB-CG2 3.81Å; D88-T274 HydrophobicContact CB-CG2 4.26Å; D88-T274 PolarHBondContact OD2-OG1 3.5Å
89	L	95.1	Very high	87.1	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	136.2	178.7	174.8	62.6	0	0	0	109.2	V87 F115 M138 V149 V150 L151 V244 V246 V276	V87-L89 VanDerWaalsContact CG1-O 3.3Å; V87-L89 WeakPolarHBondContact CG1-O 3.4Å; L89-F115 HydrophobicContact CB-CB 4.12Å; L89-F115 HydrophobicContact CB-CD2 4.18Å; L89-F115 HydrophobicContact CD2-CD2 4.18Å; L89-F115 HydrophobicContact CG-CD2 3.91Å; L89-F115 PolarHBondContact N-O 2.78Å; L89-F115 WeakPolarHBondContact O-CB 3.25Å; L89-F115 WeakPolarHBondContact O-CD2 3.45Å; L89-F115 PolarHBondContact O-N 2.75Å; L89-M138 HydrophobicContact CD2-CB 4.46Å; L89-M138 HydrophobicContact CD2-CE 3.23Å; L89-M138 HydrophobicContact CG-CE 4.05Å; L89-V149 HydrophobicContact CD1-CG1 3.54Å; L89-V150 CarbonylContact C-O 3.37Å; L89-V150 WeakPolarHBondContact CA-O 3.32Å; L89-L151 HydrophobicContact CB-CD1 3.98Å; L89-L151 HydrophobicContact CD1-CB 4.19Å; L89-L151 HydrophobicContact CD1-CD1 3.88Å; L89-L151 HydrophobicContact CG-CD1 4.39Å; L89-V244 HydrophobicContact CB-CG1 4.36Å; L89-V244 HydrophobicContact CD2-CG1 4.01Å; L89-V246 HydrophobicContact CD2-CG2 4.48Å; L89-V276 HydrophobicContact CD2-CG2 4.42Å
90	S	94.6	Very high	87.5	Confident	12 Å²	12	63 Å²	63	8%	0.084	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	150.6	171.6	62.8	0	0	0	0	111.2	A113 V149 V150	S90-A113 CarbonylContact C-O 3.52Å; S90-A113 WeakPolarHBondContact CA-O 3.36Å; S90-V149 WeakPolarHBondContact O-CA 3.48Å; S90-V149 WeakPolarHBondContact O-CG1 3.29Å; S90-V150 PolarHBondContact N-O 3.21Å; S90-V150 PolarHBondContact O-N 2.98Å; S90-V150 WeakPolarHBondContact OG-CB 3.09Å
91	V	94.9	Very high	87.7	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.018	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.3	178.8	170.6	0	0	0	0	104.6	I94 V111 S112 A113 F115 L134 M138 V149	V91-I94 HydrophobicContact CB-CG1 4.4Å; V91-I94 HydrophobicContact CG1-CB 3.67Å; V91-I94 HydrophobicContact CG1-CG1 3.29Å; V91-V111 HydrophobicContact CG1-CG1 4.36Å; V91-V111 WeakPolarHBondContact CG1-O 2.96Å; V91-S112 CarbonylContact O-C 3.55Å; V91-S112 WeakPolarHBondContact O-CA 3.42Å; V91-A113 PolarHBondContact N-O 2.7Å; V91-A113 PolarHBondContact O-N 2.85Å; V91-F115 HydrophobicContact CG2-CE2 4.01Å; V91-L134 HydrophobicContact CG1-CD1 3.86Å; V91-L134 HydrophobicContact CG2-CD1 4.47Å; V91-M138 HydrophobicContact CG2-CE 4.31Å; V91-M138 HydrophobicContact CG2-CG 3.46Å; V91-M138 VanDerWaalsContact CG2-CG 3.46Å; V91-M138 HydrophobicContact CG2-SD 3.96Å; V91-V149 HydrophobicContact CG2-CG1 4.49Å
92	E	94.2	Very high	87.5	Confident	93 Å²	93	72.8 Å²	72.8	44%	0.435	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	110.7	-172.9	-63.4	-177.3	-175.3	0	0	110.2	I94 G147 D148	E92-I94 PolarHBondContact O-N 3.34Å; E92-G147 CarbonylContact O-C 3.56Å; E92-G147 WeakPolarHBondContact O-CA 3.48Å; E92-D148 PolarHBondContact N-O 2.81Å; E92-D148 PolarHBondContact O-N 3.49Å
93	H	94.6	Very high	87.9	Confident	112 Å²	112	76.5 Å²	76.5	52%	0.519	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.4	35.3	173.8	-63.1	-71.3	0	0	0	114.2	S95 D110 V111 S112	H93-S95 PolarHBondContact O-N 3.45Å; H93-D110 VanDerWaalsContact CA-OD1 3.27Å; H93-D110 WeakPolarHBondContact CA-OD1 3.34Å; H93-D110 VanDerWaalsContact CB-OD1 3.22Å; H93-D110 WeakPolarHBondContact CB-OD1 2.95Å; H93-D110 IonicContact CE1-OD1 3.67Å; H93-D110 IonicContact CG-OD1 3.04Å; H93-D110 IonicContact ND1-OD1 3.9Å; H93-D110 PolarHBondContact ND1-OD1 3.2Å; H93-D110 IonicContact ND1-OD2 2.76Å; H93-V111 PolarHBondContact N-O 2.93Å; H93-S112 PolarHBondContact N-OG 3.04Å
94	I	94.6	Very high	88.4	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	121.4	-174	-70.3	-67.2	0	0	0	111.1	V91 E92 L108 D110 V111 I137 P144 K146 D148 V149	V91-I94 HydrophobicContact CB-CG1 4.4Å; V91-I94 HydrophobicContact CG1-CB 3.67Å; V91-I94 HydrophobicContact CG1-CG1 3.29Å; E92-I94 PolarHBondContact O-N 3.34Å; I94-L108 HydrophobicContact CG2-CD1 3.85Å; I94-D110 PolarHBondContact O-N 3.33Å; I94-D110 VanDerWaalsContact O-N 3.15Å; I94-V111 PolarHBondContact N-O 3.4Å; I94-V111 PolarHBondContact O-N 3.4Å; I94-I137 HydrophobicContact CD1-CG2 4.05Å; I94-I137 HydrophobicContact CG2-CD1 4.09Å; I94-I137 HydrophobicContact CG2-CG2 4.07Å; I94-P144 HydrophobicContact CD1-CB 3.54Å; I94-P144 HydrophobicContact CD1-CG 3.59Å; I94-P144 HydrophobicContact CG2-CB 4.25Å; I94-K146 WeakPolarHBondContact CA-O 3.09Å; I94-D148 WeakPolarHBondContact CD1-O 3.22Å; I94-V149 HydrophobicContact CD1-CG2 3.96Å; I94-V149 HydrophobicContact CG1-CG2 4.31Å
95	S	94.7	Very high	89.1	Confident	21 Å²	21	74.5 Å²	74.5	15%	0.147	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140	171.2	-57	0	0	0	0	110.3	H93 L108 D110 T145 K146	H93-S95 PolarHBondContact O-N 3.45Å; S95-L108 WeakPolarHBondContact CA-O 3.27Å; S95-D110 PolarHBondContact OG-N 2.93Å; S95-T145 WeakPolarHBondContact O-CA 3.49Å; S95-T145 VanDerWaalsContact O-CB 3.29Å; S95-T145 WeakPolarHBondContact O-CB 3.25Å; S95-T145 PolarHBondContact O-N 3.37Å; S95-K146 PolarHBondContact N-O 3Å; S95-K146 PolarHBondContact O-N 2.89Å
96	M	94.4	Very high	89.6	Confident	18 Å²	18	73.4 Å²	73.4	9%	0.089	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	121.5	-179.6	-174.3	58.8	177.6	0	0	111	Y98 A107 L108 T133 I137	M96-Y98 HydrophobicContact CE-CD1 3.98Å; M96-Y98 HydrophobicContact CE-CE1 3.47Å; M96-Y98 VanDerWaalsContact CE-CE1 3.47Å; M96-Y98 HydrophobicContact CE-CE2 4.2Å; M96-Y98 HydrophobicContact CG-CD2 4.35Å; M96-Y98 HydrophobicContact CG-CE2 3.84Å; M96-A107 PolarHBondContact O-N 2.89Å; M96-L108 HydrophobicContact CB-CB 4Å; M96-L108 HydrophobicContact CB-CD1 4.19Å; M96-L108 HydrophobicContact CB-CG 4.24Å; M96-L108 PolarHBondContact N-O 3.23Å; M96-L108 PolarHBondContact O-N 3.31Å; M96-L108 VanDerWaalsContact O-N 3.11Å; M96-T133 HydrophobicContact CB-CG2 4.07Å; M96-T133 HydrophobicContact CG-CG2 3.75Å; M96-I137 HydrophobicContact CB-CD1 3.78Å; M96-I137 HydrophobicContact CG-CD1 3.93Å; M96-I137 HydrophobicContact SD-CD1 4.3Å
97	C	92.9	Very high	89.9	Confident	38 Å²	38	70.2 Å²	70.2	26%	0.257	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.1	175.9	-160.8	0	0	0	0	110.4	M106 T145	C97-M106 HydrophobicContact CB-CE 4.33Å; C97-M106 HydrophobicContact CB-SD 3.84Å; C97-T145 PolarHBondContact N-OG1 3.18Å; C97-T145 VanDerWaalsContact N-OG1 3.09Å
98	Y	89.8	Confident	90	Very high	93 Å²	93	67.7 Å²	67.7	37%	0.365	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	135.4	174.7	-69.4	-81.2	0	0	0	111	M96 A104 K105 A107 T133	M96-Y98 HydrophobicContact CE-CD1 3.98Å; M96-Y98 HydrophobicContact CE-CE1 3.47Å; M96-Y98 VanDerWaalsContact CE-CE1 3.47Å; M96-Y98 HydrophobicContact CE-CE2 4.2Å; M96-Y98 HydrophobicContact CG-CD2 4.35Å; M96-Y98 HydrophobicContact CG-CE2 3.84Å; Y98-A104 CarbonylContact O-C 3.55Å; Y98-A104 WeakPolarHBondContact O-CA 2.78Å; Y98-K105 PolarHBondContact N-O 3.05Å; Y98-K105 PolarHBondContact O-N 3.08Å; Y98-A107 HydrophobicContact CD2-CB 3.61Å; Y98-A107 HydrophobicContact CE2-CB 3.58Å; Y98-T133 HydrophobicContact CE2-CG2 3.82Å; Y98-T133 WeakPolarHBondContact OH-CG2 3.28Å
99	G	86.3	Confident	90	Very high	57 Å²	57	70.6 Å²	70.6	59%	0.588	37%	0.371	S	S	*	.	S	Bend	trans	90.2	176.2	179.7	0	0	0	0	0	113.3
100	I	79.5	Confident	90	Very high	162 Å²	162	75.3 Å²	75.3	83%	0.831	40%	0.396	S	S	*	.	S	Bend	trans	-127.7	143.3	-175	-56.2	173.1	0	0	0	109.1
101	G	79.4	Confident	90	Very high	60 Å²	60	74.9 Å²	74.9	62%	0.619	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	68.3	-141.9	174.4	0	0	0	0	0	113.7	K103 A104	G101-K103 PolarHBondContact O-N 2.86Å; G101-A104 WeakPolarHBondContact O-CB 3.36Å; G101-A104 PolarHBondContact O-N 3.48Å
102	K	76.6	Confident	89.9	Confident	224 Å²	224	76.2 Å²	76.2	97%	0.974	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-63	-14.1	-175.6	-66.1	-173.4	178.5	-177.5	0	114.8
103	K	81.1	Confident	89.9	Confident	190 Å²	190	72 Å²	72	83%	0.826	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-98.1	3.1	177.9	-67.5	-176.1	178.1	-179.7	0	113.1	G101 K105	G101-K103 PolarHBondContact O-N 2.86Å; K103-K105 PolarHBondContact O-N 3.1Å
104	A	85	Confident	89.9	Confident	46 Å²	46	70.2 Å²	70.2	38%	0.38	38%	0.375	S	S	.	.			trans	-63.9	121.3	-179.7	0	0	0	0	0	110.4	Y98 G101	Y98-A104 CarbonylContact O-C 3.55Å; Y98-A104 WeakPolarHBondContact O-CA 2.78Å; G101-A104 WeakPolarHBondContact O-CB 3.36Å; G101-A104 PolarHBondContact O-N 3.48Å
105	K	88.8	Confident	89.9	Confident	159 Å²	159	70.4 Å²	70.4	69%	0.691	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.6	178.3	-173.7	178.9	179.9	-178	0	109.1	Y98 K103 A107	Y98-K105 PolarHBondContact N-O 3.05Å; Y98-K105 PolarHBondContact O-N 3.08Å; K103-K105 PolarHBondContact O-N 3.1Å; K105-A107 PolarHBondContact O-N 2.83Å
106	M	90.8	Very high	89.9	Confident	89 Å²	89	69.6 Å²	69.6	44%	0.438	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	114.6	174.1	-163.1	67.1	77.6	0	0	109.7	C97 L108 K109	C97-M106 HydrophobicContact CB-CE 4.33Å; C97-M106 HydrophobicContact CB-SD 3.84Å; M106-L108 WeakPolarHBondContact CG-O 3.46Å; M106-K109 HydrophobicContact CB-CG 4.4Å; M106-K109 HydrophobicContact CG-CD 4.19Å; M106-K109 HydrophobicContact CG-CG 3.33Å; M106-K109 HydrophobicContact SD-CG 4.44Å
107	A	93.6	Very high	89.9	Confident	17 Å²	17	70.5 Å²	70.5	14%	0.14	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-34.7	177.8	0	0	0	0	0	112.4	M96 Y98 K105 T133 G298	M96-A107 PolarHBondContact O-N 2.89Å; Y98-A107 HydrophobicContact CD2-CB 3.61Å; Y98-A107 HydrophobicContact CE2-CB 3.58Å; K105-A107 PolarHBondContact O-N 2.83Å; A107-T133 HydrophobicContact CB-CG2 4.19Å; A107-G298 WeakPolarHBondContact O-CA 3.39Å
108	L	95.6	Very high	89.8	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	143.1	173.8	-61.1	173.5	0	0	0	110.5	I94 S95 M96 M106 V111 T133 L134 I137 I295 G298	I94-L108 HydrophobicContact CG2-CD1 3.85Å; S95-L108 WeakPolarHBondContact CA-O 3.27Å; M96-L108 HydrophobicContact CB-CB 4Å; M96-L108 HydrophobicContact CB-CD1 4.19Å; M96-L108 HydrophobicContact CB-CG 4.24Å; M96-L108 PolarHBondContact N-O 3.23Å; M96-L108 PolarHBondContact O-N 3.31Å; M96-L108 VanDerWaalsContact O-N 3.11Å; M106-L108 WeakPolarHBondContact CG-O 3.46Å; L108-V111 HydrophobicContact CB-CG2 4.34Å; L108-V111 HydrophobicContact CD2-CG2 4.24Å; L108-T133 HydrophobicContact CD1-CG2 3.87Å; L108-T133 HydrophobicContact CG-CG2 4.09Å; L108-L134 HydrophobicContact CD1-CB 3.94Å; L108-L134 HydrophobicContact CD1-CD1 4.12Å; L108-L134 HydrophobicContact CD2-CB 4.12Å; L108-I137 HydrophobicContact CD1-CD1 3.77Å; L108-I295 HydrophobicContact CD2-CD1 3.73Å; L108-G298 CarbonylContact C-O 3.35Å; L108-G298 VanDerWaalsContact CA-O 3.27Å; L108-G298 WeakPolarHBondContact CA-O 3.48Å
109	K	94.1	Very high	89.9	Confident	88 Å²	88	67.2 Å²	67.2	38%	0.383	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	107	-178.1	-68	168.3	178	175.8	0	109.2	M106 V111 G298 E299	M106-K109 HydrophobicContact CB-CG 4.4Å; M106-K109 HydrophobicContact CG-CD 4.19Å; M106-K109 HydrophobicContact CG-CG 3.33Å; M106-K109 HydrophobicContact SD-CG 4.44Å; K109-V111 VanDerWaalsContact C-N 3.31Å; K109-V111 PolarHBondContact O-N 2.81Å; K109-G298 PolarHBondContact N-O 3.34Å; K109-E299 HydrophobicContact CB-CG 3.64Å; K109-E299 HydrophobicContact CD-CG 3.89Å; K109-E299 WeakPolarHBondContact CD-OE1 3.47Å; K109-E299 HydrophobicContact CG-CG 4.4Å; K109-E299 IonicContact NZ-OE1 2.75Å; K109-E299 PolarHBondContact NZ-OE1 3.41Å
110	D	93.6	Very high	90.4	Very high	100 Å²	100	64.5 Å²	64.5	54%	0.535	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.4	51.5	171.6	-161.9	33.9	0	0	0	113.8	H93 I94 S95	H93-D110 VanDerWaalsContact CA-OD1 3.27Å; H93-D110 WeakPolarHBondContact CA-OD1 3.34Å; H93-D110 VanDerWaalsContact CB-OD1 3.22Å; H93-D110 WeakPolarHBondContact CB-OD1 2.95Å; H93-D110 IonicContact CE1-OD1 3.67Å; H93-D110 IonicContact CG-OD1 3.04Å; H93-D110 IonicContact ND1-OD1 3.9Å; H93-D110 PolarHBondContact ND1-OD1 3.2Å; H93-D110 IonicContact ND1-OD2 2.76Å; I94-D110 PolarHBondContact O-N 3.33Å; I94-D110 VanDerWaalsContact O-N 3.15Å; S95-D110 PolarHBondContact OG-N 2.93Å
111	V	94.6	Very high	91.3	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.012	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.7	-178.9	177.2	0	0	0	0	109.2	V91 H93 I94 L108 K109 L134 G298 L300	V91-V111 HydrophobicContact CG1-CG1 4.36Å; V91-V111 WeakPolarHBondContact CG1-O 2.96Å; H93-V111 PolarHBondContact N-O 2.93Å; I94-V111 PolarHBondContact N-O 3.4Å; I94-V111 PolarHBondContact O-N 3.4Å; L108-V111 HydrophobicContact CB-CG2 4.34Å; L108-V111 HydrophobicContact CD2-CG2 4.24Å; K109-V111 VanDerWaalsContact C-N 3.31Å; K109-V111 PolarHBondContact O-N 2.81Å; V111-L134 HydrophobicContact CG1-CD1 4.05Å; V111-L134 HydrophobicContact CG1-CD2 4.14Å; V111-G298 VanDerWaalsContact CG2-O 3.27Å; V111-G298 WeakPolarHBondContact CG2-O 3.43Å; V111-L300 HydrophobicContact CG1-CB 4.07Å
112	S	94.5	Very high	92.2	Very high	32 Å²	32	54 Å²	54	22%	0.224	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	133.1	169.3	-58	0	0	0	0	110.6	Q80 V91 H93 L300	Q80-S112 PolarHBondContact NE2-O 2.59Å; V91-S112 CarbonylContact O-C 3.55Å; V91-S112 WeakPolarHBondContact O-CA 3.42Å; H93-S112 PolarHBondContact N-OG 3.04Å; S112-L300 WeakPolarHBondContact O-CD2 3.34Å
113	A	93.6	Very high	93.1	Very high	5 Å²	5	43.4 Å²	43.4	4%	0.041	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	145.8	178.7	0	0	0	0	0	111.5	S90 V91 F115 L300	S90-A113 CarbonylContact C-O 3.52Å; S90-A113 WeakPolarHBondContact CA-O 3.36Å; V91-A113 PolarHBondContact N-O 2.7Å; V91-A113 PolarHBondContact O-N 2.85Å; A113-F115 HydrophobicContact CB-CE2 4.01Å; A113-F115 HydrophobicContact CB-CZ 4.05Å; A113-L300 HydrophobicContact CB-CD2 4.05Å
114	E	94.2	Very high	93.9	Very high	74 Å²	74	34.4 Å²	34.4	35%	0.346	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	143.9	174.8	-64.6	179.3	171.2	0	0	110.9	V87 Y116	V87-E114 HydrophobicContact CG1-CB 4.16Å; V87-E114 HydrophobicContact CG1-CG 4.37Å; V87-E114 HydrophobicContact CG2-CB 4.28Å; V87-E114 HydrophobicContact CG2-CG 4.4Å; E114-Y116 HydrophobicContact CB-CE1 4.34Å; E114-Y116 HydrophobicContact CB-CE2 4.49Å; E114-Y116 PolarHBondContact OE2-OH 3.27Å
115	F	95.6	Very high	94.3	Very high	3 Å²	3	32.2 Å²	32.2	1%	0.013	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	116.8	179.6	-55	-86.5	0	0	0	109.1	D88 L89 V91 A113 T121 V123 M138 T274 V276	D88-F115 PolarHBondContact N-O 3.47Å; L89-F115 HydrophobicContact CB-CB 4.12Å; L89-F115 HydrophobicContact CB-CD2 4.18Å; L89-F115 HydrophobicContact CD2-CD2 4.18Å; L89-F115 HydrophobicContact CG-CD2 3.91Å; L89-F115 PolarHBondContact N-O 2.78Å; L89-F115 WeakPolarHBondContact O-CB 3.25Å; L89-F115 WeakPolarHBondContact O-CD2 3.45Å; L89-F115 PolarHBondContact O-N 2.75Å; V91-F115 HydrophobicContact CG2-CE2 4.01Å; A113-F115 HydrophobicContact CB-CE2 4.01Å; A113-F115 HydrophobicContact CB-CZ 4.05Å; F115-T121 HydrophobicContact CD1-CG2 3.72Å; F115-T121 HydrophobicContact CE1-CG2 3.65Å; F115-V123 HydrophobicContact CE1-CG2 4.43Å; F115-M138 HydrophobicContact CD2-CE 3.77Å; F115-M138 HydrophobicContact CE1-CE 4.13Å; F115-M138 HydrophobicContact CE2-CE 3.23Å; F115-M138 HydrophobicContact CE2-SD 4.1Å; F115-M138 HydrophobicContact CG-CE 4.44Å; F115-M138 HydrophobicContact CZ-CE 3.43Å; F115-M138 VanDerWaalsContact CZ-CE 3.43Å; F115-M138 HydrophobicContact CZ-SD 4.06Å; F115-T274 HydrophobicContact CB-CG2 4.24Å; F115-V276 HydrophobicContact CB-CG2 4.1Å; F115-V276 HydrophobicContact CD1-CB 4.31Å; F115-V276 HydrophobicContact CD1-CG1 3.98Å; F115-V276 HydrophobicContact CD1-CG2 3.37Å; F115-V276 HydrophobicContact CD2-CG2 4.47Å; F115-V276 HydrophobicContact CE1-CB 4.35Å; F115-V276 HydrophobicContact CE1-CG1 3.54Å; F115-V276 HydrophobicContact CE1-CG2 3.84Å; F115-V276 HydrophobicContact CG-CG2 3.73Å; F115-V276 HydrophobicContact CZ-CG1 4.17Å
116	Y	94.1	Very high	94.5	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.016	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	151.2	-168.4	-55.9	-76.7	0	0	0	113.3	L83 F85 P86 V87 E114 G118 E119 T274	L83-Y116 HydrophobicContact CB-CE1 4.34Å; L83-Y116 HydrophobicContact CB-CE2 4.23Å; L83-Y116 HydrophobicContact CD1-CD2 4.49Å; L83-Y116 HydrophobicContact CD1-CE2 4.4Å; L83-Y116 PolarHBondContact N-OH 2.93Å; F85-Y116 HydrophobicContact CB-CD1 3.74Å; F85-Y116 HydrophobicContact CB-CG 4.02Å; F85-Y116 WeakPolarHBondContact O-CD1 3.21Å; P86-Y116 WeakPolarHBondContact O-CA 3.34Å; V87-Y116 HydrophobicContact CG2-CD1 3.72Å; V87-Y116 HydrophobicContact CG2-CE1 3.52Å; E114-Y116 HydrophobicContact CB-CE1 4.34Å; E114-Y116 HydrophobicContact CB-CE2 4.49Å; E114-Y116 PolarHBondContact OE2-OH 3.27Å; Y116-G118 PolarHBondContact O-N 3.2Å; Y116-E119 WeakPolarHBondContact CB-OE2 3.44Å; Y116-E119 WeakPolarHBondContact CD2-OE2 3.3Å; Y116-E119 PolarHBondContact O-N 2.84Å; Y116-T274 WeakPolarHBondContact O-CG2 3.35Å; Y116-T274 PolarHBondContact O-OG1 3.36Å
117	A	93.2	Very high	94.5	Very high	38 Å²	38	28.3 Å²	28.3	31%	0.314	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	126.4	-178	0	0	0	0	0	112.5	P86 E119 T274	P86-A117 HydrophobicContact CB-CB 4.36Å; P86-A117 HydrophobicContact CG-CB 3.78Å; P86-A117 PolarHBondContact O-N 3.42Å; A117-E119 VanDerWaalsContact C-N 3.27Å; A117-E119 PolarHBondContact O-N 3.09Å; A117-T274 VanDerWaalsContact CA-OG1 3.22Å; A117-T274 WeakPolarHBondContact CA-OG1 3.36Å
118	G	91.4	Very high	94.3	Very high	34 Å²	34	31.3 Å²	31.3	35%	0.351	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	9.1	175.6	0	0	0	0	0	114.9	Y116 K270 T274	Y116-G118 PolarHBondContact O-N 3.2Å; G118-K270 VanDerWaalsContact O-CE 3.27Å; G118-K270 WeakPolarHBondContact O-CE 3.44Å; G118-K270 WeakPolarHBondContact O-CG 3.44Å; G118-T274 PolarHBondContact N-OG1 2.91Å
119	E	93.1	Very high	94.1	Very high	28 Å²	28	31.7 Å²	31.7	13%	0.131	21%	0.206	C	C	.	.			trans	-101.7	156.7	174	-66.6	-169.9	155.3	0	0	112.3	Y116 A117 V275 D290 R291	Y116-E119 WeakPolarHBondContact CB-OE2 3.44Å; Y116-E119 WeakPolarHBondContact CD2-OE2 3.3Å; Y116-E119 PolarHBondContact O-N 2.84Å; A117-E119 VanDerWaalsContact C-N 3.27Å; A117-E119 PolarHBondContact O-N 3.09Å; E119-V275 PolarHBondContact O-N 2.98Å; E119-D290 HydrophobicContact CB-CB 4.34Å; E119-D290 HydrophobicContact CG-CB 4.45Å; E119-R291 WeakPolarHBondContact OE2-CD 3.48Å
120	V	96.7	Very high	94.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.1	167.5	-178.4	0	0	0	0	108.3	I266 K270 V275 F277 L288 A289 D290 R291	V120-I266 HydrophobicContact CG1-CG2 4.4Å; V120-I266 HydrophobicContact CG2-CG2 4.35Å; V120-K270 HydrophobicContact CG2-CB 3.72Å; V120-K270 HydrophobicContact CG2-CD 3.58Å; V120-K270 HydrophobicContact CG2-CG 3.64Å; V120-V275 CarbonylContact C-O 3.49Å; V120-V275 VanDerWaalsContact CA-O 3.31Å; V120-V275 WeakPolarHBondContact CA-O 3.38Å; V120-V275 HydrophobicContact CB-CB 4.38Å; V120-V275 HydrophobicContact CG1-CB 4.23Å; V120-V275 HydrophobicContact CG1-CG1 4.25Å; V120-V275 HydrophobicContact CG2-CB 3.97Å; V120-V275 HydrophobicContact CG2-CG2 4.22Å; V120-F277 HydrophobicContact CG1-CD1 3.67Å; V120-F277 HydrophobicContact CG1-CE1 3.47Å; V120-F277 VanDerWaalsContact CG1-CE1 3.47Å; V120-L288 WeakPolarHBondContact CB-O 3.41Å; V120-L288 WeakPolarHBondContact CG1-O 3.14Å; V120-A289 HydrophobicContact CG1-CB 4.41Å; V120-A289 CarbonylContact O-C 3.59Å; V120-A289 WeakPolarHBondContact O-CA 3.2Å; V120-D290 PolarHBondContact N-OD2 3.49Å; V120-D290 PolarHBondContact O-N 3.22Å; V120-R291 PolarHBondContact O-N 2.84Å
121	T	97.3	Very high	94.2	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.3	174.3	-56.2	0	0	0	0	111.3	F115 V275 V276 F277 R291 A293	F115-T121 HydrophobicContact CD1-CG2 3.72Å; F115-T121 HydrophobicContact CE1-CG2 3.65Å; T121-V275 PolarHBondContact N-O 3.38Å; T121-V276 WeakPolarHBondContact O-CA 3.29Å; T121-F277 PolarHBondContact O-N 2.78Å; T121-R291 CarbonylContact C-O 3.52Å; T121-R291 VanDerWaalsContact CA-O 3.26Å; T121-R291 WeakPolarHBondContact CA-O 3.43Å; T121-R291 HydrophobicContact CG2-CB 4.25Å; T121-A293 HydrophobicContact CG2-CB 4.42Å
122	A	97.7	Very high	94.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	120.5	172.4	0	0	0	0	0	111.1	L124 F277 A285 A289 R291 I292 A293	A122-L124 PolarHBondContact O-N 3.05Å; A122-F277 CarbonylContact C-O 3.59Å; A122-F277 WeakPolarHBondContact CA-O 3.47Å; A122-F277 HydrophobicContact CB-CD1 4.49Å; A122-F277 HydrophobicContact CB-CE1 3.83Å; A122-F277 HydrophobicContact CB-CE2 3.88Å; A122-F277 HydrophobicContact CB-CZ 3.5Å; A122-F277 VanDerWaalsContact CB-CZ 3.5Å; A122-A285 HydrophobicContact CB-CB 3.77Å; A122-A289 HydrophobicContact CB-CB 3.57Å; A122-R291 PolarHBondContact N-O 3.09Å; A122-I292 HydrophobicContact CB-CG1 4.3Å; A122-I292 CarbonylContact O-C 3.57Å; A122-I292 WeakPolarHBondContact O-CA 3.32Å; A122-A293 PolarHBondContact O-N 3.25Å
123	V	97.4	Very high	94.2	Very high	2 Å²	2	26 Å²	26	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	98.6	165.4	-175.9	0	0	0	0	108	F115 K131 L134 L135 V276 F277 S278 T279 A293 I295	F115-V123 HydrophobicContact CE1-CG2 4.43Å; V123-K131 HydrophobicContact CG1-CB 4.47Å; V123-K131 HydrophobicContact CG1-CG 4.21Å; V123-K131 WeakPolarHBondContact O-CD 3.27Å; V123-L134 HydrophobicContact CG1-CD2 4.29Å; V123-L135 HydrophobicContact CG2-CD2 4.2Å; V123-V276 HydrophobicContact CG2-CG1 3.92Å; V123-F277 PolarHBondContact N-O 3.37Å; V123-S278 WeakPolarHBondContact O-CA 3.4Å; V123-T279 PolarHBondContact O-N 2.84Å; V123-A293 CarbonylContact C-O 3.54Å; V123-A293 WeakPolarHBondContact CA-O 3.32Å; V123-I295 HydrophobicContact CG1-CG2 3.93Å
124	L	96	Very high	94.3	Very high	0 Å²	0	26 Å²	26	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.2	-173.9	-179.4	65.6	0	0	0	111.3	A122 T279 L282 A285 I292 A293 I294 I295 L398 M402	A122-L124 PolarHBondContact O-N 3.05Å; L124-T279 WeakPolarHBondContact CA-O 3.16Å; L124-T279 HydrophobicContact CD1-CG2 3.95Å; L124-L282 HydrophobicContact CD2-CD1 4.34Å; L124-A285 HydrophobicContact CD1-CB 4.28Å; L124-A285 HydrophobicContact CD2-CB 4.42Å; L124-I292 HydrophobicContact CB-CG2 3.88Å; L124-I292 HydrophobicContact CD2-CG2 4.07Å; L124-A293 PolarHBondContact N-O 2.82Å; L124-I294 HydrophobicContact CD2-CG1 4.42Å; L124-I294 CarbonylContact O-C 3.54Å; L124-I294 WeakPolarHBondContact O-CA 3.4Å; L124-I295 PolarHBondContact O-N 3.43Å; L124-L398 HydrophobicContact CD2-CD2 4.31Å; L124-M402 HydrophobicContact CD2-SD 4.22Å; L124-M402 HydrophobicContact CG-SD 4.39Å
125	G	94.3	Very high	94.4	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.01	17%	0.165	C	C	.	.			trans	175.6	166.1	174.3	0	0	0	0	0	113.8	K131 T279	G125-K131 PolarHBondContact O-NZ 3.27Å; G125-T279 PolarHBondContact N-O 3.16Å
126	A	92.5	Very high	94.3	Very high	58 Å²	58	22.7 Å²	22.7	48%	0.479	17%	0.167	S	C	.	.			trans	-66.4	167.4	178	0	0	0	0	0	112.9	G128 S129 K131	A126-G128 PolarHBondContact O-N 3.16Å; A126-S129 WeakPolarHBondContact O-CB 3.39Å; A126-S129 PolarHBondContact O-N 2.8Å; A126-S129 PolarHBondContact O-OG 2.94Å; A126-K131 PolarHBondContact O-NZ 2.87Å; A126-K131 VanDerWaalsContact O-NZ 3.1Å
127	N	90.8	Very high	94.3	Very high	107 Å²	107	22.7 Å²	22.7	57%	0.572	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	133.7	172.1	-71	-32.7	0	0	0	110.9	S129 Q280	N127-S129 VanDerWaalsContact C-N 3.33Å; N127-Q280 VanDerWaalsContact CG-OE1 3.25Å; N127-Q280 PolarHBondContact ND2-OE1 3.04Å; N127-Q280 PolarHBondContact OD1-OE1 3.45Å; N127-Q280 VanDerWaalsContact OD1-OE1 3.13Å
128	G	89.7	Confident	94.3	Very high	81 Å²	81	20.9 Å²	20.9	84%	0.835	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.8	8.3	-176.9	0	0	0	0	0	115.3	A126 G130	A126-G128 PolarHBondContact O-N 3.16Å; G128-G130 VanDerWaalsContact C-N 3.25Å; G128-G130 PolarHBondContact O-N 2.73Å
129	S	92.7	Very high	94.3	Very high	7 Å²	7	19.6 Å²	19.6	5%	0.049	14%	0.138	C	C	.	.	S	Bend	trans	-73.3	-12.8	175.8	65.2	0	0	0	0	114.7	A126 N127 K131 I295 G298	A126-S129 WeakPolarHBondContact O-CB 3.39Å; A126-S129 PolarHBondContact O-N 2.8Å; A126-S129 PolarHBondContact O-OG 2.94Å; N127-S129 VanDerWaalsContact C-N 3.33Å; S129-K131 WeakPolarHBondContact OG-CG 3.43Å; S129-I295 WeakPolarHBondContact CB-O 3.18Å; S129-G298 VanDerWaalsContact O-CA 3.32Å; S129-G298 WeakPolarHBondContact O-CA 3.25Å; S129-G298 PolarHBondContact O-N 3.45Å
130	G	93.2	Very high	94.2	Very high	9 Å²	9	19.3 Å²	19.3	9%	0.093	14%	0.142	C	C	.	.	S	Bend	trans	111.9	-2	-179.7	0	0	0	0	0	115.4	G128 T132 T133 L134	G128-G130 VanDerWaalsContact C-N 3.25Å; G128-G130 PolarHBondContact O-N 2.73Å; G130-T132 PolarHBondContact O-N 3.22Å; G130-T133 WeakPolarHBondContact O-CB 3.27Å; G130-T133 PolarHBondContact O-N 3.23Å; G130-T133 VanDerWaalsContact O-N 3.14Å; G130-L134 PolarHBondContact O-N 2.97Å
131	K	95.6	Very high	93.8	Very high	8 Å²	8	23.6 Å²	23.6	4%	0.035	17%	0.165	C	C	.	.	H	α-helix	trans	-48.5	-59.6	-177	-55.2	-170.6	-58.1	-80.9	0	114.1	V123 G125 A126 S129 T133 L134 L135 E249 T279 I295	V123-K131 HydrophobicContact CG1-CB 4.47Å; V123-K131 HydrophobicContact CG1-CG 4.21Å; V123-K131 WeakPolarHBondContact O-CD 3.27Å; G125-K131 PolarHBondContact O-NZ 3.27Å; A126-K131 PolarHBondContact O-NZ 2.87Å; A126-K131 VanDerWaalsContact O-NZ 3.1Å; S129-K131 WeakPolarHBondContact OG-CG 3.43Å; K131-T133 VanDerWaalsContact C-N 3.29Å; K131-T133 PolarHBondContact O-N 2.95Å; K131-L134 WeakPolarHBondContact O-CB 3.21Å; K131-L134 PolarHBondContact O-N 3.14Å; K131-L134 VanDerWaalsContact O-N 3.12Å; K131-L135 WeakPolarHBondContact O-CG 3.13Å; K131-L135 PolarHBondContact O-N 3.05Å; K131-E249 WeakPolarHBondContact CE-OE1 3.37Å; K131-E249 IonicContact NZ-OE1 2.7Å; K131-E249 PolarHBondContact NZ-OE1 3.15Å; K131-T279 WeakPolarHBondContact CD-O 3.46Å; K131-T279 WeakPolarHBondContact CE-O 3.4Å; K131-I295 HydrophobicContact CD-CG2 4.5Å; K131-I295 HydrophobicContact CG-CG2 3.64Å
132	T	94.8	Very high	93.2	Very high	62 Å²	62	28.3 Å²	28.3	38%	0.38	19%	0.185	S	C	.	.	H	α-helix	trans	-60.9	-37.8	-179	-57.4	0	0	0	0	111.9	G130 S136 D248	G130-T132 PolarHBondContact O-N 3.22Å; T132-S136 VanDerWaalsContact O-CB 3.31Å; T132-S136 WeakPolarHBondContact O-CB 3.47Å; T132-S136 PolarHBondContact O-N 2.82Å; T132-S136 PolarHBondContact O-OG 3.26Å; T132-D248 WeakPolarHBondContact CG2-OD2 3.05Å; T132-D248 PolarHBondContact OG1-OD1 3.22Å; T132-D248 PolarHBondContact OG1-OD2 2.81Å
133	T	94.9	Very high	92.8	Very high	24 Å²	24	33.5 Å²	33.5	15%	0.147	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-45.6	174.5	-61.6	0	0	0	0	111.2	M96 Y98 A107 L108 G130 K131 S136 I137	M96-T133 HydrophobicContact CB-CG2 4.07Å; M96-T133 HydrophobicContact CG-CG2 3.75Å; Y98-T133 HydrophobicContact CE2-CG2 3.82Å; Y98-T133 WeakPolarHBondContact OH-CG2 3.28Å; A107-T133 HydrophobicContact CB-CG2 4.19Å; L108-T133 HydrophobicContact CD1-CG2 3.87Å; L108-T133 HydrophobicContact CG-CG2 4.09Å; G130-T133 WeakPolarHBondContact O-CB 3.27Å; G130-T133 PolarHBondContact O-N 3.23Å; G130-T133 VanDerWaalsContact O-N 3.14Å; K131-T133 VanDerWaalsContact C-N 3.29Å; K131-T133 PolarHBondContact O-N 2.95Å; T133-S136 PolarHBondContact O-N 3.06Å; T133-I137 HydrophobicContact CG2-CD1 3.93Å; T133-I137 WeakPolarHBondContact O-CG1 3.11Å; T133-I137 PolarHBondContact O-N 3.46Å
134	L	96.1	Very high	92.6	Very high	5 Å²	5	35.2 Å²	35.2	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-50.7	177.6	178	61.8	0	0	0	110.9	V91 L108 V111 V123 G130 K131 S136 I137 M138 I295	V91-L134 HydrophobicContact CG1-CD1 3.86Å; V91-L134 HydrophobicContact CG2-CD1 4.47Å; L108-L134 HydrophobicContact CD1-CB 3.94Å; L108-L134 HydrophobicContact CD1-CD1 4.12Å; L108-L134 HydrophobicContact CD2-CB 4.12Å; V111-L134 HydrophobicContact CG1-CD1 4.05Å; V111-L134 HydrophobicContact CG1-CD2 4.14Å; V123-L134 HydrophobicContact CG1-CD2 4.29Å; G130-L134 PolarHBondContact O-N 2.97Å; K131-L134 WeakPolarHBondContact O-CB 3.21Å; K131-L134 PolarHBondContact O-N 3.14Å; K131-L134 VanDerWaalsContact O-N 3.12Å; L134-S136 VanDerWaalsContact C-N 3.3Å; L134-S136 PolarHBondContact O-N 3.26Å; L134-I137 PolarHBondContact O-N 2.93Å; L134-M138 HydrophobicContact CD1-CG 4.43Å; L134-M138 HydrophobicContact CD1-SD 4.31Å; L134-M138 HydrophobicContact CG-SD 3.92Å; L134-M138 VanDerWaalsContact O-CG 3.27Å; L134-M138 WeakPolarHBondContact O-CG 3.27Å; L134-M138 PolarHBondContact O-N 3.5Å; L134-I295 HydrophobicContact CD2-CD1 4.24Å
135	L	96.3	Very high	92.4	Very high	0 Å²	0	39 Å²	39	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.3	-38.7	178.2	-64.6	-162.2	0	0	0	112.3	V123 K131 I137 M138 C139 V246 D248 V276	V123-L135 HydrophobicContact CG2-CD2 4.2Å; K131-L135 WeakPolarHBondContact O-CG 3.13Å; K131-L135 PolarHBondContact O-N 3.05Å; L135-I137 VanDerWaalsContact C-N 3.34Å; L135-I137 PolarHBondContact O-N 2.68Å; L135-M138 HydrophobicContact CD2-CE 4.4Å; L135-M138 HydrophobicContact CD2-SD 3.69Å; L135-M138 WeakPolarHBondContact O-CB 3.4Å; L135-M138 PolarHBondContact O-N 3.45Å; L135-C139 PolarHBondContact O-N 2.91Å; L135-C139 PolarHBondContact O-SG 3.37Å; L135-V246 HydrophobicContact CB-CG1 3.79Å; L135-V246 HydrophobicContact CD1-CG1 3.73Å; L135-V246 HydrophobicContact CD2-CG1 3.81Å; L135-V246 HydrophobicContact CG-CG1 3.96Å; L135-D248 HydrophobicContact CD1-CB 4.22Å; L135-V276 HydrophobicContact CD2-CG1 3.98Å
136	S	93.4	Very high	92.4	Very high	8 Å²	8	46 Å²	46	6%	0.056	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-38.9	177.9	-58.2	0	0	0	0	112.3	T132 T133 L134 C139 G140 L141	T132-S136 VanDerWaalsContact O-CB 3.31Å; T132-S136 WeakPolarHBondContact O-CB 3.47Å; T132-S136 PolarHBondContact O-N 2.82Å; T132-S136 PolarHBondContact O-OG 3.26Å; T133-S136 PolarHBondContact O-N 3.06Å; L134-S136 VanDerWaalsContact C-N 3.3Å; L134-S136 PolarHBondContact O-N 3.26Å; S136-C139 PolarHBondContact O-N 2.87Å; S136-G140 PolarHBondContact O-N 2.86Å; S136-L141 WeakPolarHBondContact O-CB 3.31Å; S136-L141 PolarHBondContact O-N 2.69Å
137	I	93.8	Very high	92.4	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.015	28%	0.28	C	S	.	.	H	α-helix	trans	-67.6	-43.4	174.3	-71.6	164.4	0	0	0	110.4	I94 M96 L108 T133 L134 L135 C139 G140 P144 V149	I94-I137 HydrophobicContact CD1-CG2 4.05Å; I94-I137 HydrophobicContact CG2-CD1 4.09Å; I94-I137 HydrophobicContact CG2-CG2 4.07Å; M96-I137 HydrophobicContact CB-CD1 3.78Å; M96-I137 HydrophobicContact CG-CD1 3.93Å; M96-I137 HydrophobicContact SD-CD1 4.3Å; L108-I137 HydrophobicContact CD1-CD1 3.77Å; T133-I137 HydrophobicContact CG2-CD1 3.93Å; T133-I137 WeakPolarHBondContact O-CG1 3.11Å; T133-I137 PolarHBondContact O-N 3.46Å; L134-I137 PolarHBondContact O-N 2.93Å; L135-I137 VanDerWaalsContact C-N 3.34Å; L135-I137 PolarHBondContact O-N 2.68Å; I137-C139 PolarHBondContact O-N 3.15Å; I137-G140 PolarHBondContact O-N 2.96Å; I137-P144 HydrophobicContact CD1-CB 4.49Å; I137-P144 HydrophobicContact CG2-CB 4.02Å; I137-P144 HydrophobicContact CG2-CG 4.34Å; I137-V149 HydrophobicContact CG2-CG2 3.85Å
138	M	93.3	Very high	92.5	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-57	-31.5	174.3	-70.4	168.5	68.6	0	0	112.4	L89 V91 F115 L134 L135 I156 V276	L89-M138 HydrophobicContact CD2-CB 4.46Å; L89-M138 HydrophobicContact CD2-CE 3.23Å; L89-M138 HydrophobicContact CG-CE 4.05Å; V91-M138 HydrophobicContact CG2-CE 4.31Å; V91-M138 HydrophobicContact CG2-CG 3.46Å; V91-M138 VanDerWaalsContact CG2-CG 3.46Å; V91-M138 HydrophobicContact CG2-SD 3.96Å; F115-M138 HydrophobicContact CD2-CE 3.77Å; F115-M138 HydrophobicContact CE1-CE 4.13Å; F115-M138 HydrophobicContact CE2-CE 3.23Å; F115-M138 HydrophobicContact CE2-SD 4.1Å; F115-M138 HydrophobicContact CG-CE 4.44Å; F115-M138 HydrophobicContact CZ-CE 3.43Å; F115-M138 VanDerWaalsContact CZ-CE 3.43Å; F115-M138 HydrophobicContact CZ-SD 4.06Å; L134-M138 HydrophobicContact CD1-CG 4.43Å; L134-M138 HydrophobicContact CD1-SD 4.31Å; L134-M138 HydrophobicContact CG-SD 3.92Å; L134-M138 VanDerWaalsContact O-CG 3.27Å; L134-M138 WeakPolarHBondContact O-CG 3.27Å; L134-M138 PolarHBondContact O-N 3.5Å; L135-M138 HydrophobicContact CD2-CE 4.4Å; L135-M138 HydrophobicContact CD2-SD 3.69Å; L135-M138 WeakPolarHBondContact O-CB 3.4Å; L135-M138 PolarHBondContact O-N 3.45Å; M138-I156 WeakPolarHBondContact O-CD1 3.45Å; M138-V276 HydrophobicContact CE-CB 4.42Å; M138-V276 HydrophobicContact CE-CG1 4.03Å; M138-V276 HydrophobicContact CE-CG2 4.18Å
139	C	91.4	Very high	92.8	Very high	7 Å²	7	38.5 Å²	38.5	5%	0.047	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	2.6	176.8	-62.4	0	0	0	0	115.3	L135 S136 I137 L141 L167 Y169 V246	L135-C139 PolarHBondContact O-N 2.91Å; L135-C139 PolarHBondContact O-SG 3.37Å; S136-C139 PolarHBondContact O-N 2.87Å; I137-C139 PolarHBondContact O-N 3.15Å; C139-L141 HydrophobicContact CB-CD1 4.44Å; C139-L141 HydrophobicContact CB-CG 4.09Å; C139-L141 PolarHBondContact O-N 2.72Å; C139-L167 VanDerWaalsContact CA-CD2 3.47Å; C139-L167 HydrophobicContact CB-CD2 3.9Å; C139-Y169 HydrophobicContact CB-CD2 4.32Å; C139-Y169 HydrophobicContact CB-CG 4.27Å; C139-Y169 WeakPolarHBondContact SG-CD2 3.11Å; C139-V246 VanDerWaalsContact SG-CB 3.59Å
140	G	89.6	Confident	92.8	Very high	21 Å²	21	39.4 Å²	39.4	22%	0.216	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	14.2	-177.4	0	0	0	0	0	114.2	S136 I137 F142	S136-G140 PolarHBondContact O-N 2.86Å; I137-G140 PolarHBondContact O-N 2.96Å; G140-F142 VanDerWaalsContact C-N 3.3Å; G140-F142 PolarHBondContact O-N 2.86Å
141	L	88.2	Confident	92.9	Very high	90 Å²	90	39.1 Å²	39.1	47%	0.471	23%	0.227	S	C	.	.	S	Bend	trans	-69.4	-31.7	178.7	-62.3	178.3	0	0	0	111.9	S136 C139 Y169	S136-L141 WeakPolarHBondContact O-CB 3.31Å; S136-L141 PolarHBondContact O-N 2.69Å; C139-L141 HydrophobicContact CB-CD1 4.44Å; C139-L141 HydrophobicContact CB-CG 4.09Å; C139-L141 PolarHBondContact O-N 2.72Å; L141-Y169 HydrophobicContact CD1-CD1 3.84Å; L141-Y169 HydrophobicContact CD1-CE1 3.5Å
142	F	85.7	Confident	92.7	Very high	101 Å²	101	41.2 Å²	41.2	44%	0.443	24%	0.238	S	C	.	.	S	Bend	trans	-136.4	136.6	173.2	-56.5	-73.8	0	0	0	109.4	G140	G140-F142 VanDerWaalsContact C-N 3.3Å; G140-F142 PolarHBondContact O-N 2.86Å
143	P	89.3	Confident	92.5	Very high	108 Å²	108	41.5 Å²	41.5	70%	0.701	25%	0.254	S	S	*	.			trans	-67.9	142.2	171.1	29.5	-33.6	0	0	0	109.8
144	P	92.3	Very high	92.3	Very high	38 Å²	38	44.1 Å²	44.1	25%	0.247	26%	0.264	C	S	.	.			trans	-69.5	159.1	173	32	-35.9	0	0	0	111.2	I94 I137 K146	I94-P144 HydrophobicContact CD1-CB 3.54Å; I94-P144 HydrophobicContact CD1-CG 3.59Å; I94-P144 HydrophobicContact CG2-CB 4.25Å; I137-P144 HydrophobicContact CD1-CB 4.49Å; I137-P144 HydrophobicContact CG2-CB 4.02Å; I137-P144 HydrophobicContact CG2-CG 4.34Å; P144-K146 WeakPolarHBondContact CB-O 3.34Å
145	T	92.4	Very high	92.1	Very high	80 Å²	80	45 Å²	45	49%	0.491	27%	0.271	S	S	.	.	S	Bend	trans	-71.7	-34.4	171.5	-51.8	0	0	0	0	111.3	S95 C97	S95-T145 WeakPolarHBondContact O-CA 3.49Å; S95-T145 VanDerWaalsContact O-CB 3.29Å; S95-T145 WeakPolarHBondContact O-CB 3.25Å; S95-T145 PolarHBondContact O-N 3.37Å; C97-T145 PolarHBondContact N-OG1 3.18Å; C97-T145 VanDerWaalsContact N-OG1 3.09Å
146	K	93.9	Very high	91.7	Very high	148 Å²	148	45.6 Å²	45.6	64%	0.643	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.7	158.2	173.2	-62.6	-175.3	176.1	-176.9	0	109.8	I94 S95 P144	I94-K146 WeakPolarHBondContact CA-O 3.09Å; S95-K146 PolarHBondContact N-O 3Å; S95-K146 PolarHBondContact O-N 2.89Å; P144-K146 WeakPolarHBondContact CB-O 3.34Å
147	G	93.4	Very high	91.2	Very high	39 Å²	39	50 Å²	50	40%	0.402	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	89.9	-178	-179	0	0	0	0	0	112.2	E92	E92-G147 CarbonylContact O-C 3.56Å; E92-G147 WeakPolarHBondContact O-CA 3.48Å
148	D	93.6	Very high	90.8	Very high	46 Å²	46	53.9 Å²	53.9	25%	0.246	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	162.2	-179.5	-159.7	10.8	0	0	0	111.4	E92 I94 S155	E92-D148 PolarHBondContact N-O 2.81Å; E92-D148 PolarHBondContact O-N 3.49Å; I94-D148 WeakPolarHBondContact CD1-O 3.22Å; D148-S155 PolarHBondContact OD1-OG 3.46Å; D148-S155 WeakPolarHBondContact OD2-CB 3.43Å; D148-S155 PolarHBondContact OD2-OG 3.08Å
149	V	94.4	Very high	90.3	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.024	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.4	172.7	-176.8	0	0	0	0	107.6	L89 S90 V91 I94 I137 I156	L89-V149 HydrophobicContact CD1-CG1 3.54Å; S90-V149 WeakPolarHBondContact O-CA 3.48Å; S90-V149 WeakPolarHBondContact O-CG1 3.29Å; V91-V149 HydrophobicContact CG2-CG1 4.49Å; I94-V149 HydrophobicContact CD1-CG2 3.96Å; I94-V149 HydrophobicContact CG1-CG2 4.31Å; I137-V149 HydrophobicContact CG2-CG2 3.85Å; V149-I156 HydrophobicContact CB-CB 4.41Å; V149-I156 HydrophobicContact CB-CD1 3.69Å; V149-I156 HydrophobicContact CB-CG1 4.07Å; V149-I156 HydrophobicContact CG1-CD1 3.32Å; V149-I156 HydrophobicContact CG1-CG1 4.01Å; V149-I156 WeakPolarHBondContact O-CG1 3.46Å; V149-I156 PolarHBondContact O-N 2.8Å
150	V	94	Very high	89.8	Confident	25 Å²	25	61 Å²	61	15%	0.152	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.7	-179.5	-178	0	0	0	0	108.7	L89 S90 G153 E154	L89-V150 CarbonylContact C-O 3.37Å; L89-V150 WeakPolarHBondContact CA-O 3.32Å; S90-V150 PolarHBondContact N-O 3.21Å; S90-V150 PolarHBondContact O-N 2.98Å; S90-V150 WeakPolarHBondContact OG-CB 3.09Å; V150-G153 VanDerWaalsContact CG1-C 3.45Å; V150-E154 CarbonylContact C-O 3.59Å; V150-E154 WeakPolarHBondContact CA-O 3.47Å
151	L	94	Very high	89.5	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.016	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.6	176.5	-179	72.8	0	0	0	108.6	D88 L89 G153 E154 I156 I163 L167 V244	D88-L151 WeakPolarHBondContact O-CD1 3.44Å; L89-L151 HydrophobicContact CB-CD1 3.98Å; L89-L151 HydrophobicContact CD1-CB 4.19Å; L89-L151 HydrophobicContact CD1-CD1 3.88Å; L89-L151 HydrophobicContact CG-CD1 4.39Å; L151-G153 PolarHBondContact O-N 3.35Å; L151-E154 PolarHBondContact N-O 3.45Å; L151-E154 PolarHBondContact O-N 2.67Å; L151-I156 HydrophobicContact CB-CG1 4.28Å; L151-I163 HydrophobicContact CB-CG2 3.57Å; L151-I163 HydrophobicContact CD2-CG2 3.32Å; L151-I163 WeakPolarHBondContact CD2-O 3.39Å; L151-I163 HydrophobicContact CG-CG2 3.91Å; L151-L167 HydrophobicContact CD1-CD1 4.22Å; L151-L167 HydrophobicContact CD2-CB 3.98Å; L151-L167 HydrophobicContact CD2-CD1 4.26Å; L151-V244 HydrophobicContact CD1-CB 3.94Å; L151-V244 HydrophobicContact CD1-CG1 4.35Å; L151-V244 HydrophobicContact CD1-CG2 3.59Å
152	L	91.8	Very high	89.3	Confident	53 Å²	53	70.3 Å²	70.3	28%	0.277	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	35.5	179.3	-55.9	166.4	0	0	0	113.2	D88 E154 F166 K243	D88-L152 HydrophobicContact CB-CD2 4.23Å; D88-L152 PolarHBondContact O-N 3.42Å; D88-L152 WeakPolarHBondContact OD1-CD2 3.15Å; L152-E154 VanDerWaalsContact C-N 3.31Å; L152-E154 PolarHBondContact O-N 2.85Å; L152-F166 HydrophobicContact CD1-CB 3.78Å; L152-F166 HydrophobicContact CD1-CD1 4.46Å; L152-F166 HydrophobicContact CD1-CD2 4.25Å; L152-F166 HydrophobicContact CD1-CG 3.91Å; L152-K243 HydrophobicContact CD1-CB 4.5Å; L152-K243 HydrophobicContact CD1-CD 3.77Å; L152-K243 HydrophobicContact CD2-CD 4.04Å
153	G	90.2	Very high	89.2	Confident	68 Å²	68	65.8 Å²	65.8	70%	0.701	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-1.4	-177.7	0	0	0	0	0	115.3	V150 L151	V150-G153 VanDerWaalsContact CG1-C 3.45Å; L151-G153 PolarHBondContact O-N 3.35Å
154	E	91.4	Very high	88.9	Confident	78 Å²	78	62.7 Å²	62.7	36%	0.364	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132.3	176.9	-64.8	-179.1	-165.7	0	0	111.4	V150 L151 L152 I156 H162 I163	V150-E154 CarbonylContact C-O 3.59Å; V150-E154 WeakPolarHBondContact CA-O 3.47Å; L151-E154 PolarHBondContact N-O 3.45Å; L151-E154 PolarHBondContact O-N 2.67Å; L152-E154 VanDerWaalsContact C-N 3.31Å; L152-E154 PolarHBondContact O-N 2.85Å; E154-I156 PolarHBondContact O-N 2.81Å; E154-H162 IonicContact OE1-CE1 2.67Å; E154-H162 IonicContact OE1-ND1 2.81Å; E154-H162 IonicContact OE2-CE1 3.87Å; E154-H162 IonicContact OE2-ND1 3.68Å; E154-H162 PolarHBondContact OE2-ND1 2.86Å; E154-I163 HydrophobicContact CB-CD1 3.69Å; E154-I163 HydrophobicContact CB-CG1 4.1Å
155	S	91.5	Very high	88.7	Confident	24 Å²	24	63 Å²	63	17%	0.168	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	128.2	172.9	168.7	0	0	0	0	110.9	D148 S157 S158 I163	D148-S155 PolarHBondContact OD1-OG 3.46Å; D148-S155 WeakPolarHBondContact OD2-CB 3.43Å; D148-S155 PolarHBondContact OD2-OG 3.08Å; S155-S157 PolarHBondContact O-N 2.87Å; S155-S157 VanDerWaalsContact O-N 3.15Å; S155-S157 PolarHBondContact OG-N 2.86Å; S155-S157 PolarHBondContact OG-OG 3.27Å; S155-S158 WeakPolarHBondContact O-CB 3.19Å; S155-S158 PolarHBondContact O-N 2.84Å; S155-S158 PolarHBondContact O-OG 3.25Å; S155-I163 WeakPolarHBondContact O-CD1 3.42Å
156	I	87.3	Confident	88.6	Confident	13 Å²	13	62.2 Å²	62.2	7%	0.067	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-33.7	177.1	-67.1	-172.4	0	0	0	111.2	M138 V149 L151 E154 S158 I160 I163	M138-I156 WeakPolarHBondContact O-CD1 3.45Å; V149-I156 HydrophobicContact CB-CB 4.41Å; V149-I156 HydrophobicContact CB-CD1 3.69Å; V149-I156 HydrophobicContact CB-CG1 4.07Å; V149-I156 HydrophobicContact CG1-CD1 3.32Å; V149-I156 HydrophobicContact CG1-CG1 4.01Å; V149-I156 WeakPolarHBondContact O-CG1 3.46Å; V149-I156 PolarHBondContact O-N 2.8Å; L151-I156 HydrophobicContact CB-CG1 4.28Å; E154-I156 PolarHBondContact O-N 2.81Å; I156-S158 PolarHBondContact O-N 2.8Å; I156-I160 HydrophobicContact CG2-CD1 4.49Å; I156-I160 HydrophobicContact CG2-CG1 4.3Å; I156-I160 PolarHBondContact O-N 2.92Å; I156-I163 HydrophobicContact CG1-CG2 3.98Å
157	S	84.1	Confident	88.6	Confident	100 Å²	100	55.9 Å²	55.9	70%	0.699	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.5	-180	73.4	0	0	0	0	113.6	S155	S155-S157 PolarHBondContact O-N 2.87Å; S155-S157 VanDerWaalsContact O-N 3.15Å; S155-S157 PolarHBondContact OG-N 2.86Å; S155-S157 PolarHBondContact OG-OG 3.27Å
158	S	85	Confident	88.6	Confident	85 Å²	85	54.1 Å²	54.1	59%	0.594	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-43.5	-175.6	71.2	0	0	0	0	113.4	S155 I156	S155-S158 WeakPolarHBondContact O-CB 3.19Å; S155-S158 PolarHBondContact O-N 2.84Å; S155-S158 PolarHBondContact O-OG 3.25Å; I156-S158 PolarHBondContact O-N 2.8Å
159	N	81.9	Confident	88.7	Confident	76 Å²	76	54.8 Å²	54.8	41%	0.406	31%	0.306	S	S	.	.			trans	-150.7	67.8	-177.9	-166.3	-12.7	0	0	0	112.1	R161 H162 I163	N159-R161 PolarHBondContact O-N 2.77Å; N159-R161 VanDerWaalsContact O-N 3.08Å; N159-H162 HydrophobicContact CB-CB 4.19Å; N159-H162 WeakPolarHBondContact ND2-CB 3.14Å; N159-H162 PolarHBondContact O-N 3.29Å; N159-H162 VanDerWaalsContact O-N 3.12Å; N159-H162 WeakPolarHBondContact OD1-CB 3.1Å; N159-H162 PolarHBondContact OD1-N 2.87Å; N159-I163 HydrophobicContact CB-CD1 4.47Å; N159-I163 WeakPolarHBondContact O-CB 3.43Å; N159-I163 VanDerWaalsContact O-CG1 3.29Å; N159-I163 WeakPolarHBondContact O-CG1 3.28Å; N159-I163 PolarHBondContact O-N 2.8Å
160	I	82.9	Confident	88.8	Confident	82 Å²	82	54.6 Å²	54.6	42%	0.421	30%	0.304	S	S	.	.	H	α-helix	trans	-51.5	-37	-178	-164	163.5	0	0	0	113.3	I156 C164	I156-I160 HydrophobicContact CG2-CD1 4.49Å; I156-I160 HydrophobicContact CG2-CG1 4.3Å; I156-I160 PolarHBondContact O-N 2.92Å; I160-C164 VanDerWaalsContact CG1-SG 3.6Å; I160-C164 WeakPolarHBondContact O-CB 3.21Å; I160-C164 PolarHBondContact O-N 2.9Å; I160-C164 PolarHBondContact O-SG 2.78Å
161	R	82.2	Confident	88.8	Confident	226 Å²	226	55.2 Å²	55.2	85%	0.853	31%	0.309	S	S	*	.	H	α-helix	trans	-67.3	-43.9	-178.8	-69.9	-175.1	-177	171.9	1.2	112.6	N159	N159-R161 PolarHBondContact O-N 2.77Å; N159-R161 VanDerWaalsContact O-N 3.08Å
162	H	85.1	Confident	88.8	Confident	80 Å²	80	58.3 Å²	58.3	37%	0.37	32%	0.322	S	S	.	.	H	α-helix	trans	-67.3	-47.2	177.5	177.5	-115.5	0	0	0	110.7	E154 N159 A165 F166	E154-H162 IonicContact OE1-CE1 2.67Å; E154-H162 IonicContact OE1-ND1 2.81Å; E154-H162 IonicContact OE2-CE1 3.87Å; E154-H162 IonicContact OE2-ND1 3.68Å; E154-H162 PolarHBondContact OE2-ND1 2.86Å; N159-H162 HydrophobicContact CB-CB 4.19Å; N159-H162 WeakPolarHBondContact ND2-CB 3.14Å; N159-H162 PolarHBondContact O-N 3.29Å; N159-H162 VanDerWaalsContact O-N 3.12Å; N159-H162 WeakPolarHBondContact OD1-CB 3.1Å; N159-H162 PolarHBondContact OD1-N 2.87Å; H162-A165 VanDerWaalsContact O-CB 3.25Å; H162-A165 WeakPolarHBondContact O-CB 3.41Å; H162-A165 PolarHBondContact O-N 2.84Å; H162-F166 AromaticContact CE1-CE2 3.79Å; H162-F166 AromaticContact NE2-CE2 3.68Å; H162-F166 WeakPolarHBondContact O-CD2 3.46Å
163	I	83.4	Confident	88.8	Confident	5 Å²	5	61 Å²	61	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-69.9	-42	-172	-65	170.2	0	0	0	111.1	L151 E154 S155 I156 N159 A165 F166	L151-I163 HydrophobicContact CB-CG2 3.57Å; L151-I163 HydrophobicContact CD2-CG2 3.32Å; L151-I163 WeakPolarHBondContact CD2-O 3.39Å; L151-I163 HydrophobicContact CG-CG2 3.91Å; E154-I163 HydrophobicContact CB-CD1 3.69Å; E154-I163 HydrophobicContact CB-CG1 4.1Å; S155-I163 WeakPolarHBondContact O-CD1 3.42Å; I156-I163 HydrophobicContact CG1-CG2 3.98Å; N159-I163 HydrophobicContact CB-CD1 4.47Å; N159-I163 WeakPolarHBondContact O-CB 3.43Å; N159-I163 VanDerWaalsContact O-CG1 3.29Å; N159-I163 WeakPolarHBondContact O-CG1 3.28Å; N159-I163 PolarHBondContact O-N 2.8Å; I163-A165 PolarHBondContact O-N 2.75Å; I163-A165 VanDerWaalsContact O-N 3.12Å; I163-F166 PolarHBondContact O-N 2.78Å; I163-F166 VanDerWaalsContact O-N 3.1Å
164	C	82.3	Confident	88.8	Confident	43 Å²	43	60.3 Å²	60.3	29%	0.291	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-16.1	176.2	-70.5	0	0	0	0	113.7	I160 F166 L167	I160-C164 VanDerWaalsContact CG1-SG 3.6Å; I160-C164 WeakPolarHBondContact O-CB 3.21Å; I160-C164 PolarHBondContact O-N 2.9Å; I160-C164 PolarHBondContact O-SG 2.78Å; C164-F166 VanDerWaalsContact C-N 3.27Å; C164-F166 PolarHBondContact O-N 2.92Å; C164-L167 PolarHBondContact O-N 2.91Å
165	A	87.1	Confident	88.8	Confident	45 Å²	45	61.1 Å²	61.1	37%	0.372	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-36.9	173.6	0	0	0	0	0	111.6	H162 I163 L167 K193	H162-A165 VanDerWaalsContact O-CB 3.25Å; H162-A165 WeakPolarHBondContact O-CB 3.41Å; H162-A165 PolarHBondContact O-N 2.84Å; I163-A165 PolarHBondContact O-N 2.75Å; I163-A165 VanDerWaalsContact O-N 3.12Å; A165-L167 VanDerWaalsContact C-N 3.35Å; A165-K193 WeakPolarHBondContact O-CE 3.14Å; A165-K193 PolarHBondContact O-NZ 2.88Å; A165-K193 VanDerWaalsContact O-NZ 3.07Å
166	F	90.9	Very high	89	Confident	63 Å²	63	61 Å²	61	28%	0.276	32%	0.324	S	S	.	.	S	Bend	trans	-84.6	-7.2	-179.7	-57.2	-73	0	0	0	114	L152 H162 I163 C164 T242 K243 V244	L152-F166 HydrophobicContact CD1-CB 3.78Å; L152-F166 HydrophobicContact CD1-CD1 4.46Å; L152-F166 HydrophobicContact CD1-CD2 4.25Å; L152-F166 HydrophobicContact CD1-CG 3.91Å; H162-F166 AromaticContact CE1-CE2 3.79Å; H162-F166 AromaticContact NE2-CE2 3.68Å; H162-F166 WeakPolarHBondContact O-CD2 3.46Å; I163-F166 PolarHBondContact O-N 2.78Å; I163-F166 VanDerWaalsContact O-N 3.1Å; C164-F166 VanDerWaalsContact C-N 3.27Å; C164-F166 PolarHBondContact O-N 2.92Å; F166-T242 CarbonylContact O-C 3.57Å; F166-T242 WeakPolarHBondContact O-CA 3.45Å; F166-K243 HydrophobicContact CD1-CD 4.34Å; F166-K243 HydrophobicContact CD1-CG 4.36Å; F166-K243 PolarHBondContact O-N 2.97Å; F166-V244 PolarHBondContact O-N 3.01Å
167	L	93.3	Very high	89.4	Confident	15 Å²	15	63.4 Å²	63.4	8%	0.079	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.4	-177.7	-166.1	71.4	0	0	0	111.7	C139 L151 C164 A165 V244 V246	C139-L167 VanDerWaalsContact CA-CD2 3.47Å; C139-L167 HydrophobicContact CB-CD2 3.9Å; L151-L167 HydrophobicContact CD1-CD1 4.22Å; L151-L167 HydrophobicContact CD2-CB 3.98Å; L151-L167 HydrophobicContact CD2-CD1 4.26Å; C164-L167 PolarHBondContact O-N 2.91Å; A165-L167 VanDerWaalsContact C-N 3.35Å; L167-V244 CarbonylContact C-O 3.55Å; L167-V244 WeakPolarHBondContact CA-O 3.27Å; L167-V244 HydrophobicContact CD1-CB 3.79Å; L167-V244 HydrophobicContact CD1-CG1 3.78Å; L167-V246 HydrophobicContact CD1-CG2 4.05Å
168	G	94.5	Very high	89.9	Confident	2 Å²	2	62.6 Å²	62.6	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	136.2	166.9	0	0	0	0	0	110.6	A237 V244 I245 V246	G168-A237 WeakPolarHBondContact CA-O 3.36Å; G168-V244 PolarHBondContact N-O 3.44Å; G168-I245 CarbonylContact O-C 3.58Å; G168-I245 WeakPolarHBondContact O-CA 3.18Å; G168-V246 PolarHBondContact O-N 2.98Å
169	Y	95	Very high	90.5	Very high	61 Å²	61	65.6 Å²	65.6	24%	0.239	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.8	171.9	178.3	-118.3	0	0	0	110.7	C139 L141 P171 V246 D248	C139-Y169 HydrophobicContact CB-CD2 4.32Å; C139-Y169 HydrophobicContact CB-CG 4.27Å; C139-Y169 WeakPolarHBondContact SG-CD2 3.11Å; L141-Y169 HydrophobicContact CD1-CD1 3.84Å; L141-Y169 HydrophobicContact CD1-CE1 3.5Å; Y169-P171 HydrophobicContact CE1-CB 3.73Å; Y169-P171 HydrophobicContact CE1-CG 4.32Å; Y169-V246 CarbonylContact C-O 3.56Å; Y169-V246 WeakPolarHBondContact CA-O 3.41Å; Y169-V246 HydrophobicContact CD2-CB 4.2Å; Y169-V246 HydrophobicContact CD2-CG1 4.09Å; Y169-V246 HydrophobicContact CE2-CG1 4.39Å; Y169-D248 HydrophobicContact CE2-CB 4.41Å
170	C	96.1	Very high	91.2	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	107.3	171.3	-178.1	0	0	0	0	108.6	I234 A237 V246 I247 D248	C170-I234 HydrophobicContact CB-CG1 4.41Å; C170-A237 HydrophobicContact CB-CB 4.07Å; C170-V246 PolarHBondContact N-O 2.94Å; C170-I247 HydrophobicContact CB-CB 4.4Å; C170-I247 HydrophobicContact CB-CG1 4.28Å; C170-I247 HydrophobicContact CB-CG2 4.06Å; C170-D248 PolarHBondContact O-N 3.49Å
171	P	94.6	Very high	91.9	Very high	38 Å²	38	61.5 Å²	61.5	25%	0.247	31%	0.307	C	S	.	.			trans	-67.1	167.9	178	26.5	-32.1	0	0	0	111.9	Y169 D173 V175 R230	Y169-P171 HydrophobicContact CE1-CB 3.73Å; Y169-P171 HydrophobicContact CE1-CG 4.32Å; P171-D173 PolarHBondContact O-N 3.39Å; P171-V175 HydrophobicContact CG-CG2 3.89Å; P171-R230 PolarHBondContact O-NH1 3.37Å
172	K	93.4	Very high	92.7	Very high	68 Å²	68	50.8 Å²	50.8	30%	0.296	27%	0.266	S	S	.	.	S	Bend	trans	-59.2	-45.9	176.9	179.8	177.8	177.5	-177.6	0	112.4	R230 D248 E249 F252	K172-R230 PolarHBondContact O-NH1 2.9Å; K172-D248 WeakPolarHBondContact CA-O 3.12Å; K172-D248 HydrophobicContact CB-CB 4.37Å; K172-E249 HydrophobicContact CD-CG 4.48Å; K172-E249 HydrophobicContact CG-CB 4.35Å; K172-F252 HydrophobicContact CD-CD1 4.29Å; K172-F252 HydrophobicContact CD-CD2 4.41Å; K172-F252 HydrophobicContact CD-CE1 4.36Å; K172-F252 HydrophobicContact CD-CG 4.31Å; K172-F252 HydrophobicContact CD-CZ 4.49Å; K172-F252 HydrophobicContact CG-CB 4.15Å; K172-F252 HydrophobicContact CG-CD1 3.54Å; K172-F252 HydrophobicContact CG-CD2 4.3Å; K172-F252 HydrophobicContact CG-CE1 3.98Å; K172-F252 HydrophobicContact CG-CG 3.72Å
173	D	92.1	Very high	93.3	Very high	109 Å²	109	47.4 Å²	47.4	58%	0.583	25%	0.253	S	S	*	.	S	Bend	trans	-85.9	142.9	178.1	-62.2	-44.2	0	0	0	111.2	P171 V175	P171-D173 PolarHBondContact O-N 3.39Å; D173-V175 PolarHBondContact O-N 2.96Å
174	N	91.3	Very high	94	Very high	53 Å²	53	51.6 Å²	51.6	28%	0.283	27%	0.272	S	S	.	.			trans	-75.7	96.4	179.8	-66.6	-31.9	0	0	0	110.6	L176 R230	N174-L176 HydrophobicContact CB-CD1 4.02Å; N174-L176 HydrophobicContact CB-CG 4.19Å; N174-L176 PolarHBondContact O-N 3.23Å; N174-L176 VanDerWaalsContact O-N 3.08Å; N174-R230 WeakPolarHBondContact OD1-CD 3.28Å
175	V	91	Very high	94.8	Very high	95 Å²	95	49.5 Å²	49.5	58%	0.576	26%	0.259	S	S	*	.			trans	-79.4	86.2	174.9	-175	0	0	0	0	109.6	P171 D173 F189	P171-V175 HydrophobicContact CG-CG2 3.89Å; D173-V175 PolarHBondContact O-N 2.96Å; V175-F189 WeakPolarHBondContact O-CZ 3.3Å
176	L	95	Very high	95.3	Very high	22 Å²	22	47.4 Å²	47.4	12%	0.115	24%	0.241	C	C	.	.			trans	-128.3	152.1	-175	-58.3	174.8	0	0	0	112.4	N174 N178 V221 K229 L232 A233 I236	N174-L176 HydrophobicContact CB-CD1 4.02Å; N174-L176 HydrophobicContact CB-CG 4.19Å; N174-L176 PolarHBondContact O-N 3.23Å; N174-L176 VanDerWaalsContact O-N 3.08Å; L176-N178 PolarHBondContact O-N 3.09Å; L176-V221 HydrophobicContact CB-CG1 4.06Å; L176-V221 HydrophobicContact CD1-CG1 3.86Å; L176-K229 HydrophobicContact CD1-CB 3.69Å; L176-K229 HydrophobicContact CD1-CG 4.05Å; L176-L232 HydrophobicContact CD1-CD2 4.27Å; L176-L232 HydrophobicContact CD2-CD2 3.99Å; L176-L232 HydrophobicContact CD2-CG 3.85Å; L176-A233 HydrophobicContact CD2-CB 4.43Å; L176-I236 HydrophobicContact CD2-CD1 3.44Å; L176-I236 VanDerWaalsContact CD2-CD1 3.44Å
177	L	96.2	Very high	95.6	Very high	64 Å²	64	48 Å²	48	34%	0.335	25%	0.247	S	C	.	.			trans	-89.7	94.9	172.6	-61.2	179.9	0	0	0	109.6	K179 L180 N185 F188	L177-K179 PolarHBondContact O-N 3.29Å; L177-K179 VanDerWaalsContact O-N 3.14Å; L177-L180 HydrophobicContact CB-CB 4.2Å; L177-L180 HydrophobicContact CB-CD1 3.87Å; L177-L180 HydrophobicContact CB-CG 3.97Å; L177-L180 HydrophobicContact CD1-CD1 3.47Å; L177-L180 VanDerWaalsContact CD1-CD1 3.47Å; L177-L180 HydrophobicContact CD1-CG 4.37Å; L177-L180 HydrophobicContact CG-CD1 4.33Å; L177-L180 PolarHBondContact O-N 3.11Å; L177-N185 WeakPolarHBondContact CB-OD1 3.09Å; L177-N185 PolarHBondContact N-OD1 2.71Å; L177-N185 PolarHBondContact O-ND2 2.76Å; L177-F188 HydrophobicContact CD1-CB 4.41Å; L177-F188 HydrophobicContact CD1-CD1 3.46Å; L177-F188 VanDerWaalsContact CD1-CD1 3.46Å; L177-F188 HydrophobicContact CD1-CD2 4.09Å; L177-F188 HydrophobicContact CD1-CE1 3.63Å; L177-F188 HydrophobicContact CD1-CE2 4.22Å; L177-F188 HydrophobicContact CD1-CG 3.71Å; L177-F188 HydrophobicContact CD1-CZ 4.01Å; L177-F188 HydrophobicContact CG-CD1 4.49Å
178	N	95	Very high	95.8	Very high	82 Å²	82	51.8 Å²	51.8	44%	0.439	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.2	-174	-72.5	-23.1	0	0	0	114.7	L176 L180 E222	L176-N178 PolarHBondContact O-N 3.09Å; N178-L180 VanDerWaalsContact C-N 3.33Å; N178-E222 HydrophobicContact CB-CB 4.24Å; N178-E222 WeakPolarHBondContact O-CB 3.19Å; N178-E222 PolarHBondContact O-N 3.42Å; N178-E222 VanDerWaalsContact O-N 3.13Å
179	K	97	Very high	95.8	Very high	149 Å²	149	53.6 Å²	53.6	65%	0.648	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	0.4	179.7	-61.5	-56.3	-173.6	-174.1	0	114.2	L177 E222	L177-K179 PolarHBondContact O-N 3.29Å; L177-K179 VanDerWaalsContact O-N 3.14Å; K179-E222 IonicContact NZ-OE1 3.69Å; K179-E222 PolarHBondContact NZ-OE1 3.21Å; K179-E222 IonicContact NZ-OE2 3.33Å; K179-E222 PolarHBondContact NZ-OE2 2.92Å
180	L	97.4	Very high	95.8	Very high	53 Å²	53	50.7 Å²	50.7	28%	0.277	26%	0.259	S	S	.	.	S	Bend	trans	-108.4	156.8	174.3	-62.1	-173.5	0	0	0	110.1	L177 N178 E184 N185 F188 V221	L177-L180 HydrophobicContact CB-CB 4.2Å; L177-L180 HydrophobicContact CB-CD1 3.87Å; L177-L180 HydrophobicContact CB-CG 3.97Å; L177-L180 HydrophobicContact CD1-CD1 3.47Å; L177-L180 VanDerWaalsContact CD1-CD1 3.47Å; L177-L180 HydrophobicContact CD1-CG 4.37Å; L177-L180 HydrophobicContact CG-CD1 4.33Å; L177-L180 PolarHBondContact O-N 3.11Å; N178-L180 VanDerWaalsContact C-N 3.33Å; L180-E184 HydrophobicContact CB-CB 3.89Å; L180-E184 HydrophobicContact CD1-CB 4.36Å; L180-E184 HydrophobicContact CG-CB 4.5Å; L180-N185 WeakPolarHBondContact CB-ND2 3.33Å; L180-N185 PolarHBondContact O-ND2 2.93Å; L180-F188 HydrophobicContact CD1-CB 4.41Å; L180-V221 WeakPolarHBondContact O-CG2 3.48Å; L180-V221 PolarHBondContact O-N 2.95Å
181	T	98	Very high	95.7	Very high	19 Å²	19	53.6 Å²	53.6	12%	0.117	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-70.5	166.1	171.4	61.9	0	0	0	0	111.9	G183 E184 N185 H218 V219 L220	T181-G183 VanDerWaalsContact C-N 3.29Å; T181-G183 PolarHBondContact O-N 3.04Å; T181-E184 WeakPolarHBondContact CB-OE2 3.25Å; T181-E184 WeakPolarHBondContact CG2-OE2 3.13Å; T181-E184 PolarHBondContact N-OE2 2.89Å; T181-E184 PolarHBondContact O-N 2.74Å; T181-E184 WeakPolarHBondContact OG1-CB 3.24Å; T181-E184 WeakPolarHBondContact OG1-CG 3.31Å; T181-E184 PolarHBondContact OG1-N 3.25Å; T181-E184 PolarHBondContact OG1-OE2 3.48Å; T181-N185 PolarHBondContact O-N 3.22Å; T181-N185 PolarHBondContact O-ND2 3.2Å; T181-H218 WeakPolarHBondContact CG2-O 3.33Å; T181-V219 CarbonylContact C-O 3.59Å; T181-V219 WeakPolarHBondContact CA-O 3.49Å; T181-V219 WeakPolarHBondContact CB-O 3.42Å; T181-L220 HydrophobicContact CG2-CD2 4.1Å
182	V	98	Very high	95.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-54	-47	174	175.8	0	0	0	0	111	N185 L186 L208 L213 M216 V219 V221 L232	V182-N185 PolarHBondContact O-N 3.31Å; V182-L186 PolarHBondContact O-N 2.89Å; V182-L208 HydrophobicContact CG1-CD2 3.9Å; V182-L213 HydrophobicContact CG1-CB 4.49Å; V182-L213 HydrophobicContact CG1-CD1 4.3Å; V182-M216 WeakPolarHBondContact CB-O 3.39Å; V182-M216 HydrophobicContact CG2-CB 4.33Å; V182-M216 WeakPolarHBondContact CG2-O 3.05Å; V182-V219 PolarHBondContact N-O 2.93Å; V182-V221 HydrophobicContact CG2-CG2 4.41Å; V182-L232 HydrophobicContact CB-CD2 4.41Å; V182-L232 HydrophobicContact CG1-CD1 3.92Å; V182-L232 HydrophobicContact CG1-CD2 4.27Å; V182-L232 HydrophobicContact CG2-CD2 4.29Å
183	G	97.8	Very high	95.4	Very high	9 Å²	9	58.5 Å²	58.5	9%	0.093	30%	0.302	C	S	.	.	H	α-helix	trans	-67	-38.3	179	0	0	0	0	0	113.3	T181 L186 N187 R217	T181-G183 VanDerWaalsContact C-N 3.29Å; T181-G183 PolarHBondContact O-N 3.04Å; G183-L186 PolarHBondContact O-N 3.47Å; G183-N187 WeakPolarHBondContact O-CB 3.24Å; G183-N187 PolarHBondContact O-N 3.43Å; G183-R217 PolarHBondContact N-O 3.48Å
184	E	98	Very high	95.3	Very high	93 Å²	93	56.1 Å²	56.1	44%	0.435	30%	0.303	S	S	.	.	H	α-helix	trans	-69.8	-36.3	176.9	-74	165	153.6	0	0	112.4	L180 T181 N187 F188	L180-E184 HydrophobicContact CB-CB 3.89Å; L180-E184 HydrophobicContact CD1-CB 4.36Å; L180-E184 HydrophobicContact CG-CB 4.5Å; T181-E184 WeakPolarHBondContact CB-OE2 3.25Å; T181-E184 WeakPolarHBondContact CG2-OE2 3.13Å; T181-E184 PolarHBondContact N-OE2 2.89Å; T181-E184 PolarHBondContact O-N 2.74Å; T181-E184 WeakPolarHBondContact OG1-CB 3.24Å; T181-E184 WeakPolarHBondContact OG1-CG 3.31Å; T181-E184 PolarHBondContact OG1-N 3.25Å; T181-E184 PolarHBondContact OG1-OE2 3.48Å; E184-N187 PolarHBondContact O-N 2.87Å; E184-F188 VanDerWaalsContact O-CB 3.29Å; E184-F188 WeakPolarHBondContact O-CB 3.37Å; E184-F188 PolarHBondContact O-N 2.82Å
185	N	98.1	Very high	95.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.2	-50.6	171.8	-90	-93.9	0	0	0	110.7	L177 L180 T181 V182 N187 F188 F189 V221 L232	L177-N185 WeakPolarHBondContact CB-OD1 3.09Å; L177-N185 PolarHBondContact N-OD1 2.71Å; L177-N185 PolarHBondContact O-ND2 2.76Å; L180-N185 WeakPolarHBondContact CB-ND2 3.33Å; L180-N185 PolarHBondContact O-ND2 2.93Å; T181-N185 PolarHBondContact O-N 3.22Å; T181-N185 PolarHBondContact O-ND2 3.2Å; V182-N185 PolarHBondContact O-N 3.31Å; N185-N187 VanDerWaalsContact C-N 3.31Å; N185-N187 PolarHBondContact O-N 3.41Å; N185-F188 PolarHBondContact O-N 3.43Å; N185-F189 VanDerWaalsContact O-CD2 3.27Å; N185-F189 WeakPolarHBondContact O-CD2 3.27Å; N185-F189 PolarHBondContact O-N 2.83Å; N185-V221 VanDerWaalsContact ND2-CG2 3.28Å; N185-V221 WeakPolarHBondContact ND2-CG2 3.44Å; N185-L232 HydrophobicContact CB-CD1 4.43Å; N185-L232 HydrophobicContact CB-CD2 4.09Å
186	L	97.8	Very high	95.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-42.1	177.6	-67.9	170.1	0	0	0	111.8	V182 G183 G190 I204 V207 L208 L232 A235 I236 L239	V182-L186 PolarHBondContact O-N 2.89Å; G183-L186 PolarHBondContact O-N 3.47Å; L186-G190 PolarHBondContact O-N 2.82Å; L186-I204 HydrophobicContact CB-CD1 4.38Å; L186-I204 HydrophobicContact CB-CG1 3.99Å; L186-I204 HydrophobicContact CB-CG2 4.36Å; L186-I204 HydrophobicContact CD1-CG2 4.1Å; L186-V207 HydrophobicContact CD2-CG1 4.04Å; L186-L208 HydrophobicContact CD1-CD1 4.35Å; L186-L208 HydrophobicContact CD1-CD2 3.52Å; L186-L208 HydrophobicContact CD1-CG 3.65Å; L186-L232 HydrophobicContact CD1-CD1 4.38Å; L186-L232 HydrophobicContact CD2-CD1 3.85Å; L186-L232 HydrophobicContact CG-CD1 3.78Å; L186-A235 HydrophobicContact CD2-CB 4.04Å; L186-I236 HydrophobicContact CD2-CG1 3.9Å; L186-L239 HydrophobicContact CB-CD1 4.44Å; L186-L239 HydrophobicContact CD2-CD1 4.04Å; L186-L239 HydrophobicContact CD2-CD2 4.37Å; L186-L239 HydrophobicContact CD2-CG 4.35Å; L186-L239 WeakPolarHBondContact O-CD1 3.49Å
187	N	97.5	Very high	95.5	Very high	77 Å²	77	56.2 Å²	56.2	41%	0.412	31%	0.311	S	S	.	.	H	α-helix	trans	-63.4	-41.7	176.3	-171.9	77.7	0	0	0	112.2	G183 E184 N185 S191 I204	G183-N187 WeakPolarHBondContact O-CB 3.24Å; G183-N187 PolarHBondContact O-N 3.43Å; E184-N187 PolarHBondContact O-N 2.87Å; N185-N187 VanDerWaalsContact C-N 3.31Å; N185-N187 PolarHBondContact O-N 3.41Å; N187-S191 VanDerWaalsContact O-CB 3.25Å; N187-S191 WeakPolarHBondContact O-CB 3.42Å; N187-S191 PolarHBondContact O-N 2.84Å; N187-S191 PolarHBondContact O-OG 3.29Å; N187-I204 HydrophobicContact CB-CD1 3.92Å
188	F	97.2	Very high	95.4	Very high	94 Å²	94	55.9 Å²	55.9	41%	0.412	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-55	178.5	176.7	-93.9	0	0	0	111.5	L177 L180 E184 N185 G190 S191 L192	L177-F188 HydrophobicContact CD1-CB 4.41Å; L177-F188 HydrophobicContact CD1-CD1 3.46Å; L177-F188 VanDerWaalsContact CD1-CD1 3.46Å; L177-F188 HydrophobicContact CD1-CD2 4.09Å; L177-F188 HydrophobicContact CD1-CE1 3.63Å; L177-F188 HydrophobicContact CD1-CE2 4.22Å; L177-F188 HydrophobicContact CD1-CG 3.71Å; L177-F188 HydrophobicContact CD1-CZ 4.01Å; L177-F188 HydrophobicContact CG-CD1 4.49Å; L180-F188 HydrophobicContact CD1-CB 4.41Å; E184-F188 VanDerWaalsContact O-CB 3.29Å; E184-F188 WeakPolarHBondContact O-CB 3.37Å; E184-F188 PolarHBondContact O-N 2.82Å; N185-F188 PolarHBondContact O-N 3.43Å; F188-G190 PolarHBondContact O-N 3.45Å; F188-S191 PolarHBondContact O-N 3.27Å; F188-L192 HydrophobicContact CE1-CD2 4.49Å; F188-L192 WeakPolarHBondContact O-CB 3.37Å; F188-L192 PolarHBondContact O-N 2.82Å
189	F	95.1	Very high	95.4	Very high	40 Å²	40	56.8 Å²	56.8	18%	0.175	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-35.6	-178.1	-75.9	-74.3	0	0	0	112.7	V175 N185 L192 K193 I236 L239	V175-F189 WeakPolarHBondContact O-CZ 3.3Å; N185-F189 VanDerWaalsContact O-CD2 3.27Å; N185-F189 WeakPolarHBondContact O-CD2 3.27Å; N185-F189 PolarHBondContact O-N 2.83Å; F189-L192 HydrophobicContact CD1-CD2 4.49Å; F189-L192 WeakPolarHBondContact O-CB 3.2Å; F189-L192 PolarHBondContact O-N 3.09Å; F189-K193 WeakPolarHBondContact O-CB 3.26Å; F189-K193 PolarHBondContact O-N 3.11Å; F189-I236 HydrophobicContact CB-CG1 4.37Å; F189-I236 HydrophobicContact CB-CG2 3.59Å; F189-I236 HydrophobicContact CD1-CG2 4.15Å; F189-I236 HydrophobicContact CD2-CD1 3.45Å; F189-I236 VanDerWaalsContact CD2-CD1 3.45Å; F189-I236 HydrophobicContact CD2-CG1 3.92Å; F189-I236 HydrophobicContact CD2-CG2 4.04Å; F189-I236 HydrophobicContact CE2-CD1 3.69Å; F189-I236 HydrophobicContact CG-CD1 4.24Å; F189-I236 HydrophobicContact CG-CG1 4.35Å; F189-I236 HydrophobicContact CG-CG2 3.68Å; F189-L239 HydrophobicContact CB-CD1 4.39Å
190	G	94.8	Very high	95.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-68.3	-36.4	174.9	0	0	0	0	0	113.1	L186 F188 K193 G194 I195	L186-G190 PolarHBondContact O-N 2.82Å; F188-G190 PolarHBondContact O-N 3.45Å; G190-K193 PolarHBondContact O-N 2.78Å; G190-G194 PolarHBondContact O-N 3.04Å; G190-I195 WeakPolarHBondContact O-CG1 3.48Å; G190-I195 PolarHBondContact O-N 3.31Å
191	S	94.8	Very high	95.3	Very high	61 Å²	61	54.4 Å²	54.4	43%	0.427	30%	0.302	S	S	.	.	H	α-helix	trans	-66.1	-40.3	171.6	-57.5	0	0	0	0	111.2	N187 F188 K193 G194 L200	N187-S191 VanDerWaalsContact O-CB 3.25Å; N187-S191 WeakPolarHBondContact O-CB 3.42Å; N187-S191 PolarHBondContact O-N 2.84Å; N187-S191 PolarHBondContact O-OG 3.29Å; F188-S191 PolarHBondContact O-N 3.27Å; S191-K193 VanDerWaalsContact C-N 3.29Å; S191-K193 PolarHBondContact O-N 2.91Å; S191-G194 PolarHBondContact O-N 2.85Å; S191-L200 WeakPolarHBondContact OG-CD2 3.36Å
192	L	91.8	Very high	95.2	Very high	128 Å²	128	61.6 Å²	61.6	67%	0.67	33%	0.327	S	S	*	.	H	α-helix	trans	-63.6	-35	175.7	-174.4	64.7	0	0	0	112.1	F188 F189 G194	F188-L192 HydrophobicContact CE1-CD2 4.49Å; F188-L192 WeakPolarHBondContact O-CB 3.37Å; F188-L192 PolarHBondContact O-N 2.82Å; F189-L192 HydrophobicContact CD1-CD2 4.49Å; F189-L192 WeakPolarHBondContact O-CB 3.2Å; F189-L192 PolarHBondContact O-N 3.09Å; L192-G194 PolarHBondContact O-N 2.99Å
193	K	89	Confident	95.1	Very high	80 Å²	80	62.4 Å²	62.4	35%	0.348	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-11.3	173	-166.9	170.4	178.3	176.7	0	113	A165 F189 G190 S191 I195 L239	A165-K193 WeakPolarHBondContact O-CE 3.14Å; A165-K193 PolarHBondContact O-NZ 2.88Å; A165-K193 VanDerWaalsContact O-NZ 3.07Å; F189-K193 WeakPolarHBondContact O-CB 3.26Å; F189-K193 PolarHBondContact O-N 3.11Å; G190-K193 PolarHBondContact O-N 2.78Å; S191-K193 VanDerWaalsContact C-N 3.29Å; S191-K193 PolarHBondContact O-N 2.91Å; K193-I195 HydrophobicContact CB-CD1 4.37Å; K193-I195 HydrophobicContact CB-CG1 4.28Å; K193-I195 HydrophobicContact CD-CD1 4.39Å; K193-I195 HydrophobicContact CG-CG1 4.45Å; K193-L239 WeakPolarHBondContact CD-O 3.42Å; K193-L239 PolarHBondContact NZ-O 3.41Å
194	G	90.6	Very high	95	Very high	59 Å²	59	62.2 Å²	62.2	61%	0.608	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	19.5	178.5	0	0	0	0	0	114.4	G190 S191 L192	G190-G194 PolarHBondContact O-N 3.04Å; S191-G194 PolarHBondContact O-N 2.85Å; L192-G194 PolarHBondContact O-N 2.99Å
195	I	92.6	Very high	95	Very high	20 Å²	20	61 Å²	61	10%	0.103	33%	0.325	C	S	.	.			trans	-71.4	127.5	179.8	-55.6	166.6	0	0	0	109.1	G190 K193 S197 E199 L200 L239 G240	G190-I195 WeakPolarHBondContact O-CG1 3.48Å; G190-I195 PolarHBondContact O-N 3.31Å; K193-I195 HydrophobicContact CB-CD1 4.37Å; K193-I195 HydrophobicContact CB-CG1 4.28Å; K193-I195 HydrophobicContact CD-CD1 4.39Å; K193-I195 HydrophobicContact CG-CG1 4.45Å; I195-S197 PolarHBondContact O-N 3.1Å; I195-E199 HydrophobicContact CG2-CB 3.97Å; I195-L200 HydrophobicContact CB-CB 4.22Å; I195-L200 HydrophobicContact CB-CD1 4.42Å; I195-L200 HydrophobicContact CD1-CD1 4.14Å; I195-L200 HydrophobicContact CG2-CB 3.84Å; I195-L239 HydrophobicContact CD1-CB 3.91Å; I195-G240 VanDerWaalsContact CD1-CA 3.42Å; I195-G240 VanDerWaalsContact CD1-N 3.25Å
196	P	93.9	Very high	94.8	Very high	70 Å²	70	64.7 Å²	64.7	46%	0.455	34%	0.342	S	S	.	.			trans	-55.2	136.2	177.4	-25.7	34.3	0	0	0	111.9	A198 E199 L200	P196-A198 PolarHBondContact O-N 3.17Å; P196-E199 WeakPolarHBondContact O-CA 3.35Å; P196-E199 WeakPolarHBondContact O-CB 3.29Å; P196-E199 PolarHBondContact O-N 3.16Å; P196-L200 PolarHBondContact O-N 3.29Å
197	S	94.4	Very high	94.8	Very high	83 Å²	83	64.7 Å²	64.7	58%	0.58	34%	0.342	S	S	*	.	H	α-helix	trans	-56	-31.8	-170.1	-48.8	0	0	0	0	114.5	I195 R201	I195-S197 PolarHBondContact O-N 3.1Å; S197-R201 WeakPolarHBondContact O-CG 3.32Å; S197-R201 PolarHBondContact O-N 2.95Å
198	A	94.2	Very high	94.8	Very high	57 Å²	57	61.1 Å²	61.1	47%	0.471	32%	0.323	S	S	.	.	H	α-helix	trans	-71.2	-34.4	176.9	0	0	0	0	0	113.1	P196 R202	P196-A198 PolarHBondContact O-N 3.17Å; A198-R202 PolarHBondContact O-NE 3.11Å
199	E	95.2	Very high	94.7	Very high	100 Å²	100	63.9 Å²	63.9	47%	0.467	34%	0.335	S	S	.	.	H	α-helix	trans	-76.4	-44.5	174.3	-70.1	174.2	-158.9	0	0	110.4	I195 P196 R201 R202 D203	I195-E199 HydrophobicContact CG2-CB 3.97Å; P196-E199 WeakPolarHBondContact O-CA 3.35Å; P196-E199 WeakPolarHBondContact O-CB 3.29Å; P196-E199 PolarHBondContact O-N 3.16Å; E199-R201 VanDerWaalsContact C-N 3.3Å; E199-R201 PolarHBondContact O-N 2.86Å; E199-R202 WeakPolarHBondContact O-CA 3.08Å; E199-R202 WeakPolarHBondContact O-CB 3.44Å; E199-R202 PolarHBondContact O-N 2.82Å; E199-D203 WeakPolarHBondContact O-CB 3.32Å; E199-D203 PolarHBondContact O-N 3.36Å
200	L	96.4	Very high	94.8	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-55.4	-43.1	179.6	179.7	56.9	0	0	0	112.1	S191 I195 P196 R202 D203 I204 L239	S191-L200 WeakPolarHBondContact OG-CD2 3.36Å; I195-L200 HydrophobicContact CB-CB 4.22Å; I195-L200 HydrophobicContact CB-CD1 4.42Å; I195-L200 HydrophobicContact CD1-CD1 4.14Å; I195-L200 HydrophobicContact CG2-CB 3.84Å; P196-L200 PolarHBondContact O-N 3.29Å; L200-R202 VanDerWaalsContact C-N 3.29Å; L200-R202 PolarHBondContact O-N 3.04Å; L200-D203 PolarHBondContact O-N 3.19Å; L200-I204 HydrophobicContact CD1-CD1 3.85Å; L200-I204 HydrophobicContact CD1-CG1 3.84Å; L200-I204 HydrophobicContact CG-CD1 3.77Å; L200-I204 HydrophobicContact CG-CG1 4.24Å; L200-I204 WeakPolarHBondContact O-CB 3.32Å; L200-I204 WeakPolarHBondContact O-CG1 3.46Å; L200-I204 PolarHBondContact O-N 3.03Å; L200-L239 HydrophobicContact CD1-CD2 4.34Å
201	R	95.7	Very high	94.8	Very high	151 Å²	151	63.2 Å²	63.2	57%	0.57	33%	0.333	S	S	*	.	H	α-helix	trans	-59.9	-38.3	176.3	-75.2	-170.7	-61.4	-107.9	3.3	113.1	S197 E199 N205	S197-R201 WeakPolarHBondContact O-CG 3.32Å; S197-R201 PolarHBondContact O-N 2.95Å; E199-R201 VanDerWaalsContact C-N 3.3Å; E199-R201 PolarHBondContact O-N 2.86Å; R201-N205 PolarHBondContact O-N 2.9Å; R201-N205 PolarHBondContact O-ND2 3.39Å; R201-N205 VanDerWaalsContact O-ND2 3.12Å
202	R	96.1	Very high	94.9	Very high	170 Å²	170	66.3 Å²	66.3	64%	0.642	35%	0.345	S	S	*	.	H	α-helix	trans	-71.7	-45.3	177.7	-70.8	-175.3	-75.8	152.3	-4.6	110.5	A198 E199 L200 N205 E206	A198-R202 PolarHBondContact O-NE 3.11Å; E199-R202 WeakPolarHBondContact O-CA 3.08Å; E199-R202 WeakPolarHBondContact O-CB 3.44Å; E199-R202 PolarHBondContact O-N 2.82Å; L200-R202 VanDerWaalsContact C-N 3.29Å; L200-R202 PolarHBondContact O-N 3.04Å; R202-N205 WeakPolarHBondContact O-CB 3.44Å; R202-N205 PolarHBondContact O-N 2.83Å; R202-N205 VanDerWaalsContact O-N 3.16Å; R202-E206 PolarHBondContact O-N 3.16Å
203	D	95.5	Very high	95.1	Very high	18 Å²	18	60.4 Å²	60.4	10%	0.096	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-44.8	-179.9	-167.1	30.6	0	0	0	111.8	E199 L200 N205 E206 V207 L239 G240	E199-D203 WeakPolarHBondContact O-CB 3.32Å; E199-D203 PolarHBondContact O-N 3.36Å; L200-D203 PolarHBondContact O-N 3.19Å; D203-N205 VanDerWaalsContact C-N 3.28Å; D203-N205 PolarHBondContact O-N 2.79Å; D203-E206 PolarHBondContact O-N 2.53Å; D203-E206 VanDerWaalsContact O-N 3.09Å; D203-V207 WeakPolarHBondContact O-CB 3.45Å; D203-V207 WeakPolarHBondContact O-CG2 3.13Å; D203-V207 PolarHBondContact O-N 3.31Å; D203-L239 VanDerWaalsContact OD2-CA 3.31Å; D203-L239 WeakPolarHBondContact OD2-CA 3.42Å; D203-G240 PolarHBondContact OD2-N 2.96Å
204	I	97.3	Very high	95.5	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-55.1	-44.2	173.4	-71	169.8	0	0	0	111.3	L186 N187 L200 L208 L239	L186-I204 HydrophobicContact CB-CD1 4.38Å; L186-I204 HydrophobicContact CB-CG1 3.99Å; L186-I204 HydrophobicContact CB-CG2 4.36Å; L186-I204 HydrophobicContact CD1-CG2 4.1Å; N187-I204 HydrophobicContact CB-CD1 3.92Å; L200-I204 HydrophobicContact CD1-CD1 3.85Å; L200-I204 HydrophobicContact CD1-CG1 3.84Å; L200-I204 HydrophobicContact CG-CD1 3.77Å; L200-I204 HydrophobicContact CG-CG1 4.24Å; L200-I204 WeakPolarHBondContact O-CB 3.32Å; L200-I204 WeakPolarHBondContact O-CG1 3.46Å; L200-I204 PolarHBondContact O-N 3.03Å; I204-L208 HydrophobicContact CG2-CD1 3.8Å; I204-L208 HydrophobicContact CG2-CG 4.3Å; I204-L208 WeakPolarHBondContact O-CB 3.42Å; I204-L208 VanDerWaalsContact O-CG 3.23Å; I204-L208 WeakPolarHBondContact O-CG 3.4Å; I204-L208 PolarHBondContact O-N 2.78Å; I204-L239 HydrophobicContact CG1-CD2 4.29Å
205	N	96.6	Very high	95.8	Very high	67 Å²	67	64.8 Å²	64.8	36%	0.358	33%	0.325	S	S	.	.	H	α-helix	trans	-68.1	-35.1	179.9	-68.9	-29.9	0	0	0	112.2	R201 R202 D203 K209 R217	R201-N205 PolarHBondContact O-N 2.9Å; R201-N205 PolarHBondContact O-ND2 3.39Å; R201-N205 VanDerWaalsContact O-ND2 3.12Å; R202-N205 WeakPolarHBondContact O-CB 3.44Å; R202-N205 PolarHBondContact O-N 2.83Å; R202-N205 VanDerWaalsContact O-N 3.16Å; D203-N205 VanDerWaalsContact C-N 3.28Å; D203-N205 PolarHBondContact O-N 2.79Å; N205-K209 VanDerWaalsContact O-CG 3.26Å; N205-K209 WeakPolarHBondContact O-CG 3.49Å; N205-K209 PolarHBondContact O-N 2.83Å; N205-R217 PolarHBondContact OD1-NH1 3.35Å
206	E	95.4	Very high	96	Very high	78 Å²	78	66.5 Å²	66.5	36%	0.364	33%	0.333	S	S	.	.	H	α-helix	trans	-70	-47.4	175.2	-176.5	171.4	-179.2	0	0	111	R202 D203 L208 K209 I210 K272	R202-E206 PolarHBondContact O-N 3.16Å; D203-E206 PolarHBondContact O-N 2.53Å; D203-E206 VanDerWaalsContact O-N 3.09Å; E206-L208 PolarHBondContact O-N 2.8Å; E206-K209 WeakPolarHBondContact O-CB 3.38Å; E206-K209 PolarHBondContact O-N 2.77Å; E206-K209 VanDerWaalsContact O-N 3.12Å; E206-I210 HydrophobicContact CG-CD1 4.01Å; E206-I210 WeakPolarHBondContact O-CG1 3.41Å; E206-I210 PolarHBondContact O-N 2.97Å; E206-K272 IonicContact OE1-NZ 3.45Å
207	V	96.3	Very high	96.1	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-41.9	179.6	165.8	0	0	0	0	111.8	L186 D203 K209 I210 A211 A235 L238 L239	L186-V207 HydrophobicContact CD2-CG1 4.04Å; D203-V207 WeakPolarHBondContact O-CB 3.45Å; D203-V207 WeakPolarHBondContact O-CG2 3.13Å; D203-V207 PolarHBondContact O-N 3.31Å; V207-K209 VanDerWaalsContact C-N 3.29Å; V207-K209 PolarHBondContact O-N 2.82Å; V207-I210 PolarHBondContact O-N 2.79Å; V207-A211 WeakPolarHBondContact O-CB 3.38Å; V207-A211 PolarHBondContact O-N 2.64Å; V207-A235 HydrophobicContact CG1-CB 3.5Å; V207-A235 VanDerWaalsContact CG1-CB 3.5Å; V207-A235 VanDerWaalsContact CG1-O 3.25Å; V207-A235 WeakPolarHBondContact CG1-O 3.29Å; V207-L238 HydrophobicContact CG1-CB 4.48Å; V207-L238 HydrophobicContact CG2-CB 3.85Å; V207-L239 HydrophobicContact CB-CD2 4.48Å; V207-L239 HydrophobicContact CG2-CD2 4.13Å
208	L	97.5	Very high	96.3	Very high	2 Å²	2	70.3 Å²	70.3	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-61.7	-36	174.5	-76.6	171.8	0	0	0	112.5	V182 L186 I204 E206 D212 L213 R217	V182-L208 HydrophobicContact CG1-CD2 3.9Å; L186-L208 HydrophobicContact CD1-CD1 4.35Å; L186-L208 HydrophobicContact CD1-CD2 3.52Å; L186-L208 HydrophobicContact CD1-CG 3.65Å; I204-L208 HydrophobicContact CG2-CD1 3.8Å; I204-L208 HydrophobicContact CG2-CG 4.3Å; I204-L208 WeakPolarHBondContact O-CB 3.42Å; I204-L208 VanDerWaalsContact O-CG 3.23Å; I204-L208 WeakPolarHBondContact O-CG 3.4Å; I204-L208 PolarHBondContact O-N 2.78Å; E206-L208 PolarHBondContact O-N 2.8Å; L208-D212 PolarHBondContact O-N 3.13Å; L208-D212 VanDerWaalsContact O-N 3.09Å; L208-L213 HydrophobicContact CD2-CB 3.87Å; L208-L213 PolarHBondContact O-N 3.23Å; L208-R217 HydrophobicContact CD1-CB 4.3Å; L208-R217 HydrophobicContact CD1-CG 4.04Å
209	K	96.5	Very high	96.4	Very high	152 Å²	152	69.6 Å²	69.6	66%	0.661	32%	0.322	S	S	*	.	H	α-helix	trans	-69.3	-43.3	175	-70.9	171.7	-174.6	-175.6	0	111.5	N205 E206 V207 A211 D212	N205-K209 VanDerWaalsContact O-CG 3.26Å; N205-K209 WeakPolarHBondContact O-CG 3.49Å; N205-K209 PolarHBondContact O-N 2.83Å; E206-K209 WeakPolarHBondContact O-CB 3.38Å; E206-K209 PolarHBondContact O-N 2.77Å; E206-K209 VanDerWaalsContact O-N 3.12Å; V207-K209 VanDerWaalsContact C-N 3.29Å; V207-K209 PolarHBondContact O-N 2.82Å; K209-A211 VanDerWaalsContact C-N 3.3Å; K209-A211 PolarHBondContact O-N 3.25Å; K209-D212 PolarHBondContact O-N 2.89Å
210	I	95.4	Very high	96.5	Very high	27 Å²	27	67.8 Å²	67.8	14%	0.138	32%	0.315	C	S	.	.	H	α-helix	trans	-62	-40.6	176.7	-66.8	167.6	0	0	0	110.8	E206 V207 D212 L238 M265 I269	E206-I210 HydrophobicContact CG-CD1 4.01Å; E206-I210 WeakPolarHBondContact O-CG1 3.41Å; E206-I210 PolarHBondContact O-N 2.97Å; V207-I210 PolarHBondContact O-N 2.79Å; I210-D212 VanDerWaalsContact C-N 3.27Å; I210-D212 PolarHBondContact O-N 3.29Å; I210-L238 HydrophobicContact CG2-CD1 3.93Å; I210-M265 HydrophobicContact CG2-CG 4.47Å; I210-I269 HydrophobicContact CG2-CG1 3.72Å
211	A	96	Very high	96.6	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-76.8	-12.7	179.6	0	0	0	0	0	113.8	V207 K209 L213 K231 A235 M265	V207-A211 WeakPolarHBondContact O-CB 3.38Å; V207-A211 PolarHBondContact O-N 2.64Å; K209-A211 VanDerWaalsContact C-N 3.3Å; K209-A211 PolarHBondContact O-N 3.25Å; A211-L213 HydrophobicContact CB-CB 4.21Å; A211-L213 HydrophobicContact CB-CD1 3.83Å; A211-L213 HydrophobicContact CB-CG 3.79Å; A211-K231 WeakPolarHBondContact O-CD 3.24Å; A211-K231 PolarHBondContact O-NZ 2.73Å; A211-K231 VanDerWaalsContact O-NZ 3.1Å; A211-A235 HydrophobicContact CB-CB 4.07Å; A211-M265 HydrophobicContact CB-CE 3.53Å; A211-M265 HydrophobicContact CB-SD 4Å
212	D	96.4	Very high	96.6	Very high	125 Å²	125	64.2 Å²	64.2	67%	0.668	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	52.2	-169.6	-173.1	39.1	0	0	0	111.4	L208 K209 I210 K231	L208-D212 PolarHBondContact O-N 3.13Å; L208-D212 VanDerWaalsContact O-N 3.09Å; K209-D212 PolarHBondContact O-N 2.89Å; I210-D212 VanDerWaalsContact C-N 3.27Å; I210-D212 PolarHBondContact O-N 3.29Å; D212-K231 IonicContact OD2-NZ 3.86Å
213	L	97.2	Very high	96.6	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.021	31%	0.305	C	S	.	.			trans	-125.9	13.2	-176.7	-67.9	-177.1	0	0	0	113.3	V182 L208 A211 E215 M216 R217 V228 K231 L232	V182-L213 HydrophobicContact CG1-CB 4.49Å; V182-L213 HydrophobicContact CG1-CD1 4.3Å; L208-L213 HydrophobicContact CD2-CB 3.87Å; L208-L213 PolarHBondContact O-N 3.23Å; A211-L213 HydrophobicContact CB-CB 4.21Å; A211-L213 HydrophobicContact CB-CD1 3.83Å; A211-L213 HydrophobicContact CB-CG 3.79Å; L213-E215 VanDerWaalsContact C-N 3.34Å; L213-E215 PolarHBondContact O-N 3.07Å; L213-M216 HydrophobicContact CD2-CB 4.38Å; L213-M216 HydrophobicContact CD2-CG 4.32Å; L213-M216 PolarHBondContact O-N 3.13Å; L213-R217 PolarHBondContact O-N 2.83Å; L213-V228 HydrophobicContact CD2-CB 4.39Å; L213-V228 HydrophobicContact CD2-CG1 3.86Å; L213-V228 HydrophobicContact CD2-CG2 4.16Å; L213-K231 HydrophobicContact CD1-CB 3.9Å; L213-K231 HydrophobicContact CD2-CB 4.43Å; L213-K231 HydrophobicContact CD2-CD 4.24Å; L213-K231 HydrophobicContact CG-CB 4.33Å; L213-L232 HydrophobicContact CD1-CB 4.16Å
214	C	97.2	Very high	96.6	Very high	54 Å²	54	61.4 Å²	61.4	37%	0.365	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-54.2	-47.5	-178.9	-68.2	0	0	0	0	112.6	M216 R217	C214-M216 PolarHBondContact O-N 3.43Å; C214-R217 VanDerWaalsContact O-CB 3.26Å; C214-R217 WeakPolarHBondContact O-CB 3.37Å; C214-R217 PolarHBondContact O-N 3.26Å
215	E	96.2	Very high	96.5	Very high	177 Å²	177	64.4 Å²	64.4	83%	0.827	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-67.9	-23.3	179.3	-57.8	-51.5	126.1	0	0	112.8	L213 R217	L213-E215 VanDerWaalsContact C-N 3.34Å; L213-E215 PolarHBondContact O-N 3.07Å; E215-R217 VanDerWaalsContact C-N 3.34Å
216	M	95.7	Very high	96.3	Very high	57 Å²	57	65.5 Å²	65.5	28%	0.281	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-89.7	0.2	-179.4	-59.7	-58.5	-70.1	0	0	112.8	V182 L213 C214 H218 V219 V228	V182-M216 WeakPolarHBondContact CB-O 3.39Å; V182-M216 HydrophobicContact CG2-CB 4.33Å; V182-M216 WeakPolarHBondContact CG2-O 3.05Å; L213-M216 HydrophobicContact CD2-CB 4.38Å; L213-M216 HydrophobicContact CD2-CG 4.32Å; L213-M216 PolarHBondContact O-N 3.13Å; C214-M216 PolarHBondContact O-N 3.43Å; M216-H218 PolarHBondContact O-N 2.85Å; M216-H218 VanDerWaalsContact O-N 3.1Å; M216-V219 HydrophobicContact CE-CB 3.94Å; M216-V219 HydrophobicContact CE-CG1 3.83Å; M216-V219 HydrophobicContact CE-CG2 3.79Å; M216-V219 WeakPolarHBondContact O-CB 3.39Å; M216-V219 PolarHBondContact O-N 3.33Å; M216-V219 HydrophobicContact SD-CG2 4.07Å; M216-V228 HydrophobicContact CE-CG2 4.5Å
217	R	97.2	Very high	96.3	Very high	80 Å²	80	62.5 Å²	62.5	30%	0.302	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-41.1	-173.3	-179.4	180	-171.3	139.3	7	113.7	G183 N205 L208 L213 C214 E215	G183-R217 PolarHBondContact N-O 3.48Å; N205-R217 PolarHBondContact OD1-NH1 3.35Å; L208-R217 HydrophobicContact CD1-CB 4.3Å; L208-R217 HydrophobicContact CD1-CG 4.04Å; L213-R217 PolarHBondContact O-N 2.83Å; C214-R217 VanDerWaalsContact O-CB 3.26Å; C214-R217 WeakPolarHBondContact O-CB 3.37Å; C214-R217 PolarHBondContact O-N 3.26Å; E215-R217 VanDerWaalsContact C-N 3.34Å
218	H	97.6	Very high	96.3	Very high	152 Å²	152	63.4 Å²	63.4	70%	0.704	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	4.3	-175.5	-59.8	-66.2	0	0	0	113.4	T181 M216	T181-H218 WeakPolarHBondContact CG2-O 3.33Å; M216-H218 PolarHBondContact O-N 2.85Å; M216-H218 VanDerWaalsContact O-N 3.1Å
219	V	97.5	Very high	96.3	Very high	43 Å²	43	65.2 Å²	65.2	26%	0.261	33%	0.331	S	S	.	.	S	Bend	trans	-82.3	133.9	177.9	179.6	0	0	0	0	109.4	T181 V182 M216 N223	T181-V219 CarbonylContact C-O 3.59Å; T181-V219 WeakPolarHBondContact CA-O 3.49Å; T181-V219 WeakPolarHBondContact CB-O 3.42Å; V182-V219 PolarHBondContact N-O 2.93Å; M216-V219 HydrophobicContact CE-CB 3.94Å; M216-V219 HydrophobicContact CE-CG1 3.83Å; M216-V219 HydrophobicContact CE-CG2 3.79Å; M216-V219 WeakPolarHBondContact O-CB 3.39Å; M216-V219 PolarHBondContact O-N 3.33Å; M216-V219 HydrophobicContact SD-CG2 4.07Å; V219-N223 HydrophobicContact CG1-CB 4.5Å
220	L	97.9	Very high	96.3	Very high	61 Å²	61	58 Å²	58	32%	0.319	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-62.5	134	171.9	-73.4	171.9	0	0	0	110.6	T181 E222 N223	T181-L220 HydrophobicContact CG2-CD2 4.1Å; L220-E222 HydrophobicContact CB-CG 4.21Å; L220-E222 PolarHBondContact O-N 3.32Å; L220-N223 PolarHBondContact O-N 3.42Å
221	V	97.1	Very high	96.4	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-60.3	-35	-176.9	169.8	0	0	0	0	112.2	L176 L180 V182 N185 N223 S224 K229 L232	L176-V221 HydrophobicContact CB-CG1 4.06Å; L176-V221 HydrophobicContact CD1-CG1 3.86Å; L180-V221 WeakPolarHBondContact O-CG2 3.48Å; L180-V221 PolarHBondContact O-N 2.95Å; V182-V221 HydrophobicContact CG2-CG2 4.41Å; N185-V221 VanDerWaalsContact ND2-CG2 3.28Å; N185-V221 WeakPolarHBondContact ND2-CG2 3.44Å; V221-N223 PolarHBondContact O-N 3.39Å; V221-S224 WeakPolarHBondContact O-CB 3.45Å; V221-S224 PolarHBondContact O-N 3.36Å; V221-S224 VanDerWaalsContact O-N 3.1Å; V221-S224 PolarHBondContact O-OG 2.92Å; V221-K229 HydrophobicContact CG1-CG 4.15Å; V221-K229 WeakPolarHBondContact O-CE 3.43Å; V221-L232 HydrophobicContact CG2-CD2 3.52Å
222	E	96.4	Very high	96.5	Very high	78 Å²	78	57.6 Å²	57.6	36%	0.364	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-59.9	-28.9	175.7	64.4	-175.5	169.7	0	0	114.3	N178 K179 L220	N178-E222 HydrophobicContact CB-CB 4.24Å; N178-E222 WeakPolarHBondContact O-CB 3.19Å; N178-E222 PolarHBondContact O-N 3.42Å; N178-E222 VanDerWaalsContact O-N 3.13Å; K179-E222 IonicContact NZ-OE1 3.69Å; K179-E222 PolarHBondContact NZ-OE1 3.21Å; K179-E222 IonicContact NZ-OE2 3.33Å; K179-E222 PolarHBondContact NZ-OE2 2.92Å; L220-E222 HydrophobicContact CB-CG 4.21Å; L220-E222 PolarHBondContact O-N 3.32Å
223	N	96.4	Very high	96.5	Very high	119 Å²	119	52.1 Å²	52.1	64%	0.636	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-92	3.2	179.9	-64.2	-21.5	0	0	0	113	V219 L220 V221	V219-N223 HydrophobicContact CG1-CB 4.5Å; L220-N223 PolarHBondContact O-N 3.42Å; V221-N223 PolarHBondContact O-N 3.39Å
224	S	94.5	Very high	96.5	Very high	9 Å²	9	51.9 Å²	51.9	6%	0.063	27%	0.267	C	S	.	.	S	Bend	trans	-94.6	152.9	-178.6	71.5	0	0	0	0	112.2	V221 K229	V221-S224 WeakPolarHBondContact O-CB 3.45Å; V221-S224 PolarHBondContact O-N 3.36Å; V221-S224 VanDerWaalsContact O-N 3.1Å; V221-S224 PolarHBondContact O-OG 2.92Å; S224-K229 VanDerWaalsContact O-CE 3.27Å; S224-K229 WeakPolarHBondContact O-CE 3.44Å; S224-K229 WeakPolarHBondContact OG-CG 3.37Å
225	S	94.7	Very high	96.5	Very high	67 Å²	67	49.3 Å²	49.3	47%	0.469	25%	0.25	S	C	.	.			trans	-69.3	159.8	175.3	67.2	0	0	0	0	111.8	T227 V228 K229	S225-T227 PolarHBondContact O-N 3.41Å; S225-V228 WeakPolarHBondContact O-CB 3.39Å; S225-V228 PolarHBondContact O-N 2.92Å; S225-V228 WeakPolarHBondContact OG-CG2 3.3Å; S225-V228 PolarHBondContact OG-N 3.21Å; S225-K229 PolarHBondContact O-N 3.41Å
226	D	93.8	Very high	96.5	Very high	90 Å²	90	42.2 Å²	42.2	48%	0.481	22%	0.217	S	C	.	.	H	α-helix	trans	-62.6	-30.8	179.9	-66	-27.3	0	0	0	112.7	K229 R230	D226-K229 PolarHBondContact O-N 3.36Å; D226-K229 IonicContact OD1-NZ 2.67Å; D226-R230 WeakPolarHBondContact O-CB 3.38Å; D226-R230 PolarHBondContact O-N 3.12Å
227	T	95.3	Very high	96.5	Very high	16 Å²	16	39.9 Å²	39.9	10%	0.098	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-42.9	170.9	-49	0	0	0	0	111.9	S225 R230 K231 V254 L258 A261	S225-T227 PolarHBondContact O-N 3.41Å; T227-R230 PolarHBondContact O-N 2.87Å; T227-K231 WeakPolarHBondContact O-CB 3.47Å; T227-K231 WeakPolarHBondContact O-CG 3.37Å; T227-K231 PolarHBondContact O-N 2.91Å; T227-V254 HydrophobicContact CG2-CG1 4.25Å; T227-L258 HydrophobicContact CG2-CB 4.49Å; T227-L258 WeakPolarHBondContact OG1-CD1 3.25Å; T227-A261 HydrophobicContact CG2-CB 4.01Å
228	V	95.8	Very high	96.4	Very high	18 Å²	18	36 Å²	36	11%	0.109	19%	0.192	C	C	.	.	H	α-helix	trans	-67.6	-43.6	176.9	170.3	0	0	0	0	110.6	L213 M216 S225 R230 K231 L232	L213-V228 HydrophobicContact CD2-CB 4.39Å; L213-V228 HydrophobicContact CD2-CG1 3.86Å; L213-V228 HydrophobicContact CD2-CG2 4.16Å; M216-V228 HydrophobicContact CE-CG2 4.5Å; S225-V228 WeakPolarHBondContact O-CB 3.39Å; S225-V228 PolarHBondContact O-N 2.92Å; S225-V228 WeakPolarHBondContact OG-CG2 3.3Å; S225-V228 PolarHBondContact OG-N 3.21Å; V228-R230 VanDerWaalsContact C-N 3.3Å; V228-R230 PolarHBondContact O-N 3.34Å; V228-K231 PolarHBondContact O-N 3.1Å; V228-L232 WeakPolarHBondContact O-CB 3.22Å; V228-L232 PolarHBondContact O-N 3.48Å
229	K	96.6	Very high	96.3	Very high	41 Å²	41	28.9 Å²	28.9	18%	0.178	16%	0.159	C	C	.	.	H	α-helix	trans	-57.9	-44.1	174.3	-67.6	177.1	-173.4	158.3	0	111.3	L176 V221 S224 S225 D226 L232 A233	L176-K229 HydrophobicContact CD1-CB 3.69Å; L176-K229 HydrophobicContact CD1-CG 4.05Å; V221-K229 HydrophobicContact CG1-CG 4.15Å; V221-K229 WeakPolarHBondContact O-CE 3.43Å; S224-K229 VanDerWaalsContact O-CE 3.27Å; S224-K229 WeakPolarHBondContact O-CE 3.44Å; S224-K229 WeakPolarHBondContact OG-CG 3.37Å; S225-K229 PolarHBondContact O-N 3.41Å; D226-K229 PolarHBondContact O-N 3.36Å; D226-K229 IonicContact OD1-NZ 2.67Å; K229-L232 PolarHBondContact O-N 3.04Å; K229-A233 PolarHBondContact O-N 2.89Å
230	R	97.3	Very high	96	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66	-46.2	179.1	-172.1	59.2	177.4	166.9	0.8	112.2	P171 K172 N174 D226 T227 V228 L232 A233 I234 D248 E249 P250 V254 V262	P171-R230 PolarHBondContact O-NH1 3.37Å; K172-R230 PolarHBondContact O-NH1 2.9Å; N174-R230 WeakPolarHBondContact OD1-CD 3.28Å; D226-R230 WeakPolarHBondContact O-CB 3.38Å; D226-R230 PolarHBondContact O-N 3.12Å; T227-R230 PolarHBondContact O-N 2.87Å; V228-R230 VanDerWaalsContact C-N 3.3Å; V228-R230 PolarHBondContact O-N 3.34Å; R230-L232 VanDerWaalsContact C-N 3.28Å; R230-L232 PolarHBondContact O-N 3.14Å; R230-A233 PolarHBondContact O-N 3.29Å; R230-I234 HydrophobicContact CG-CD1 4.44Å; R230-I234 WeakPolarHBondContact O-CG1 3.35Å; R230-I234 PolarHBondContact O-N 2.94Å; R230-D248 PolarHBondContact NH2-O 2.77Å; R230-E249 VanDerWaalsContact NH2-C 3.28Å; R230-E249 PolarHBondContact NH2-O 3.41Å; R230-P250 VanDerWaalsContact CG-O 3.29Å; R230-P250 WeakPolarHBondContact CG-O 3.4Å; R230-P250 PolarHBondContact NE-O 2.91Å; R230-P250 VanDerWaalsContact NH2-CA 3.34Å; R230-V254 HydrophobicContact CB-CG2 3.74Å; R230-V254 HydrophobicContact CG-CG2 3.84Å; R230-V262 HydrophobicContact CG-CG2 4.34Å
231	K	97.3	Very high	95.5	Very high	19 Å²	19	30.6 Å²	30.6	8%	0.083	17%	0.173	C	C	.	.	H	α-helix	trans	-57.2	-43.1	173.1	-78.2	178.7	158	-156.1	0	111.3	A211 D212 L213 T227 V228 I234 A235 A261 M265	A211-K231 WeakPolarHBondContact O-CD 3.24Å; A211-K231 PolarHBondContact O-NZ 2.73Å; A211-K231 VanDerWaalsContact O-NZ 3.1Å; D212-K231 IonicContact OD2-NZ 3.86Å; L213-K231 HydrophobicContact CD1-CB 3.9Å; L213-K231 HydrophobicContact CD2-CB 4.43Å; L213-K231 HydrophobicContact CD2-CD 4.24Å; L213-K231 HydrophobicContact CG-CB 4.33Å; T227-K231 WeakPolarHBondContact O-CB 3.47Å; T227-K231 WeakPolarHBondContact O-CG 3.37Å; T227-K231 PolarHBondContact O-N 2.91Å; V228-K231 PolarHBondContact O-N 3.1Å; K231-I234 PolarHBondContact O-N 3.2Å; K231-A235 WeakPolarHBondContact O-CB 3.33Å; K231-A235 PolarHBondContact O-N 3.36Å; K231-A261 WeakPolarHBondContact CE-O 3.43Å; K231-M265 HydrophobicContact CB-SD 4.04Å; K231-M265 HydrophobicContact CG-SD 4.01Å; K231-M265 WeakPolarHBondContact O-CE 2.82Å
232	L	97.7	Very high	95.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.1	-41.1	176.3	175.6	57.7	0	0	0	112.2	L176 V182 N185 L186 L213 V221 V228 K229 R230 I234 A235 I236	L176-L232 HydrophobicContact CD1-CD2 4.27Å; L176-L232 HydrophobicContact CD2-CD2 3.99Å; L176-L232 HydrophobicContact CD2-CG 3.85Å; V182-L232 HydrophobicContact CB-CD2 4.41Å; V182-L232 HydrophobicContact CG1-CD1 3.92Å; V182-L232 HydrophobicContact CG1-CD2 4.27Å; V182-L232 HydrophobicContact CG2-CD2 4.29Å; N185-L232 HydrophobicContact CB-CD1 4.43Å; N185-L232 HydrophobicContact CB-CD2 4.09Å; L186-L232 HydrophobicContact CD1-CD1 4.38Å; L186-L232 HydrophobicContact CD2-CD1 3.85Å; L186-L232 HydrophobicContact CG-CD1 3.78Å; L213-L232 HydrophobicContact CD1-CB 4.16Å; V221-L232 HydrophobicContact CG2-CD2 3.52Å; V228-L232 WeakPolarHBondContact O-CB 3.22Å; V228-L232 PolarHBondContact O-N 3.48Å; K229-L232 PolarHBondContact O-N 3.04Å; R230-L232 VanDerWaalsContact C-N 3.28Å; R230-L232 PolarHBondContact O-N 3.14Å; L232-I234 PolarHBondContact O-N 3.46Å; L232-A235 WeakPolarHBondContact O-CB 3.4Å; L232-A235 PolarHBondContact O-N 3Å; L232-A235 VanDerWaalsContact O-N 3.16Å; L232-I236 HydrophobicContact CD1-CD1 4.29Å; L232-I236 HydrophobicContact CD1-CG1 4.28Å; L232-I236 HydrophobicContact CG-CD1 4.23Å; L232-I236 WeakPolarHBondContact O-CG1 3.48Å; L232-I236 PolarHBondContact O-N 3.34Å
233	A	97.3	Very high	95.2	Very high	9 Å²	9	31.5 Å²	31.5	7%	0.074	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-44	176.1	0	0	0	0	0	111.7	L176 K229 R230 A235 I236 A237	L176-A233 HydrophobicContact CD2-CB 4.43Å; K229-A233 PolarHBondContact O-N 2.89Å; R230-A233 PolarHBondContact O-N 3.29Å; A233-A235 VanDerWaalsContact C-N 3.33Å; A233-I236 PolarHBondContact O-N 3.19Å; A233-A237 PolarHBondContact O-N 3.33Å
234	I	97.1	Very high	95.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-39.4	173.7	-60.6	169.3	0	0	0	110.5	C170 R230 K231 L232 I236 A237 L238 I245 I247 V262 M265 I269	C170-I234 HydrophobicContact CB-CG1 4.41Å; R230-I234 HydrophobicContact CG-CD1 4.44Å; R230-I234 WeakPolarHBondContact O-CG1 3.35Å; R230-I234 PolarHBondContact O-N 2.94Å; K231-I234 PolarHBondContact O-N 3.2Å; L232-I234 PolarHBondContact O-N 3.46Å; I234-I236 VanDerWaalsContact C-N 3.33Å; I234-I236 PolarHBondContact O-N 3.36Å; I234-A237 WeakPolarHBondContact O-CB 3.4Å; I234-A237 PolarHBondContact O-N 3.41Å; I234-A237 VanDerWaalsContact O-N 3.11Å; I234-L238 PolarHBondContact O-N 3.2Å; I234-I245 HydrophobicContact CG2-CD1 4.14Å; I234-I247 HydrophobicContact CD1-CG2 4.43Å; I234-I247 HydrophobicContact CG1-CD1 4.48Å; I234-I247 HydrophobicContact CG1-CG2 4.27Å; I234-I247 HydrophobicContact CG2-CD1 3.93Å; I234-V262 HydrophobicContact CD1-CG1 3.75Å; I234-M265 HydrophobicContact CB-CE 3.92Å; I234-M265 HydrophobicContact CB-SD 4.15Å; I234-M265 HydrophobicContact CG2-CE 3.72Å; I234-M265 HydrophobicContact CG2-SD 4.12Å; I234-I269 HydrophobicContact CG2-CD1 3.78Å
235	A	97.1	Very high	95.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60	-41.2	178.1	0	0	0	0	0	112.1	L186 V207 A211 K231 L232 A233 A237 L238 M265	L186-A235 HydrophobicContact CD2-CB 4.04Å; V207-A235 HydrophobicContact CG1-CB 3.5Å; V207-A235 VanDerWaalsContact CG1-CB 3.5Å; V207-A235 VanDerWaalsContact CG1-O 3.25Å; V207-A235 WeakPolarHBondContact CG1-O 3.29Å; A211-A235 HydrophobicContact CB-CB 4.07Å; K231-A235 WeakPolarHBondContact O-CB 3.33Å; K231-A235 PolarHBondContact O-N 3.36Å; L232-A235 WeakPolarHBondContact O-CB 3.4Å; L232-A235 PolarHBondContact O-N 3Å; L232-A235 VanDerWaalsContact O-N 3.16Å; A233-A235 VanDerWaalsContact C-N 3.33Å; A235-A237 VanDerWaalsContact C-N 3.28Å; A235-A237 PolarHBondContact O-N 2.64Å; A235-L238 WeakPolarHBondContact O-CB 3.38Å; A235-L238 PolarHBondContact O-N 2.75Å; A235-M265 HydrophobicContact CB-CE 3.99Å
236	I	96.7	Very high	95.4	Very high	28 Å²	28	22.2 Å²	22.2	14%	0.144	12%	0.121	C	C	.	.	H	α-helix	trans	-59.2	-40.1	174.8	-71.4	159.6	0	0	0	111.2	L176 L186 F189 L232 A233 I234 L238 L239	L176-I236 HydrophobicContact CD2-CD1 3.44Å; L176-I236 VanDerWaalsContact CD2-CD1 3.44Å; L186-I236 HydrophobicContact CD2-CG1 3.9Å; F189-I236 HydrophobicContact CB-CG1 4.37Å; F189-I236 HydrophobicContact CB-CG2 3.59Å; F189-I236 HydrophobicContact CD1-CG2 4.15Å; F189-I236 HydrophobicContact CD2-CD1 3.45Å; F189-I236 VanDerWaalsContact CD2-CD1 3.45Å; F189-I236 HydrophobicContact CD2-CG1 3.92Å; F189-I236 HydrophobicContact CD2-CG2 4.04Å; F189-I236 HydrophobicContact CE2-CD1 3.69Å; F189-I236 HydrophobicContact CG-CD1 4.24Å; F189-I236 HydrophobicContact CG-CG1 4.35Å; F189-I236 HydrophobicContact CG-CG2 3.68Å; L232-I236 HydrophobicContact CD1-CD1 4.29Å; L232-I236 HydrophobicContact CD1-CG1 4.28Å; L232-I236 HydrophobicContact CG-CD1 4.23Å; L232-I236 WeakPolarHBondContact O-CG1 3.48Å; L232-I236 PolarHBondContact O-N 3.34Å; A233-I236 PolarHBondContact O-N 3.19Å; I234-I236 VanDerWaalsContact C-N 3.33Å; I234-I236 PolarHBondContact O-N 3.36Å; I236-L238 PolarHBondContact O-N 2.99Å; I236-L239 WeakPolarHBondContact O-CB 3.34Å; I236-L239 PolarHBondContact O-N 3.15Å
237	A	95.6	Very high	95.6	Very high	7 Å²	7	18 Å²	18	6%	0.058	10%	0.098	C	C	.	.	H	α-helix	trans	-67.2	-17.8	177.5	0	0	0	0	0	113.6	G168 C170 A233 I234 A235 T242 I245	G168-A237 WeakPolarHBondContact CA-O 3.36Å; C170-A237 HydrophobicContact CB-CB 4.07Å; A233-A237 PolarHBondContact O-N 3.33Å; I234-A237 WeakPolarHBondContact O-CB 3.4Å; I234-A237 PolarHBondContact O-N 3.41Å; I234-A237 VanDerWaalsContact O-N 3.11Å; A235-A237 VanDerWaalsContact C-N 3.28Å; A235-A237 PolarHBondContact O-N 2.64Å; A237-T242 PolarHBondContact O-OG1 3.49Å; A237-I245 HydrophobicContact CB-CD1 3.83Å; A237-I245 HydrophobicContact CB-CG1 4.2Å
238	L	95.4	Very high	95.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-83.1	-17.1	176.6	-64.5	171.5	0	0	0	113.7	V207 I210 I234 A235 I236 T242 I245 M265 I269	V207-L238 HydrophobicContact CG1-CB 4.48Å; V207-L238 HydrophobicContact CG2-CB 3.85Å; I210-L238 HydrophobicContact CG2-CD1 3.93Å; I234-L238 PolarHBondContact O-N 3.2Å; A235-L238 WeakPolarHBondContact O-CB 3.38Å; A235-L238 PolarHBondContact O-N 2.75Å; I236-L238 PolarHBondContact O-N 2.99Å; L238-T242 PolarHBondContact O-OG1 3.21Å; L238-I245 HydrophobicContact CD2-CD1 3.6Å; L238-I245 HydrophobicContact CG-CD1 4.03Å; L238-M265 HydrophobicContact CD1-CE 3.93Å; L238-I269 HydrophobicContact CD1-CD1 3.82Å; L238-I269 HydrophobicContact CD1-CG1 3.79Å; L238-I269 HydrophobicContact CD2-CB 4.47Å; L238-I269 HydrophobicContact CD2-CD1 3.96Å; L238-I269 HydrophobicContact CD2-CG1 3.86Å; L238-I269 HydrophobicContact CD2-CG2 3.78Å; L238-I269 HydrophobicContact CG-CD1 4.29Å; L238-I269 HydrophobicContact CG-CG1 4.43Å
239	L	95.1	Very high	95.7	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.005	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	141.5	-176.9	-66.5	170.1	0	0	0	111.4	L186 F189 K193 I195 L200 D203 I204 V207 I236	L186-L239 HydrophobicContact CB-CD1 4.44Å; L186-L239 HydrophobicContact CD2-CD1 4.04Å; L186-L239 HydrophobicContact CD2-CD2 4.37Å; L186-L239 HydrophobicContact CD2-CG 4.35Å; L186-L239 WeakPolarHBondContact O-CD1 3.49Å; F189-L239 HydrophobicContact CB-CD1 4.39Å; K193-L239 WeakPolarHBondContact CD-O 3.42Å; K193-L239 PolarHBondContact NZ-O 3.41Å; I195-L239 HydrophobicContact CD1-CB 3.91Å; L200-L239 HydrophobicContact CD1-CD2 4.34Å; D203-L239 VanDerWaalsContact OD2-CA 3.31Å; D203-L239 WeakPolarHBondContact OD2-CA 3.42Å; I204-L239 HydrophobicContact CG1-CD2 4.29Å; V207-L239 HydrophobicContact CB-CD2 4.48Å; V207-L239 HydrophobicContact CG2-CD2 4.13Å; I236-L239 WeakPolarHBondContact O-CB 3.34Å; I236-L239 PolarHBondContact O-N 3.15Å
240	G	91.2	Very high	95.7	Very high	25 Å²	25	14.7 Å²	14.7	26%	0.258	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	28.1	176.6	0	0	0	0	0	113.8	I195 D203 T242	I195-G240 VanDerWaalsContact CD1-CA 3.42Å; I195-G240 VanDerWaalsContact CD1-N 3.25Å; D203-G240 PolarHBondContact OD2-N 2.96Å; G240-T242 VanDerWaalsContact C-N 3.33Å; G240-T242 PolarHBondContact O-N 2.85Å
241	N	87	Confident	95.6	Very high	115 Å²	115	14.8 Å²	14.8	62%	0.615	8%	0.081	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	48.5	179.4	-167.4	36.5	0	0	0	113.2
242	T	92.9	Very high	95.4	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.006	9%	0.092	C	C	.	.			trans	-60.7	136.9	177.7	50	0	0	0	0	110.8	F166 A237 L238 G240 R273	F166-T242 CarbonylContact O-C 3.57Å; F166-T242 WeakPolarHBondContact O-CA 3.45Å; A237-T242 PolarHBondContact O-OG1 3.49Å; L238-T242 PolarHBondContact O-OG1 3.21Å; G240-T242 VanDerWaalsContact C-N 3.33Å; G240-T242 PolarHBondContact O-N 2.85Å; T242-R273 WeakPolarHBondContact O-CD 3.34Å; T242-R273 WeakPolarHBondContact O-CG 3.4Å; T242-R273 PolarHBondContact O-NE 2.91Å
243	K	94.3	Very high	94.9	Very high	97 Å²	97	19.9 Å²	19.9	42%	0.422	12%	0.119	S	C	.	.	S	Bend	trans	-89.1	-36.4	176.2	-65.6	-171.6	-176.2	175.7	0	111.4	L152 F166 R273 T274	L152-K243 HydrophobicContact CD1-CB 4.5Å; L152-K243 HydrophobicContact CD1-CD 3.77Å; L152-K243 HydrophobicContact CD2-CD 4.04Å; F166-K243 HydrophobicContact CD1-CD 4.34Å; F166-K243 HydrophobicContact CD1-CG 4.36Å; F166-K243 PolarHBondContact O-N 2.97Å; K243-R273 VanDerWaalsContact O-CA 3.31Å; K243-R273 WeakPolarHBondContact O-CA 3.43Å; K243-R273 WeakPolarHBondContact O-CB 3.16Å; K243-T274 PolarHBondContact O-N 3.38Å
244	V	96.4	Very high	94.8	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.4	178.7	-174.4	0	0	0	0	109.1	D88 L89 L151 F166 L167 G168 T274	D88-V244 HydrophobicContact CB-CG2 3.81Å; L89-V244 HydrophobicContact CB-CG1 4.36Å; L89-V244 HydrophobicContact CD2-CG1 4.01Å; L151-V244 HydrophobicContact CD1-CB 3.94Å; L151-V244 HydrophobicContact CD1-CG1 4.35Å; L151-V244 HydrophobicContact CD1-CG2 3.59Å; F166-V244 PolarHBondContact O-N 3.01Å; L167-V244 CarbonylContact C-O 3.55Å; L167-V244 WeakPolarHBondContact CA-O 3.27Å; L167-V244 HydrophobicContact CD1-CB 3.79Å; L167-V244 HydrophobicContact CD1-CG1 3.78Å; G168-V244 PolarHBondContact N-O 3.44Å; V244-T274 CarbonylContact C-O 3.56Å; V244-T274 WeakPolarHBondContact CA-O 3.45Å; V244-T274 HydrophobicContact CG1-CG2 4.37Å
245	I	96.8	Very high	94.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.6	175	-175.8	171.5	0	0	0	110.1	G168 I234 A237 L238 I247 I269 T274 V275 V276	G168-I245 CarbonylContact O-C 3.58Å; G168-I245 WeakPolarHBondContact O-CA 3.18Å; I234-I245 HydrophobicContact CG2-CD1 4.14Å; A237-I245 HydrophobicContact CB-CD1 3.83Å; A237-I245 HydrophobicContact CB-CG1 4.2Å; L238-I245 HydrophobicContact CD2-CD1 3.6Å; L238-I245 HydrophobicContact CG-CD1 4.03Å; I245-I247 HydrophobicContact CD1-CD1 4.14Å; I245-I247 HydrophobicContact CD1-CG1 4.13Å; I245-I247 HydrophobicContact CG1-CD1 4.34Å; I245-I247 HydrophobicContact CG1-CG1 3.92Å; I245-I269 HydrophobicContact CG2-CG2 3.83Å; I245-T274 PolarHBondContact N-O 2.97Å; I245-V275 HydrophobicContact CG2-CB 4.1Å; I245-V275 HydrophobicContact CG2-CG1 4.09Å; I245-V275 HydrophobicContact CG2-CG2 3.7Å; I245-V275 WeakPolarHBondContact O-CA 3.45Å; I245-V276 PolarHBondContact O-N 2.83Å
246	V	97.4	Very high	94.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	122.1	179.1	-179.8	0	0	0	0	108.7	L89 L135 C139 L167 G168 Y169 C170 V276	L89-V246 HydrophobicContact CD2-CG2 4.48Å; L135-V246 HydrophobicContact CB-CG1 3.79Å; L135-V246 HydrophobicContact CD1-CG1 3.73Å; L135-V246 HydrophobicContact CD2-CG1 3.81Å; L135-V246 HydrophobicContact CG-CG1 3.96Å; C139-V246 VanDerWaalsContact SG-CB 3.59Å; L167-V246 HydrophobicContact CD1-CG2 4.05Å; G168-V246 PolarHBondContact O-N 2.98Å; Y169-V246 CarbonylContact C-O 3.56Å; Y169-V246 WeakPolarHBondContact CA-O 3.41Å; Y169-V246 HydrophobicContact CD2-CB 4.2Å; Y169-V246 HydrophobicContact CD2-CG1 4.09Å; Y169-V246 HydrophobicContact CE2-CG1 4.39Å; C170-V246 PolarHBondContact N-O 2.94Å; V246-V276 CarbonylContact C-O 3.44Å; V246-V276 VanDerWaalsContact CA-O 3.24Å; V246-V276 WeakPolarHBondContact CA-O 3.37Å; V246-V276 HydrophobicContact CG2-CB 4.32Å
247	I	97.7	Very high	94	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	115.7	-174.8	-50.9	172.1	0	0	0	109.6	C170 I234 I245 E249 P250 I266 V275 V276 F277 S278	C170-I247 HydrophobicContact CB-CB 4.4Å; C170-I247 HydrophobicContact CB-CG1 4.28Å; C170-I247 HydrophobicContact CB-CG2 4.06Å; I234-I247 HydrophobicContact CD1-CG2 4.43Å; I234-I247 HydrophobicContact CG1-CD1 4.48Å; I234-I247 HydrophobicContact CG1-CG2 4.27Å; I234-I247 HydrophobicContact CG2-CD1 3.93Å; I245-I247 HydrophobicContact CD1-CD1 4.14Å; I245-I247 HydrophobicContact CD1-CG1 4.13Å; I245-I247 HydrophobicContact CG1-CD1 4.34Å; I245-I247 HydrophobicContact CG1-CG1 3.92Å; I247-E249 PolarHBondContact O-N 3.5Å; I247-P250 HydrophobicContact CG2-CB 3.8Å; I247-I266 HydrophobicContact CD1-CD1 4.46Å; I247-I266 HydrophobicContact CD1-CG1 4.3Å; I247-V275 HydrophobicContact CD1-CG1 4.27Å; I247-V276 PolarHBondContact N-O 3.46Å; I247-F277 HydrophobicContact CB-CB 4.07Å; I247-F277 CarbonylContact O-C 3.57Å; I247-F277 WeakPolarHBondContact O-CA 3.41Å; I247-F277 WeakPolarHBondContact O-CB 3Å; I247-S278 PolarHBondContact O-N 2.6Å
248	D	97.1	Very high	93.9	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.011	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	113.4	176.8	-164	26.8	0	0	0	109.9	T132 L135 Y169 C170 K172 R230 S278	T132-D248 WeakPolarHBondContact CG2-OD2 3.05Å; T132-D248 PolarHBondContact OG1-OD1 3.22Å; T132-D248 PolarHBondContact OG1-OD2 2.81Å; L135-D248 HydrophobicContact CD1-CB 4.22Å; Y169-D248 HydrophobicContact CE2-CB 4.41Å; C170-D248 PolarHBondContact O-N 3.49Å; K172-D248 WeakPolarHBondContact CA-O 3.12Å; K172-D248 HydrophobicContact CB-CB 4.37Å; R230-D248 PolarHBondContact NH2-O 2.77Å; D248-S278 VanDerWaalsContact CA-OG 3.29Å; D248-S278 WeakPolarHBondContact CA-OG 3.31Å; D248-S278 PolarHBondContact OD1-OG 3.25Å
249	E	95.2	Very high	93.9	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.019	22%	0.222	C	C	.	.	S	Bend	trans	51.7	73.4	-180	-60.7	-82.9	173.8	0	0	113.1	K131 K172 R230 I247 T251 F252 S278	K131-E249 WeakPolarHBondContact CE-OE1 3.37Å; K131-E249 IonicContact NZ-OE1 2.7Å; K131-E249 PolarHBondContact NZ-OE1 3.15Å; K172-E249 HydrophobicContact CD-CG 4.48Å; K172-E249 HydrophobicContact CG-CB 4.35Å; R230-E249 VanDerWaalsContact NH2-C 3.28Å; R230-E249 PolarHBondContact NH2-O 3.41Å; I247-E249 PolarHBondContact O-N 3.5Å; E249-T251 PolarHBondContact O-N 3.2Å; E249-F252 HydrophobicContact CB-CB 3.81Å; E249-F252 VanDerWaalsContact O-CB 3.29Å; E249-F252 WeakPolarHBondContact O-CB 3.41Å; E249-F252 PolarHBondContact O-N 3.01Å; E249-S278 WeakPolarHBondContact CA-O 3.3Å; E249-S278 PolarHBondContact N-O 3.48Å; E249-S278 VanDerWaalsContact N-O 3.16Å; E249-S278 PolarHBondContact N-OG 2.96Å
250	P	96.2	Very high	93.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.4	-167.9	21.9	-32.4	0	0	0	114.4	R230 I247 V262 I266 F277 S278	R230-P250 VanDerWaalsContact CG-O 3.29Å; R230-P250 WeakPolarHBondContact CG-O 3.4Å; R230-P250 PolarHBondContact NE-O 2.91Å; R230-P250 VanDerWaalsContact NH2-CA 3.34Å; I247-P250 HydrophobicContact CG2-CB 3.8Å; P250-V262 HydrophobicContact CB-CG1 4.2Å; P250-I266 HydrophobicContact CB-CD1 3.69Å; P250-I266 HydrophobicContact CG-CD1 4.17Å; P250-F277 HydrophobicContact CG-CB 4.19Å; P250-F277 HydrophobicContact CG-CD2 3.59Å; P250-F277 HydrophobicContact CG-CE2 4.19Å; P250-F277 HydrophobicContact CG-CG 4.07Å; P250-S278 WeakPolarHBondContact CD-O 3.38Å
251	T	95.1	Very high	94	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.012	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	14.2	178.6	54.5	0	0	0	0	114.3	E249 G253 V254 R259 V262 E284	E249-T251 PolarHBondContact O-N 3.2Å; T251-G253 PolarHBondContact O-N 3.11Å; T251-V254 PolarHBondContact O-N 2.73Å; T251-V254 VanDerWaalsContact O-N 3.1Å; T251-R259 HydrophobicContact CG2-CB 3.79Å; T251-R259 HydrophobicContact CG2-CG 3.65Å; T251-V262 HydrophobicContact CG2-CB 4.19Å; T251-V262 HydrophobicContact CG2-CG1 4.34Å; T251-E284 VanDerWaalsContact CB-OE1 3.26Å; T251-E284 WeakPolarHBondContact CB-OE1 3.38Å; T251-E284 WeakPolarHBondContact CG2-OE1 3.35Å; T251-E284 PolarHBondContact OG1-OE1 2.83Å; T251-E284 PolarHBondContact OG1-OE2 2.8Å
252	F	93	Very high	94.5	Very high	72 Å²	72	40.9 Å²	40.9	32%	0.316	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	129.8	174.3	-171.5	-105.8	0	0	0	111.4	K172 E249 V254	K172-F252 HydrophobicContact CD-CD1 4.29Å; K172-F252 HydrophobicContact CD-CD2 4.41Å; K172-F252 HydrophobicContact CD-CE1 4.36Å; K172-F252 HydrophobicContact CD-CG 4.31Å; K172-F252 HydrophobicContact CD-CZ 4.49Å; K172-F252 HydrophobicContact CG-CB 4.15Å; K172-F252 HydrophobicContact CG-CD1 3.54Å; K172-F252 HydrophobicContact CG-CD2 4.3Å; K172-F252 HydrophobicContact CG-CE1 3.98Å; K172-F252 HydrophobicContact CG-CG 3.72Å; E249-F252 HydrophobicContact CB-CB 3.81Å; E249-F252 VanDerWaalsContact O-CB 3.29Å; E249-F252 WeakPolarHBondContact O-CB 3.41Å; E249-F252 PolarHBondContact O-N 3.01Å; F252-V254 PolarHBondContact O-N 3.08Å
253	G	89.1	Confident	94.6	Very high	55 Å²	55	42.6 Å²	42.6	57%	0.567	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	-3.8	-177.2	0	0	0	0	0	115.4	T251	T251-G253 PolarHBondContact O-N 3.11Å
254	V	93.5	Very high	94.6	Very high	11 Å²	11	41.1 Å²	41.1	7%	0.067	22%	0.219	C	C	.	.	S	Bend	trans	-93	133.2	177.2	-177.5	0	0	0	0	109.8	T227 R230 T251 F252 L258 V262	T227-V254 HydrophobicContact CG2-CG1 4.25Å; R230-V254 HydrophobicContact CB-CG2 3.74Å; R230-V254 HydrophobicContact CG-CG2 3.84Å; T251-V254 PolarHBondContact O-N 2.73Å; T251-V254 VanDerWaalsContact O-N 3.1Å; F252-V254 PolarHBondContact O-N 3.08Å; V254-L258 HydrophobicContact CG1-CB 3.96Å; V254-V262 HydrophobicContact CG2-CG2 4.2Å
255	D	92.4	Very high	94.6	Very high	97 Å²	97	41.3 Å²	41.3	52%	0.519	22%	0.22	S	C	.	.			trans	-55	142.2	175.1	-174	-87.1	0	0	0	111.4	V257 L258 R259	D255-V257 PolarHBondContact O-N 2.95Å; D255-V257 VanDerWaalsContact O-N 3.16Å; D255-V257 WeakPolarHBondContact OD1-CB 3.39Å; D255-V257 WeakPolarHBondContact OD1-CG2 3.34Å; D255-V257 PolarHBondContact OD1-N 3.34Å; D255-L258 HydrophobicContact CB-CB 4.48Å; D255-L258 HydrophobicContact CB-CD1 4.32Å; D255-L258 HydrophobicContact CB-CG 4.36Å; D255-L258 PolarHBondContact O-N 2.86Å; D255-R259 PolarHBondContact O-N 3.25Å
256	R	90.3	Very high	94.6	Very high	198 Å²	198	41.3 Å²	41.3	75%	0.747	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-53.5	-39.6	-176.9	-69.7	-171.6	-174	-149.2	3.1	112.3	L258 R259	R256-L258 PolarHBondContact O-N 2.57Å; R256-R259 WeakPolarHBondContact O-CG 3.07Å
257	V	92.5	Very high	94.4	Very high	110 Å²	110	45.5 Å²	45.5	67%	0.667	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-68.5	-27.7	-178.6	-176.8	0	0	0	0	111.3	D255 H260	D255-V257 PolarHBondContact O-N 2.95Å; D255-V257 VanDerWaalsContact O-N 3.16Å; D255-V257 WeakPolarHBondContact OD1-CB 3.39Å; D255-V257 WeakPolarHBondContact OD1-CG2 3.34Å; D255-V257 PolarHBondContact OD1-N 3.34Å; V257-H260 PolarHBondContact O-CE1 3.28Å; V257-H260 PolarHBondContact O-ND1 3.33Å
258	L	93.8	Very high	94.2	Very high	75 Å²	75	47.9 Å²	47.9	39%	0.393	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-96.7	-0.6	-174.9	-60.6	180	0	0	0	114.3	T227 V254 D255 R256 H260 A261	T227-L258 HydrophobicContact CG2-CB 4.49Å; T227-L258 WeakPolarHBondContact OG1-CD1 3.25Å; V254-L258 HydrophobicContact CG1-CB 3.96Å; D255-L258 HydrophobicContact CB-CB 4.48Å; D255-L258 HydrophobicContact CB-CD1 4.32Å; D255-L258 HydrophobicContact CB-CG 4.36Å; D255-L258 PolarHBondContact O-N 2.86Å; R256-L258 PolarHBondContact O-N 2.57Å; L258-H260 PolarHBondContact O-N 2.9Å; L258-A261 WeakPolarHBondContact O-CB 3.26Å; L258-A261 PolarHBondContact O-N 2.99Å; L258-A261 VanDerWaalsContact O-N 3.11Å
259	R	94.4	Very high	94.2	Very high	12 Å²	12	47.8 Å²	47.8	5%	0.045	26%	0.255	C	S	.	.	H	α-helix	trans	-56.1	-36.1	178	-68.6	-174.1	176.5	178.1	-7.2	113.3	T251 D255 R256 A261 V262 W263 D283	T251-R259 HydrophobicContact CG2-CB 3.79Å; T251-R259 HydrophobicContact CG2-CG 3.65Å; D255-R259 PolarHBondContact O-N 3.25Å; R256-R259 WeakPolarHBondContact O-CG 3.07Å; R259-A261 PolarHBondContact O-N 3.41Å; R259-V262 PolarHBondContact O-N 2.89Å; R259-W263 HydrophobicContact CB-CD2 4.34Å; R259-W263 HydrophobicContact CB-CH2 4.41Å; R259-W263 HydrophobicContact CB-CZ2 3.87Å; R259-W263 VanDerWaalsContact O-CG 3.32Å; R259-W263 PolarHBondContact O-N 2.95Å; R259-D283 IonicContact NH1-OD2 3.6Å
260	H	94.2	Very high	94	Very high	105 Å²	105	49.9 Å²	49.9	49%	0.486	26%	0.264	S	S	.	.	H	α-helix	trans	-55.2	-27.6	178.8	73.8	-87.3	0	0	0	113.3	V257 L258 W263 S264	V257-H260 PolarHBondContact O-CE1 3.28Å; V257-H260 PolarHBondContact O-ND1 3.33Å; L258-H260 PolarHBondContact O-N 2.9Å; H260-W263 HydrophobicContact CB-CE3 4.48Å; H260-S264 WeakPolarHBondContact O-CB 3.22Å; H260-S264 PolarHBondContact O-N 2.98Å; H260-S264 PolarHBondContact O-OG 3.11Å
261	A	95.1	Very high	93.6	Very high	18 Å²	18	58.2 Å²	58.2	15%	0.149	30%	0.3	C	S	.	.	H	α-helix	trans	-71.6	-36.3	177.3	0	0	0	0	0	112.1	T227 K231 L258 R259 M265	T227-A261 HydrophobicContact CG2-CB 4.01Å; K231-A261 WeakPolarHBondContact CE-O 3.43Å; L258-A261 WeakPolarHBondContact O-CB 3.26Å; L258-A261 PolarHBondContact O-N 2.99Å; L258-A261 VanDerWaalsContact O-N 3.11Å; R259-A261 PolarHBondContact O-N 3.41Å; A261-M265 PolarHBondContact O-N 3.41Å
262	V	96.5	Very high	93.4	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-73.6	-40.5	173	178.3	0	0	0	0	110.1	R230 I234 P250 T251 V254 R259 S264 M265 I266	R230-V262 HydrophobicContact CG-CG2 4.34Å; I234-V262 HydrophobicContact CD1-CG1 3.75Å; P250-V262 HydrophobicContact CB-CG1 4.2Å; T251-V262 HydrophobicContact CG2-CB 4.19Å; T251-V262 HydrophobicContact CG2-CG1 4.34Å; V254-V262 HydrophobicContact CG2-CG2 4.2Å; R259-V262 PolarHBondContact O-N 2.89Å; V262-S264 PolarHBondContact O-N 3.49Å; V262-M265 WeakPolarHBondContact O-CB 3.47Å; V262-M265 PolarHBondContact O-N 3.46Å; V262-M265 VanDerWaalsContact O-N 3.1Å; V262-I266 HydrophobicContact CG1-CD1 4.16Å; V262-I266 PolarHBondContact O-N 3.5Å
263	W	95.8	Very high	93.5	Very high	36 Å²	36	62.4 Å²	62.4	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-60.4	-45.2	178.2	-63.4	-7.7	0	0	0	112.4	R259 H260 M265 I266 F267 E284 I287 L288	R259-W263 HydrophobicContact CB-CD2 4.34Å; R259-W263 HydrophobicContact CB-CH2 4.41Å; R259-W263 HydrophobicContact CB-CZ2 3.87Å; R259-W263 VanDerWaalsContact O-CG 3.32Å; R259-W263 PolarHBondContact O-N 2.95Å; H260-W263 HydrophobicContact CB-CE3 4.48Å; W263-M265 PolarHBondContact O-N 2.91Å; W263-I266 PolarHBondContact O-N 3.35Å; W263-I266 VanDerWaalsContact O-N 3.1Å; W263-F267 WeakPolarHBondContact O-CD2 3.35Å; W263-F267 PolarHBondContact O-N 3.32Å; W263-E284 HydrophobicContact CZ2-CB 4.2Å; W263-E284 HydrophobicContact CZ2-CG 4.43Å; W263-E284 PolarHBondContact NE1-OE1 3.12Å; W263-E284 VanDerWaalsContact NE1-OE1 3.14Å; W263-I287 HydrophobicContact CD2-CG2 4.46Å; W263-I287 HydrophobicContact CE3-CD1 4.34Å; W263-I287 HydrophobicContact CE3-CG2 3.94Å; W263-I287 HydrophobicContact CH2-CD1 3.56Å; W263-I287 HydrophobicContact CZ3-CD1 3.47Å; W263-I287 VanDerWaalsContact CZ3-CD1 3.47Å; W263-I287 HydrophobicContact CZ3-CG2 4.14Å; W263-L288 HydrophobicContact CB-CD2 3.6Å; W263-L288 HydrophobicContact CB-CG 4.49Å; W263-L288 HydrophobicContact CG-CD1 4.22Å; W263-L288 HydrophobicContact CG-CD2 3.79Å; W263-L288 HydrophobicContact CG-CG 4.15Å
264	S	95.3	Very high	93.9	Very high	67 Å²	67	59.8 Å²	59.8	47%	0.469	29%	0.29	S	S	.	.	H	α-helix	trans	-57.2	-36.7	174.1	-61.4	0	0	0	0	112.7	H260 V262 S268	H260-S264 WeakPolarHBondContact O-CB 3.22Å; H260-S264 PolarHBondContact O-N 2.98Å; H260-S264 PolarHBondContact O-OG 3.11Å; V262-S264 PolarHBondContact O-N 3.49Å; S264-S268 PolarHBondContact O-N 2.91Å; S264-S268 PolarHBondContact O-OG 3.21Å
265	M	96	Very high	94.1	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-66.9	-46.2	174.8	-176.8	179.5	-177.7	0	0	111	I210 A211 K231 I234 A235 L238 A261 V262 W263 F267 S268 I269	I210-M265 HydrophobicContact CG2-CG 4.47Å; A211-M265 HydrophobicContact CB-CE 3.53Å; A211-M265 HydrophobicContact CB-SD 4Å; K231-M265 HydrophobicContact CB-SD 4.04Å; K231-M265 HydrophobicContact CG-SD 4.01Å; K231-M265 WeakPolarHBondContact O-CE 2.82Å; I234-M265 HydrophobicContact CB-CE 3.92Å; I234-M265 HydrophobicContact CB-SD 4.15Å; I234-M265 HydrophobicContact CG2-CE 3.72Å; I234-M265 HydrophobicContact CG2-SD 4.12Å; A235-M265 HydrophobicContact CB-CE 3.99Å; L238-M265 HydrophobicContact CD1-CE 3.93Å; A261-M265 PolarHBondContact O-N 3.41Å; V262-M265 WeakPolarHBondContact O-CB 3.47Å; V262-M265 PolarHBondContact O-N 3.46Å; V262-M265 VanDerWaalsContact O-N 3.1Å; W263-M265 PolarHBondContact O-N 2.91Å; M265-F267 PolarHBondContact O-N 3.46Å; M265-S268 WeakPolarHBondContact O-CB 3.44Å; M265-S268 PolarHBondContact O-N 3.13Å; M265-I269 HydrophobicContact CE-CD1 4.32Å; M265-I269 HydrophobicContact CG-CD1 4.02Å; M265-I269 VanDerWaalsContact O-CG1 3.28Å; M265-I269 WeakPolarHBondContact O-CG1 3.34Å; M265-I269 PolarHBondContact O-N 2.83Å
266	I	96.4	Very high	94.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-43.7	177.8	-68.4	170.9	0	0	0	111.7	V120 I247 P250 V262 W263 S268 I269 K270 V275 L288	V120-I266 HydrophobicContact CG1-CG2 4.4Å; V120-I266 HydrophobicContact CG2-CG2 4.35Å; I247-I266 HydrophobicContact CD1-CD1 4.46Å; I247-I266 HydrophobicContact CD1-CG1 4.3Å; P250-I266 HydrophobicContact CB-CD1 3.69Å; P250-I266 HydrophobicContact CG-CD1 4.17Å; V262-I266 HydrophobicContact CG1-CD1 4.16Å; V262-I266 PolarHBondContact O-N 3.5Å; W263-I266 PolarHBondContact O-N 3.35Å; W263-I266 VanDerWaalsContact O-N 3.1Å; I266-S268 PolarHBondContact O-N 2.7Å; I266-I269 WeakPolarHBondContact O-CB 3.47Å; I266-I269 PolarHBondContact O-N 2.95Å; I266-I269 VanDerWaalsContact O-N 3.13Å; I266-K270 PolarHBondContact O-N 3.28Å; I266-V275 HydrophobicContact CG2-CG1 4.2Å; I266-L288 HydrophobicContact CB-CD2 4.35Å; I266-L288 HydrophobicContact CD1-CD1 3.78Å; I266-L288 HydrophobicContact CG2-CD2 4.31Å
267	F	93.4	Very high	94.7	Very high	89 Å²	89	45.2 Å²	45.2	39%	0.39	23%	0.227	S	C	.	.	H	α-helix	trans	-60.4	-34.6	174.1	-75	-57.9	0	0	0	113.1	W263 M265 I287 L288	W263-F267 WeakPolarHBondContact O-CD2 3.35Å; W263-F267 PolarHBondContact O-N 3.32Å; M265-F267 PolarHBondContact O-N 3.46Å; F267-I287 HydrophobicContact CZ-CG2 4.43Å; F267-I287 WeakPolarHBondContact CZ-O 3.33Å; F267-L288 HydrophobicContact CD2-CD2 4.27Å; F267-L288 HydrophobicContact CE1-CD2 4.48Å; F267-L288 HydrophobicContact CE2-CD2 3.79Å; F267-L288 HydrophobicContact CZ-CD2 3.92Å
268	S	94	Very high	94.9	Very high	50 Å²	50	40 Å²	40	35%	0.35	20%	0.195	S	C	.	.	H	α-helix	trans	-70.8	-35.3	176.7	-60.8	0	0	0	0	112	S264 M265 I266	S264-S268 PolarHBondContact O-N 2.91Å; S264-S268 PolarHBondContact O-OG 3.21Å; M265-S268 WeakPolarHBondContact O-CB 3.44Å; M265-S268 PolarHBondContact O-N 3.13Å; I266-S268 PolarHBondContact O-N 2.7Å
269	I	95.2	Very high	95	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-67.6	-47.6	177.3	-67.5	165.6	0	0	0	111.3	I210 I234 L238 I245 M265 I266 K271 K272 R273 V275	I210-I269 HydrophobicContact CG2-CG1 3.72Å; I234-I269 HydrophobicContact CG2-CD1 3.78Å; L238-I269 HydrophobicContact CD1-CD1 3.82Å; L238-I269 HydrophobicContact CD1-CG1 3.79Å; L238-I269 HydrophobicContact CD2-CB 4.47Å; L238-I269 HydrophobicContact CD2-CD1 3.96Å; L238-I269 HydrophobicContact CD2-CG1 3.86Å; L238-I269 HydrophobicContact CD2-CG2 3.78Å; L238-I269 HydrophobicContact CG-CD1 4.29Å; L238-I269 HydrophobicContact CG-CG1 4.43Å; I245-I269 HydrophobicContact CG2-CG2 3.83Å; M265-I269 HydrophobicContact CE-CD1 4.32Å; M265-I269 HydrophobicContact CG-CD1 4.02Å; M265-I269 VanDerWaalsContact O-CG1 3.28Å; M265-I269 WeakPolarHBondContact O-CG1 3.34Å; M265-I269 PolarHBondContact O-N 2.83Å; I266-I269 WeakPolarHBondContact O-CB 3.47Å; I266-I269 PolarHBondContact O-N 2.95Å; I266-I269 VanDerWaalsContact O-N 3.13Å; I269-K271 PolarHBondContact O-N 3.33Å; I269-K272 PolarHBondContact O-N 2.55Å; I269-R273 HydrophobicContact CG2-CB 4.19Å; I269-R273 PolarHBondContact O-N 3.28Å; I269-V275 HydrophobicContact CB-CG2 4.42Å; I269-V275 HydrophobicContact CG2-CG2 3.69Å
270	K	91.7	Very high	95	Very high	48 Å²	48	38.8 Å²	38.8	21%	0.209	19%	0.188	C	C	.	.	H	α-helix	trans	-48.9	-35.6	-177.5	176.9	-169.7	176.9	174.9	0	113.5	G118 V120 I266 K272 R273 D290	G118-K270 VanDerWaalsContact O-CE 3.27Å; G118-K270 WeakPolarHBondContact O-CE 3.44Å; G118-K270 WeakPolarHBondContact O-CG 3.44Å; V120-K270 HydrophobicContact CG2-CB 3.72Å; V120-K270 HydrophobicContact CG2-CD 3.58Å; V120-K270 HydrophobicContact CG2-CG 3.64Å; I266-K270 PolarHBondContact O-N 3.28Å; K270-K272 PolarHBondContact O-N 2.95Å; K270-R273 PolarHBondContact O-N 3.34Å; K270-R273 VanDerWaalsContact O-O 3.1Å; K270-D290 WeakPolarHBondContact CE-OD2 3.46Å; K270-D290 IonicContact NZ-OD1 3.53Å; K270-D290 PolarHBondContact NZ-OD1 2.95Å; K270-D290 IonicContact NZ-OD2 3.97Å; K270-D290 PolarHBondContact NZ-OD2 2.88Å
271	K	89.2	Confident	94.9	Very high	174 Å²	174	36.7 Å²	36.7	76%	0.757	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-22.9	-175.7	-68.1	-179.2	179.7	177.1	0	115	I269	I269-K271 PolarHBondContact O-N 3.33Å
272	K	90.6	Very high	94.7	Very high	154 Å²	154	37 Å²	37	67%	0.67	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-134.2	2.4	-178.1	-62.3	-176.1	-178.4	176.6	0	113.7	E206 I269 K270	E206-K272 IonicContact OE1-NZ 3.45Å; I269-K272 PolarHBondContact O-N 2.55Å; K270-K272 PolarHBondContact O-N 2.95Å
273	R	94.5	Very high	94.5	Very high	8 Å²	8	40.4 Å²	40.4	3%	0.03	19%	0.194	C	C	.	.	S	Bend	trans	-147	151.6	-165.4	-62.6	-177.2	-178.3	84.3	-1.8	111.2	T242 K243 I269 K270	T242-R273 WeakPolarHBondContact O-CD 3.34Å; T242-R273 WeakPolarHBondContact O-CG 3.4Å; T242-R273 PolarHBondContact O-NE 2.91Å; K243-R273 VanDerWaalsContact O-CA 3.31Å; K243-R273 WeakPolarHBondContact O-CA 3.43Å; K243-R273 WeakPolarHBondContact O-CB 3.16Å; I269-R273 HydrophobicContact CG2-CB 4.19Å; I269-R273 PolarHBondContact O-N 3.28Å; K270-R273 PolarHBondContact O-N 3.34Å; K270-R273 VanDerWaalsContact O-O 3.1Å
274	T	96.5	Very high	94.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126.1	168.8	-59.2	0	0	0	0	109.1	D88 F115 Y116 A117 G118 K243 V244 I245	D88-T274 HydrophobicContact CB-CG2 4.26Å; D88-T274 PolarHBondContact OD2-OG1 3.5Å; F115-T274 HydrophobicContact CB-CG2 4.24Å; Y116-T274 WeakPolarHBondContact O-CG2 3.35Å; Y116-T274 PolarHBondContact O-OG1 3.36Å; A117-T274 VanDerWaalsContact CA-OG1 3.22Å; A117-T274 WeakPolarHBondContact CA-OG1 3.36Å; G118-T274 PolarHBondContact N-OG1 2.91Å; K243-T274 PolarHBondContact O-N 3.38Å; V244-T274 CarbonylContact C-O 3.56Å; V244-T274 WeakPolarHBondContact CA-O 3.45Å; V244-T274 HydrophobicContact CG1-CG2 4.37Å; I245-T274 PolarHBondContact N-O 2.97Å
275	V	97.5	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.3	-178.9	-176.9	0	0	0	0	108.7	E119 V120 T121 I245 I247 I266 I269	E119-V275 PolarHBondContact O-N 2.98Å; V120-V275 CarbonylContact C-O 3.49Å; V120-V275 VanDerWaalsContact CA-O 3.31Å; V120-V275 WeakPolarHBondContact CA-O 3.38Å; V120-V275 HydrophobicContact CB-CB 4.38Å; V120-V275 HydrophobicContact CG1-CB 4.23Å; V120-V275 HydrophobicContact CG1-CG1 4.25Å; V120-V275 HydrophobicContact CG2-CB 3.97Å; V120-V275 HydrophobicContact CG2-CG2 4.22Å; T121-V275 PolarHBondContact N-O 3.38Å; I245-V275 HydrophobicContact CG2-CB 4.1Å; I245-V275 HydrophobicContact CG2-CG1 4.09Å; I245-V275 HydrophobicContact CG2-CG2 3.7Å; I245-V275 WeakPolarHBondContact O-CA 3.45Å; I247-V275 HydrophobicContact CD1-CG1 4.27Å; I266-V275 HydrophobicContact CG2-CG1 4.2Å; I269-V275 HydrophobicContact CB-CG2 4.42Å; I269-V275 HydrophobicContact CG2-CG2 3.69Å
276	V	97.9	Very high	94.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.3	166.7	-171.7	0	0	0	0	107.6	L89 F115 T121 V123 L135 M138 I245 V246 I247	L89-V276 HydrophobicContact CD2-CG2 4.42Å; F115-V276 HydrophobicContact CB-CG2 4.1Å; F115-V276 HydrophobicContact CD1-CB 4.31Å; F115-V276 HydrophobicContact CD1-CG1 3.98Å; F115-V276 HydrophobicContact CD1-CG2 3.37Å; F115-V276 HydrophobicContact CD2-CG2 4.47Å; F115-V276 HydrophobicContact CE1-CB 4.35Å; F115-V276 HydrophobicContact CE1-CG1 3.54Å; F115-V276 HydrophobicContact CE1-CG2 3.84Å; F115-V276 HydrophobicContact CG-CG2 3.73Å; F115-V276 HydrophobicContact CZ-CG1 4.17Å; T121-V276 WeakPolarHBondContact O-CA 3.29Å; V123-V276 HydrophobicContact CG2-CG1 3.92Å; L135-V276 HydrophobicContact CD2-CG1 3.98Å; M138-V276 HydrophobicContact CE-CB 4.42Å; M138-V276 HydrophobicContact CE-CG1 4.03Å; M138-V276 HydrophobicContact CE-CG2 4.18Å; I245-V276 PolarHBondContact O-N 2.83Å; V246-V276 CarbonylContact C-O 3.44Å; V246-V276 VanDerWaalsContact CA-O 3.24Å; V246-V276 WeakPolarHBondContact CA-O 3.37Å; V246-V276 HydrophobicContact CG2-CB 4.32Å; I247-V276 PolarHBondContact N-O 3.46Å
277	F	98	Very high	93.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147	172.1	74.9	-90.4	0	0	0	111.7	V120 T121 A122 V123 I247 P250 T279 E284 L288 A289	V120-F277 HydrophobicContact CG1-CD1 3.67Å; V120-F277 HydrophobicContact CG1-CE1 3.47Å; V120-F277 VanDerWaalsContact CG1-CE1 3.47Å; T121-F277 PolarHBondContact O-N 2.78Å; A122-F277 CarbonylContact C-O 3.59Å; A122-F277 WeakPolarHBondContact CA-O 3.47Å; A122-F277 HydrophobicContact CB-CD1 4.49Å; A122-F277 HydrophobicContact CB-CE1 3.83Å; A122-F277 HydrophobicContact CB-CE2 3.88Å; A122-F277 HydrophobicContact CB-CZ 3.5Å; A122-F277 VanDerWaalsContact CB-CZ 3.5Å; V123-F277 PolarHBondContact N-O 3.37Å; I247-F277 HydrophobicContact CB-CB 4.07Å; I247-F277 CarbonylContact O-C 3.57Å; I247-F277 WeakPolarHBondContact O-CA 3.41Å; I247-F277 WeakPolarHBondContact O-CB 3Å; P250-F277 HydrophobicContact CG-CB 4.19Å; P250-F277 HydrophobicContact CG-CD2 3.59Å; P250-F277 HydrophobicContact CG-CE2 4.19Å; P250-F277 HydrophobicContact CG-CG 4.07Å; F277-T279 HydrophobicContact CD2-CG2 4.27Å; F277-T279 HydrophobicContact CE2-CG2 3.63Å; F277-E284 HydrophobicContact CE2-CG 3.94Å; F277-E284 HydrophobicContact CZ-CG 4.34Å; F277-L288 HydrophobicContact CE1-CB 3.77Å; F277-L288 HydrophobicContact CE1-CD1 4.09Å; F277-L288 HydrophobicContact CE2-CD1 4.32Å; F277-L288 HydrophobicContact CZ-CB 3.76Å; F277-L288 HydrophobicContact CZ-CD1 3.83Å; F277-L288 HydrophobicContact CZ-CG 4.43Å; F277-A289 HydrophobicContact CE1-CB 4.18Å; F277-A289 HydrophobicContact CZ-CB 4.41Å
278	S	97.5	Very high	93.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	146.2	169.8	64.8	0	0	0	0	109.8	V123 I247 D248 E249 P250	V123-S278 WeakPolarHBondContact O-CA 3.4Å; I247-S278 PolarHBondContact O-N 2.6Å; D248-S278 VanDerWaalsContact CA-OG 3.29Å; D248-S278 WeakPolarHBondContact CA-OG 3.31Å; D248-S278 PolarHBondContact OD1-OG 3.25Å; E249-S278 WeakPolarHBondContact CA-O 3.3Å; E249-S278 PolarHBondContact N-O 3.48Å; E249-S278 VanDerWaalsContact N-O 3.16Å; E249-S278 PolarHBondContact N-OG 2.96Å; P250-S278 WeakPolarHBondContact CD-O 3.38Å
279	T	96	Very high	93.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	156.1	169.3	-170.2	0	0	0	0	111.3	V123 L124 G125 K131 F277 Y281 E284 A285	V123-T279 PolarHBondContact O-N 2.84Å; L124-T279 WeakPolarHBondContact CA-O 3.16Å; L124-T279 HydrophobicContact CD1-CG2 3.95Å; G125-T279 PolarHBondContact N-O 3.16Å; K131-T279 WeakPolarHBondContact CD-O 3.46Å; K131-T279 WeakPolarHBondContact CE-O 3.4Å; F277-T279 HydrophobicContact CD2-CG2 4.27Å; F277-T279 HydrophobicContact CE2-CG2 3.63Å; T279-Y281 WeakPolarHBondContact CG2-O 3.39Å; T279-Y281 WeakPolarHBondContact OG1-CB 3.44Å; T279-Y281 PolarHBondContact OG1-N 3.17Å; T279-E284 WeakPolarHBondContact CB-OE2 3.21Å; T279-E284 PolarHBondContact OG1-OE2 2.83Å; T279-A285 HydrophobicContact CG2-CB 3.91Å
280	Q	93.4	Very high	93.8	Very high	63 Å²	63	38 Å²	38	29%	0.294	18%	0.177	S	C	.	.	S	Bend	trans	-101.5	-5.5	163.1	62.2	175.9	-7.9	0	0	112.4	N127	N127-Q280 VanDerWaalsContact CG-OE1 3.25Å; N127-Q280 PolarHBondContact ND2-OE1 3.04Å; N127-Q280 PolarHBondContact OD1-OE1 3.45Å; N127-Q280 VanDerWaalsContact OD1-OE1 3.13Å
281	Y	92.5	Very high	93.9	Very high	60 Å²	60	35.9 Å²	35.9	24%	0.235	17%	0.168	C	C	.	.			trans	-95.7	117.2	-175.2	-58.7	-58.4	0	0	0	109.8	T279 D283 E284 A285	T279-Y281 WeakPolarHBondContact CG2-O 3.39Å; T279-Y281 WeakPolarHBondContact OG1-CB 3.44Å; T279-Y281 PolarHBondContact OG1-N 3.17Å; Y281-D283 WeakPolarHBondContact CB-OD1 3.29Å; Y281-E284 PolarHBondContact O-N 3.42Å; Y281-A285 PolarHBondContact O-N 3.23Å; Y281-A285 VanDerWaalsContact O-N 3.17Å
282	L	91.2	Very high	94.2	Very high	25 Å²	25	27.6 Å²	27.6	13%	0.131	13%	0.132	C	C	.	.	H	α-helix	trans	-70.2	-41.2	-175.8	-174.6	132.1	0	0	0	112.2	L124 E284 A285 E286 L398 E399 M402	L124-L282 HydrophobicContact CD2-CD1 4.34Å; L282-E284 VanDerWaalsContact C-N 3.28Å; L282-E284 PolarHBondContact O-N 3.08Å; L282-A285 PolarHBondContact O-N 3.14Å; L282-E286 WeakPolarHBondContact O-CB 3.4Å; L282-E286 PolarHBondContact O-N 2.96Å; L282-L398 HydrophobicContact CD1-CB 4.04Å; L282-L398 HydrophobicContact CD1-CD2 4.06Å; L282-L398 HydrophobicContact CD1-CG 3.81Å; L282-L398 HydrophobicContact CD2-CB 4.19Å; L282-L398 HydrophobicContact CD2-CD2 4.32Å; L282-L398 HydrophobicContact CG-CB 4.29Å; L282-L398 HydrophobicContact CG-CD2 3.84Å; L282-L398 HydrophobicContact CG-CG 4.13Å; L282-E399 HydrophobicContact CD1-CB 4.29Å; L282-E399 HydrophobicContact CD1-CG 3.7Å; L282-E399 HydrophobicContact CD2-CG 3.68Å; L282-E399 HydrophobicContact CG-CG 4.24Å; L282-M402 HydrophobicContact CD1-SD 4.35Å
283	D	91.2	Very high	94.4	Very high	72 Å²	72	20.4 Å²	20.4	39%	0.385	10%	0.102	S	C	.	.	H	α-helix	trans	-56.4	-41.9	173.1	59.6	-35.2	0	0	0	111.8	R259 Y281 E286 I287	R259-D283 IonicContact NH1-OD2 3.6Å; Y281-D283 WeakPolarHBondContact CB-OD1 3.29Å; D283-E286 PolarHBondContact O-N 3.2Å; D283-I287 WeakPolarHBondContact O-CB 3.12Å; D283-I287 WeakPolarHBondContact O-CD1 3.48Å; D283-I287 WeakPolarHBondContact O-CG1 3.2Å; D283-I287 PolarHBondContact O-N 2.92Å
284	E	93.2	Very high	94.4	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.2	-43.9	176.8	-179.6	170.2	-107.9	0	0	112.6	T251 W263 F277 T279 Y281 L282 E286 L288	T251-E284 VanDerWaalsContact CB-OE1 3.26Å; T251-E284 WeakPolarHBondContact CB-OE1 3.38Å; T251-E284 WeakPolarHBondContact CG2-OE1 3.35Å; T251-E284 PolarHBondContact OG1-OE1 2.83Å; T251-E284 PolarHBondContact OG1-OE2 2.8Å; W263-E284 HydrophobicContact CZ2-CB 4.2Å; W263-E284 HydrophobicContact CZ2-CG 4.43Å; W263-E284 PolarHBondContact NE1-OE1 3.12Å; W263-E284 VanDerWaalsContact NE1-OE1 3.14Å; F277-E284 HydrophobicContact CE2-CG 3.94Å; F277-E284 HydrophobicContact CZ-CG 4.34Å; T279-E284 WeakPolarHBondContact CB-OE2 3.21Å; T279-E284 PolarHBondContact OG1-OE2 2.83Å; Y281-E284 PolarHBondContact O-N 3.42Å; L282-E284 VanDerWaalsContact C-N 3.28Å; L282-E284 PolarHBondContact O-N 3.08Å; E284-E286 VanDerWaalsContact C-N 3.34Å; E284-L288 HydrophobicContact CG-CD1 3.74Å; E284-L288 HydrophobicContact CG-CG 4.47Å; E284-L288 VanDerWaalsContact O-CB 3.32Å; E284-L288 WeakPolarHBondContact O-CB 3.37Å; E284-L288 WeakPolarHBondContact O-CG 3.14Å; E284-L288 PolarHBondContact O-N 3.02Å
285	A	94.3	Very high	94.2	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.1	-45.3	176.3	0	0	0	0	0	111.1	A122 L124 T279 Y281 L282 A289 I292	A122-A285 HydrophobicContact CB-CB 3.77Å; L124-A285 HydrophobicContact CD1-CB 4.28Å; L124-A285 HydrophobicContact CD2-CB 4.42Å; T279-A285 HydrophobicContact CG2-CB 3.91Å; Y281-A285 PolarHBondContact O-N 3.23Å; Y281-A285 VanDerWaalsContact O-N 3.17Å; L282-A285 PolarHBondContact O-N 3.14Å; A285-A289 WeakPolarHBondContact O-CB 3.29Å; A285-A289 PolarHBondContact O-N 3.07Å; A285-I292 HydrophobicContact CB-CG1 4.3Å
286	E	91	Very high	94	Very high	49 Å²	49	21.1 Å²	21.1	23%	0.229	11%	0.108	C	C	.	.	H	α-helix	trans	-69.7	-35	-177.5	-177.6	166.4	-154.1	0	0	113.4	Q4 L282 D283 E284 L398	Q4-E286 PolarHBondContact NE2-OE1 3.1Å; Q4-E286 PolarHBondContact OE1-OE1 3.12Å; Q4-E286 VanDerWaalsContact OE1-OE1 3.11Å; L282-E286 WeakPolarHBondContact O-CB 3.4Å; L282-E286 PolarHBondContact O-N 2.96Å; D283-E286 PolarHBondContact O-N 3.2Å; E284-E286 VanDerWaalsContact C-N 3.34Å; E286-L398 HydrophobicContact CB-CD2 4.39Å
287	I	92.1	Very high	93.6	Very high	76 Å²	76	23.4 Å²	23.4	39%	0.39	13%	0.131	S	C	.	.	H	α-helix	trans	-77	-42.5	179.1	-70.7	167.5	0	0	0	111.6	W263 F267 D283	W263-I287 HydrophobicContact CD2-CG2 4.46Å; W263-I287 HydrophobicContact CE3-CD1 4.34Å; W263-I287 HydrophobicContact CE3-CG2 3.94Å; W263-I287 HydrophobicContact CH2-CD1 3.56Å; W263-I287 HydrophobicContact CZ3-CD1 3.47Å; W263-I287 VanDerWaalsContact CZ3-CD1 3.47Å; W263-I287 HydrophobicContact CZ3-CG2 4.14Å; F267-I287 HydrophobicContact CZ-CG2 4.43Å; F267-I287 WeakPolarHBondContact CZ-O 3.33Å; D283-I287 WeakPolarHBondContact O-CB 3.12Å; D283-I287 WeakPolarHBondContact O-CD1 3.48Å; D283-I287 WeakPolarHBondContact O-CG1 3.2Å; D283-I287 PolarHBondContact O-N 2.92Å
288	L	93	Very high	93.3	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-91.4	-35.5	-169.9	-70.5	179.6	0	0	0	114.4	V120 W263 I266 F267 F277 E284	V120-L288 WeakPolarHBondContact CB-O 3.41Å; V120-L288 WeakPolarHBondContact CG1-O 3.14Å; W263-L288 HydrophobicContact CB-CD2 3.6Å; W263-L288 HydrophobicContact CB-CG 4.49Å; W263-L288 HydrophobicContact CG-CD1 4.22Å; W263-L288 HydrophobicContact CG-CD2 3.79Å; W263-L288 HydrophobicContact CG-CG 4.15Å; I266-L288 HydrophobicContact CB-CD2 4.35Å; I266-L288 HydrophobicContact CD1-CD1 3.78Å; I266-L288 HydrophobicContact CG2-CD2 4.31Å; F267-L288 HydrophobicContact CD2-CD2 4.27Å; F267-L288 HydrophobicContact CE1-CD2 4.48Å; F267-L288 HydrophobicContact CE2-CD2 3.79Å; F267-L288 HydrophobicContact CZ-CD2 3.92Å; F277-L288 HydrophobicContact CE1-CB 3.77Å; F277-L288 HydrophobicContact CE1-CD1 4.09Å; F277-L288 HydrophobicContact CE2-CD1 4.32Å; F277-L288 HydrophobicContact CZ-CB 3.76Å; F277-L288 HydrophobicContact CZ-CD1 3.83Å; F277-L288 HydrophobicContact CZ-CG 4.43Å; E284-L288 HydrophobicContact CG-CD1 3.74Å; E284-L288 HydrophobicContact CG-CG 4.47Å; E284-L288 VanDerWaalsContact O-CB 3.32Å; E284-L288 WeakPolarHBondContact O-CB 3.37Å; E284-L288 WeakPolarHBondContact O-CG 3.14Å; E284-L288 PolarHBondContact O-N 3.02Å
289	A	94.3	Very high	93.1	Very high	11 Å²	11	26.7 Å²	26.7	9%	0.091	15%	0.147	C	C	.	.			trans	-93	137.2	-163	0	0	0	0	0	111.9	V120 A122 F277 A285 R291 I292	V120-A289 HydrophobicContact CG1-CB 4.41Å; V120-A289 CarbonylContact O-C 3.59Å; V120-A289 WeakPolarHBondContact O-CA 3.2Å; A122-A289 HydrophobicContact CB-CB 3.57Å; F277-A289 HydrophobicContact CE1-CB 4.18Å; F277-A289 HydrophobicContact CZ-CB 4.41Å; A285-A289 WeakPolarHBondContact O-CB 3.29Å; A285-A289 PolarHBondContact O-N 3.07Å; A289-R291 VanDerWaalsContact C-N 3.28Å; A289-R291 VanDerWaalsContact CB-O 3.25Å; A289-R291 WeakPolarHBondContact CB-O 3.24Å; A289-I292 HydrophobicContact CB-CG1 4.17Å
290	D	93.5	Very high	92.9	Very high	55 Å²	55	27.9 Å²	27.9	29%	0.294	15%	0.153	S	C	.	.	S	Bend	trans	-73.8	-31.3	164.5	-57	-68.5	0	0	0	110.4	E119 V120 K270 S305	E119-D290 HydrophobicContact CB-CB 4.34Å; E119-D290 HydrophobicContact CG-CB 4.45Å; V120-D290 PolarHBondContact N-OD2 3.49Å; V120-D290 PolarHBondContact O-N 3.22Å; K270-D290 WeakPolarHBondContact CE-OD2 3.46Å; K270-D290 IonicContact NZ-OD1 3.53Å; K270-D290 PolarHBondContact NZ-OD1 2.95Å; K270-D290 IonicContact NZ-OD2 3.97Å; K270-D290 PolarHBondContact NZ-OD2 2.88Å; D290-S305 WeakPolarHBondContact O-CA 3.27Å
291	R	94.3	Very high	92.8	Very high	5 Å²	5	26 Å²	26	2%	0.019	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	144.3	-176.3	-58.8	-176.7	65	77.6	-1.4	111	E81 E119 V120 T121 A122 A289 G304	E81-R291 PolarHBondContact O-NH2 2.95Å; E81-R291 IonicContact OE2-CZ 3.21Å; E81-R291 IonicContact OE2-NH1 2.57Å; E81-R291 PolarHBondContact OE2-NH1 3.46Å; E81-R291 IonicContact OE2-NH2 3.56Å; E119-R291 WeakPolarHBondContact OE2-CD 3.48Å; V120-R291 PolarHBondContact O-N 2.84Å; T121-R291 CarbonylContact C-O 3.52Å; T121-R291 VanDerWaalsContact CA-O 3.26Å; T121-R291 WeakPolarHBondContact CA-O 3.43Å; T121-R291 HydrophobicContact CG2-CB 4.25Å; A122-R291 PolarHBondContact N-O 3.09Å; A289-R291 VanDerWaalsContact C-N 3.28Å; A289-R291 VanDerWaalsContact CB-O 3.25Å; A289-R291 WeakPolarHBondContact CB-O 3.24Å; R291-G304 CarbonylContact C-O 3.46Å; R291-G304 WeakPolarHBondContact CA-O 3.38Å
292	I	95	Very high	92.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.3	179.3	-63.2	154.2	0	0	0	108	A122 L124 A285 A289 I294 S303 G304 L309 L398	A122-I292 HydrophobicContact CB-CG1 4.3Å; A122-I292 CarbonylContact O-C 3.57Å; A122-I292 WeakPolarHBondContact O-CA 3.32Å; L124-I292 HydrophobicContact CB-CG2 3.88Å; L124-I292 HydrophobicContact CD2-CG2 4.07Å; A285-I292 HydrophobicContact CB-CG1 4.3Å; A289-I292 HydrophobicContact CB-CG1 4.17Å; I292-I294 HydrophobicContact CG2-CG1 3.96Å; I292-S303 CarbonylContact O-C 3.45Å; I292-S303 WeakPolarHBondContact O-CA 3.31Å; I292-G304 PolarHBondContact N-O 2.87Å; I292-G304 PolarHBondContact O-N 2.62Å; I292-L309 HydrophobicContact CB-CD1 3.73Å; I292-L309 HydrophobicContact CG2-CD1 4.11Å; I292-L398 HydrophobicContact CD1-CD1 4.03Å; I292-L398 HydrophobicContact CD1-CD2 3.42Å; I292-L398 VanDerWaalsContact CD1-CD2 3.42Å; I292-L398 HydrophobicContact CD1-CG 4.38Å
293	A	95.3	Very high	92.8	Very high	3 Å²	3	22.7 Å²	22.7	3%	0.025	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	107.7	175.6	0	0	0	0	0	108.4	T121 A122 V123 L124 L300 C302	T121-A293 HydrophobicContact CG2-CB 4.42Å; A122-A293 PolarHBondContact O-N 3.25Å; V123-A293 CarbonylContact C-O 3.54Å; V123-A293 WeakPolarHBondContact CA-O 3.32Å; L124-A293 PolarHBondContact N-O 2.82Å; A293-L300 HydrophobicContact CB-CD1 3.75Å; A293-C302 CarbonylContact C-O 3.5Å; A293-C302 WeakPolarHBondContact CA-O 3.38Å
294	I	94.3	Very high	92.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	115.7	-175.7	-60.9	-177.8	0	0	0	109.8	L124 I292 K301 C302 L398 V401 M402	L124-I294 HydrophobicContact CD2-CG1 4.42Å; L124-I294 CarbonylContact O-C 3.54Å; L124-I294 WeakPolarHBondContact O-CA 3.4Å; I292-I294 HydrophobicContact CG2-CG1 3.96Å; I294-K301 PolarHBondContact O-N 2.7Å; I294-C302 PolarHBondContact N-O 2.79Å; I294-L398 HydrophobicContact CD1-CD1 4.38Å; I294-V401 HydrophobicContact CD1-CB 4.42Å; I294-V401 HydrophobicContact CD1-CG1 3.91Å; I294-M402 HydrophobicContact CD1-CB 4.5Å
295	I	93.6	Very high	92.5	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.1	178.5	-166.4	176.7	0	0	0	111.8	L108 V123 L124 S129 K131 L134 E299	L108-I295 HydrophobicContact CD2-CD1 3.73Å; V123-I295 HydrophobicContact CG1-CG2 3.93Å; L124-I295 PolarHBondContact O-N 3.43Å; S129-I295 WeakPolarHBondContact CB-O 3.18Å; K131-I295 HydrophobicContact CD-CG2 4.5Å; K131-I295 HydrophobicContact CG-CG2 3.64Å; L134-I295 HydrophobicContact CD2-CD1 4.24Å; I295-E299 WeakPolarHBondContact CA-O 3.37Å; I295-E299 WeakPolarHBondContact CG1-O 3.46Å
296	S	92.4	Very high	92.1	Very high	22 Å²	22	21.6 Å²	21.6	15%	0.154	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	132.9	177.7	-175.4	0	0	0	0	111.5	G298 E299 K301	S296-G298 PolarHBondContact O-N 2.67Å; S296-E299 PolarHBondContact N-O 2.85Å; S296-E299 PolarHBondContact O-N 2.97Å; S296-E299 VanDerWaalsContact O-N 3.14Å; S296-K301 WeakPolarHBondContact O-CE 3.39Å
297	G	89.2	Confident	91.5	Very high	48 Å²	48	21.1 Å²	21.1	50%	0.495	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	27	179.7	0	0	0	0	0	114.5	E299	G297-E299 VanDerWaalsContact C-N 3.34Å
298	G	91.5	Very high	91.1	Very high	2 Å²	2	18.6 Å²	18.6	2%	0.021	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	82	4.5	-176.8	0	0	0	0	0	115.2	A107 L108 K109 V111 S129 S296	A107-G298 WeakPolarHBondContact O-CA 3.39Å; L108-G298 CarbonylContact C-O 3.35Å; L108-G298 VanDerWaalsContact CA-O 3.27Å; L108-G298 WeakPolarHBondContact CA-O 3.48Å; K109-G298 PolarHBondContact N-O 3.34Å; V111-G298 VanDerWaalsContact CG2-O 3.27Å; V111-G298 WeakPolarHBondContact CG2-O 3.43Å; S129-G298 VanDerWaalsContact O-CA 3.32Å; S129-G298 WeakPolarHBondContact O-CA 3.25Å; S129-G298 PolarHBondContact O-N 3.45Å; S296-G298 PolarHBondContact O-N 2.67Å
299	E	93.1	Very high	90.7	Very high	67 Å²	67	18.7 Å²	18.7	31%	0.313	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	139	-178.7	-68.8	165.5	-152.6	0	0	109.8	K109 I295 S296 G297 K301	K109-E299 HydrophobicContact CB-CG 3.64Å; K109-E299 HydrophobicContact CD-CG 3.89Å; K109-E299 WeakPolarHBondContact CD-OE1 3.47Å; K109-E299 HydrophobicContact CG-CG 4.4Å; K109-E299 IonicContact NZ-OE1 2.75Å; K109-E299 PolarHBondContact NZ-OE1 3.41Å; I295-E299 WeakPolarHBondContact CA-O 3.37Å; I295-E299 WeakPolarHBondContact CG1-O 3.46Å; S296-E299 PolarHBondContact N-O 2.85Å; S296-E299 PolarHBondContact O-N 2.97Å; S296-E299 VanDerWaalsContact O-N 3.14Å; G297-E299 VanDerWaalsContact C-N 3.34Å; E299-K301 PolarHBondContact O-N 2.98Å; E299-K301 IonicContact OE2-NZ 4Å; E299-K301 PolarHBondContact OE2-NZ 3.36Å
300	L	93.2	Very high	90	Very high	25 Å²	25	21.1 Å²	21.1	13%	0.131	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	122.4	168.8	-178.4	70.7	0	0	0	109.1	V111 S112 A113 A293 C302	V111-L300 HydrophobicContact CG1-CB 4.07Å; S112-L300 WeakPolarHBondContact O-CD2 3.34Å; A113-L300 HydrophobicContact CB-CD2 4.05Å; A293-L300 HydrophobicContact CB-CD1 3.75Å; L300-C302 WeakPolarHBondContact CD1-O 3.31Å
301	K	90.9	Very high	89	Confident	22 Å²	22	20.1 Å²	20.1	10%	0.096	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-45.6	-175.6	-58.1	-64.4	156.5	-179.4	0	111.9	K79 I294 S296 E299 E405 C409	K79-K301 WeakPolarHBondContact CD-O 3.49Å; I294-K301 PolarHBondContact O-N 2.7Å; S296-K301 WeakPolarHBondContact O-CE 3.39Å; E299-K301 PolarHBondContact O-N 2.98Å; E299-K301 IonicContact OE2-NZ 4Å; E299-K301 PolarHBondContact OE2-NZ 3.36Å; K301-E405 HydrophobicContact CB-CB 3.9Å; K301-E405 HydrophobicContact CB-CG 4.39Å; K301-E405 HydrophobicContact CG-CB 4.4Å; K301-C409 VanDerWaalsContact CD-SG 3.56Å; K301-C409 WeakPolarHBondContact CE-SG 3.35Å; K301-C409 PolarHBondContact NZ-SG 3.06Å
302	C	90.7	Very high	87.8	Confident	12 Å²	12	21.8 Å²	21.8	8%	0.081	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	159.3	173.5	54.1	0	0	0	0	111	K79 A293 I294 L300 L309	K79-C302 CarbonylContact O-C 3.53Å; K79-C302 WeakPolarHBondContact O-CA 3.48Å; K79-C302 WeakPolarHBondContact O-CB 3.35Å; A293-C302 CarbonylContact C-O 3.5Å; A293-C302 WeakPolarHBondContact CA-O 3.38Å; I294-C302 PolarHBondContact N-O 2.79Å; L300-C302 WeakPolarHBondContact CD1-O 3.31Å; C302-L309 HydrophobicContact CB-CD2 3.79Å
303	S	91.9	Very high	86.7	Confident	5 Å²	5	22.1 Å²	22.1	4%	0.035	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	137.8	172.8	-174.8	0	0	0	0	111	K79 Q80 E81 I292	K79-S303 PolarHBondContact O-N 2.85Å; Q80-S303 CarbonylContact C-O 3.55Å; Q80-S303 VanDerWaalsContact CA-O 3.24Å; Q80-S303 WeakPolarHBondContact CA-O 3.44Å; E81-S303 PolarHBondContact N-O 2.95Å; I292-S303 CarbonylContact O-C 3.45Å; I292-S303 WeakPolarHBondContact O-CA 3.31Å
304	G	91	Very high	85.1	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.4	177.4	179.2	0	0	0	0	0	112.4	R291 I292	R291-G304 CarbonylContact C-O 3.46Å; R291-G304 WeakPolarHBondContact CA-O 3.38Å; I292-G304 PolarHBondContact N-O 2.87Å; I292-G304 PolarHBondContact O-N 2.62Å
305	S	88.6	Confident	83.5	Confident	27 Å²	27	27.7 Å²	27.7	19%	0.189	17%	0.173	C	C	.	.			trans	-59.7	155.3	165	63.6	0	0	0	0	110.9	E81 D290 G307 F308 L309	E81-S305 PolarHBondContact OE1-OG 2.88Å; E81-S305 WeakPolarHBondContact OE2-CB 3.47Å; E81-S305 PolarHBondContact OE2-N 2.74Å; E81-S305 PolarHBondContact OE2-OG 2.64Å; E81-S305 VanDerWaalsContact OE2-OG 3.09Å; D290-S305 WeakPolarHBondContact O-CA 3.27Å; S305-G307 PolarHBondContact O-N 2.94Å; S305-F308 PolarHBondContact O-N 2.75Å; S305-F308 VanDerWaalsContact O-N 3.13Å; S305-F308 VanDerWaalsContact OG-CB 3.27Å; S305-F308 WeakPolarHBondContact OG-CB 3.34Å; S305-F308 PolarHBondContact OG-N 2.61Å; S305-L309 WeakPolarHBondContact O-CG 3.26Å; S305-L309 PolarHBondContact O-N 3.45Å
306	T	84.9	Confident	82.2	Confident	21 Å²	21	27.9 Å²	27.9	13%	0.129	18%	0.175	C	C	.	.	H	α-helix	trans	-55.2	-41.4	177.5	-47.9	0	0	0	0	111.3	L309 M310	T306-L309 PolarHBondContact O-N 2.83Å; T306-M310 HydrophobicContact CG2-CE 3.98Å; T306-M310 HydrophobicContact CG2-CG 4.49Å; T306-M310 HydrophobicContact CG2-SD 4.16Å; T306-M310 WeakPolarHBondContact O-CB 2.89Å; T306-M310 VanDerWaalsContact O-CG 3.28Å; T306-M310 WeakPolarHBondContact O-CG 2.96Å; T306-M310 PolarHBondContact O-N 3.07Å
307	G	79.1	Confident	81.4	Confident	40 Å²	40	28.1 Å²	28.1	41%	0.412	18%	0.177	S	C	.	.	H	α-helix	trans	-61.5	-46.9	176.2	0	0	0	0	0	113	S305 L309 M310 A311	S305-G307 PolarHBondContact O-N 2.94Å; G307-L309 PolarHBondContact O-N 3.14Å; G307-M310 PolarHBondContact O-N 3.49Å; G307-A311 VanDerWaalsContact O-CB 3.3Å; G307-A311 WeakPolarHBondContact O-CB 3.47Å; G307-A311 PolarHBondContact O-N 3.05Å
308	F	84.3	Confident	81.1	Confident	22 Å²	22	26.3 Å²	26.3	10%	0.096	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-45.2	175.5	175.4	-89.8	0	0	0	112	L78 E81 S305 A311 N312	L78-F308 HydrophobicContact CB-CZ 4.16Å; L78-F308 WeakPolarHBondContact O-CZ 3.41Å; E81-F308 HydrophobicContact CB-CB 4.39Å; E81-F308 HydrophobicContact CB-CD1 3.73Å; E81-F308 HydrophobicContact CB-CD2 3.66Å; E81-F308 HydrophobicContact CB-CE1 3.74Å; E81-F308 HydrophobicContact CB-CE2 3.65Å; E81-F308 HydrophobicContact CB-CG 3.67Å; E81-F308 HydrophobicContact CB-CZ 3.68Å; E81-F308 HydrophobicContact CG-CB 4.44Å; E81-F308 HydrophobicContact CG-CD2 3.74Å; E81-F308 HydrophobicContact CG-CE2 4.01Å; E81-F308 HydrophobicContact CG-CG 4.03Å; S305-F308 PolarHBondContact O-N 2.75Å; S305-F308 VanDerWaalsContact O-N 3.13Å; S305-F308 VanDerWaalsContact OG-CB 3.27Å; S305-F308 WeakPolarHBondContact OG-CB 3.34Å; S305-F308 PolarHBondContact OG-N 2.61Å; F308-A311 PolarHBondContact O-N 3.36Å; F308-N312 WeakPolarHBondContact CD2-ND2 3.43Å; F308-N312 VanDerWaalsContact CE1-ND2 3.34Å; F308-N312 WeakPolarHBondContact CE1-ND2 3.15Å; F308-N312 WeakPolarHBondContact CE2-ND2 3.43Å; F308-N312 WeakPolarHBondContact CZ-ND2 3.38Å; F308-N312 WeakPolarHBondContact O-CB 3.36Å; F308-N312 PolarHBondContact O-N 3.32Å
309	L	84.5	Confident	80.9	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-41.6	-179.2	-71	-178.7	0	0	0	112	I292 C302 S305 T306 G307 S313 L398 V401	I292-L309 HydrophobicContact CB-CD1 3.73Å; I292-L309 HydrophobicContact CG2-CD1 4.11Å; C302-L309 HydrophobicContact CB-CD2 3.79Å; S305-L309 WeakPolarHBondContact O-CG 3.26Å; S305-L309 PolarHBondContact O-N 3.45Å; T306-L309 PolarHBondContact O-N 2.83Å; G307-L309 PolarHBondContact O-N 3.14Å; L309-S313 VanDerWaalsContact O-CB 3.24Å; L309-S313 WeakPolarHBondContact O-CB 3.29Å; L309-S313 PolarHBondContact O-N 3.28Å; L309-L398 HydrophobicContact CD1-CD1 4.11Å; L309-V401 HydrophobicContact CB-CG1 4.34Å
310	M	78.5	Confident	80.7	Confident	61 Å²	61	24.2 Å²	24.2	30%	0.3	15%	0.146	S	C	.	.	H	α-helix	trans	-66.2	-46.3	176	-69.7	-176.4	-54.1	0	0	111	T306 G307 N312 S313 V401	T306-M310 HydrophobicContact CG2-CE 3.98Å; T306-M310 HydrophobicContact CG2-CG 4.49Å; T306-M310 HydrophobicContact CG2-SD 4.16Å; T306-M310 WeakPolarHBondContact O-CB 2.89Å; T306-M310 VanDerWaalsContact O-CG 3.28Å; T306-M310 WeakPolarHBondContact O-CG 2.96Å; T306-M310 PolarHBondContact O-N 3.07Å; G307-M310 PolarHBondContact O-N 3.49Å; M310-N312 VanDerWaalsContact C-N 3.34Å; M310-N312 PolarHBondContact O-N 2.86Å; M310-S313 PolarHBondContact O-N 2.96Å; M310-S313 PolarHBondContact O-OG 2.88Å; M310-V401 HydrophobicContact CG-CG2 4.42Å
311	A	71.8	Confident	80.5	Confident	35 Å²	35	23 Å²	23	29%	0.289	14%	0.14	S	C	.	.	H	α-helix	trans	-62.8	-37.5	-179.9	0	0	0	0	0	113.4	F70 G307 F308	F70-A311 HydrophobicContact CE2-CB 4.33Å; F70-A311 HydrophobicContact CZ-CB 4.23Å; G307-A311 VanDerWaalsContact O-CB 3.3Å; G307-A311 WeakPolarHBondContact O-CB 3.47Å; G307-A311 PolarHBondContact O-N 3.05Å; F308-A311 PolarHBondContact O-N 3.36Å
312	N	71.1	Confident	80.4	Confident	40 Å²	40	24.6 Å²	24.6	21%	0.214	15%	0.151	C	C	.	.	H	α-helix	trans	-92.4	-10.5	-179.6	-72	-22.2	0	0	0	113.9	F308 M310 K314	F308-N312 WeakPolarHBondContact CD2-ND2 3.43Å; F308-N312 VanDerWaalsContact CE1-ND2 3.34Å; F308-N312 WeakPolarHBondContact CE1-ND2 3.15Å; F308-N312 WeakPolarHBondContact CE2-ND2 3.43Å; F308-N312 WeakPolarHBondContact CZ-ND2 3.38Å; F308-N312 WeakPolarHBondContact O-CB 3.36Å; F308-N312 PolarHBondContact O-N 3.32Å; M310-N312 VanDerWaalsContact C-N 3.34Å; M310-N312 PolarHBondContact O-N 2.86Å; N312-K314 PolarHBondContact O-N 3.1Å
313	S	70.5	Confident	80.2	Confident	6 Å²	6	25.5 Å²	25.5	4%	0.042	15%	0.154	C	C	.	.	S	Bend	trans	-61.3	142.5	168.9	77.5	0	0	0	0	107.9	L309 M310 G315	L309-S313 VanDerWaalsContact O-CB 3.24Å; L309-S313 WeakPolarHBondContact O-CB 3.29Å; L309-S313 PolarHBondContact O-N 3.28Å; M310-S313 PolarHBondContact O-N 2.96Å; M310-S313 PolarHBondContact O-OG 2.88Å; S313-G315 PolarHBondContact O-N 3.25Å; S313-G315 WeakPolarHBondContact OG-CA 3.48Å; S313-G315 PolarHBondContact OG-N 3.49Å; S313-G315 VanDerWaalsContact OG-N 3.1Å
314	K	62.9	Low	79.7	Confident	107 Å²	107	29 Å²	29	47%	0.465	17%	0.169	S	C	.	.			trans	-69.9	21.3	162.6	-58.1	-164	-170.2	-173.4	0	111.2	N312 G316 R408	N312-K314 PolarHBondContact O-N 3.1Å; K314-G316 PolarHBondContact O-N 3.33Å; K314-G316 VanDerWaalsContact O-N 3.08Å; K314-R408 VanDerWaalsContact CE-NH2 3.28Å; K314-R408 VanDerWaalsContact CG-NH2 3.31Å
315	G	60	Low	78.7	Confident	13 Å²	13	34.3 Å²	34.3	13%	0.134	20%	0.203	C	C	.	.			trans	-62.9	106.4	173.5	0	0	0	0	0	107.3	S313	S313-G315 PolarHBondContact O-N 3.25Å; S313-G315 WeakPolarHBondContact OG-CA 3.48Å; S313-G315 PolarHBondContact OG-N 3.49Å; S313-G315 VanDerWaalsContact OG-N 3.1Å
316	G	65.7	Low	77.4	Confident	5 Å²	5	39 Å²	39	5%	0.052	22%	0.222	C	C	.	.			trans	-58.5	177.1	167.1	0	0	0	0	0	113.9	K314 L364	K314-G316 PolarHBondContact O-N 3.33Å; K314-G316 VanDerWaalsContact O-N 3.08Å; G316-L364 CarbonylContact C-O 3.52Å; G316-L364 WeakPolarHBondContact CA-O 3.35Å
317	C	76.4	Confident	75.8	Confident	28 Å²	28	49.4 Å²	49.4	19%	0.189	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	149.7	157.9	62.2	0	0	0	0	109.5	L364 F393	C317-L364 PolarHBondContact N-O 2.99Å; C317-L364 PolarHBondContact O-N 3.44Å; C317-F393 HydrophobicContact CB-CD1 4.35Å
318	F	82.9	Confident	74.3	Confident	10 Å²	10	52.7 Å²	52.7	4%	0.044	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.2	171.2	-70.7	-97.5	0	0	0	108.3	V353 E361 F362 K363 F393 S394 G396 D400	F318-V353 HydrophobicContact CD1-CG2 4.05Å; F318-V353 HydrophobicContact CE1-CB 4.42Å; F318-V353 HydrophobicContact CE1-CG1 4.19Å; F318-V353 HydrophobicContact CE1-CG2 3.66Å; F318-E361 HydrophobicContact CB-CG 4.42Å; F318-E361 HydrophobicContact CD1-CG 3.91Å; F318-F362 CarbonylContact C-O 3.5Å; F318-F362 VanDerWaalsContact CA-O 3.28Å; F318-F362 WeakPolarHBondContact CA-O 3.48Å; F318-K363 HydrophobicContact CE1-CB 4.21Å; F318-K363 HydrophobicContact CE1-CD 4.45Å; F318-K363 HydrophobicContact CE1-CG 4.41Å; F318-K363 HydrophobicContact CZ-CD 4.11Å; F318-K363 HydrophobicContact CZ-CG 4.27Å; F318-F393 CarbonylContact O-C 3.51Å; F318-F393 VanDerWaalsContact O-CA 3.25Å; F318-F393 WeakPolarHBondContact O-CA 3.4Å; F318-S394 VanDerWaalsContact CB-OG 3.31Å; F318-S394 WeakPolarHBondContact CB-OG 3.25Å; F318-S394 PolarHBondContact N-O 3.4Å; F318-S394 PolarHBondContact O-N 3.05Å; F318-G396 VanDerWaalsContact CE2-CA 3.45Å; F318-D400 WeakPolarHBondContact CE2-OD2 3.22Å; F318-D400 VanDerWaalsContact CZ-CG 3.43Å; F318-D400 WeakPolarHBondContact CZ-OD1 3.35Å; F318-D400 VanDerWaalsContact CZ-OD2 3.28Å; F318-D400 WeakPolarHBondContact CZ-OD2 3.18Å
319	L	86.8	Confident	72.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	111.7	174.8	174.4	59.4	0	0	0	108.3	F321 L343 F362 L364 L375 I379 Y391 F393	L319-F321 HydrophobicContact CD1-CE2 4.21Å; L319-F321 HydrophobicContact CD1-CZ 4.37Å; L319-F321 HydrophobicContact CD2-CE2 3.52Å; L319-F321 HydrophobicContact CD2-CZ 3.73Å; L319-F321 HydrophobicContact CG-CD2 4.18Å; L319-F321 HydrophobicContact CG-CE2 3.52Å; L319-F321 HydrophobicContact CG-CZ 4.04Å; L319-L343 HydrophobicContact CD2-CD2 3.71Å; L319-F362 PolarHBondContact N-O 3.4Å; L319-F362 PolarHBondContact O-N 2.95Å; L319-L364 HydrophobicContact CB-CD1 3.8Å; L319-L364 HydrophobicContact CB-CG 4.17Å; L319-L364 HydrophobicContact CD2-CD1 3.92Å; L319-L375 HydrophobicContact CD2-CD2 4.2Å; L319-I379 HydrophobicContact CD2-CD1 3.77Å; L319-Y391 HydrophobicContact CD1-CD2 3.85Å; L319-Y391 HydrophobicContact CD1-CG 4.46Å; L319-F393 HydrophobicContact CB-CD1 4.32Å; L319-F393 HydrophobicContact CB-CE1 4.1Å; L319-F393 HydrophobicContact CD1-CD1 4.22Å; L319-F393 HydrophobicContact CD1-CD2 4.13Å; L319-F393 HydrophobicContact CD1-CE1 3.89Å; L319-F393 HydrophobicContact CD1-CE2 3.76Å; L319-F393 HydrophobicContact CD1-CG 4.35Å; L319-F393 HydrophobicContact CD1-CZ 3.65Å; L319-F393 HydrophobicContact CD2-CE1 4.37Å; L319-F393 HydrophobicContact CD2-CZ 4.26Å; L319-F393 HydrophobicContact CG-CE1 4.33Å; L319-F393 HydrophobicContact CG-CZ 4.4Å
320	T	88.9	Confident	71.1	Confident	24 Å²	24	63.2 Å²	63.2	15%	0.147	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124.6	-176.1	-55.7	0	0	0	0	109.8	E359 I360 E361 Y391 G392	T320-E359 HydrophobicContact CG2-CB 4.24Å; T320-E359 HydrophobicContact CG2-CG 4.44Å; T320-I360 WeakPolarHBondContact CA-O 3.48Å; T320-E361 HydrophobicContact CG2-CB 4.44Å; T320-E361 WeakPolarHBondContact OG1-CG 3.36Å; T320-E361 PolarHBondContact OG1-OE1 3.31Å; T320-Y391 CarbonylContact O-C 3.51Å; T320-Y391 WeakPolarHBondContact O-CA 3.34Å; T320-G392 PolarHBondContact N-O 2.8Å; T320-G392 PolarHBondContact O-N 3.2Å
321	F	89.1	Confident	70.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	130.9	174.2	-67.2	-95.9	0	0	0	110.4	L319 L339 L343 E359 I360 F362 I379 L383 C388	L319-F321 HydrophobicContact CD1-CE2 4.21Å; L319-F321 HydrophobicContact CD1-CZ 4.37Å; L319-F321 HydrophobicContact CD2-CE2 3.52Å; L319-F321 HydrophobicContact CD2-CZ 3.73Å; L319-F321 HydrophobicContact CG-CD2 4.18Å; L319-F321 HydrophobicContact CG-CE2 3.52Å; L319-F321 HydrophobicContact CG-CZ 4.04Å; F321-L339 HydrophobicContact CB-CD2 4.4Å; F321-L339 HydrophobicContact CD1-CD1 4.34Å; F321-L339 HydrophobicContact CD1-CD2 4.44Å; F321-L339 HydrophobicContact CD2-CD2 3.94Å; F321-L339 HydrophobicContact CE1-CD1 3.95Å; F321-L339 HydrophobicContact CE2-CD1 4.15Å; F321-L339 HydrophobicContact CE2-CD2 4.27Å; F321-L339 HydrophobicContact CG-CD2 4.02Å; F321-L339 HydrophobicContact CZ-CD1 3.84Å; F321-L343 HydrophobicContact CE2-CD1 3.78Å; F321-L343 HydrophobicContact CE2-CD2 4.32Å; F321-L343 HydrophobicContact CZ-CD1 4.33Å; F321-L343 HydrophobicContact CZ-CD2 4.31Å; F321-E359 CarbonylContact O-C 3.55Å; F321-E359 WeakPolarHBondContact O-CA 3.41Å; F321-E359 WeakPolarHBondContact O-CB 3.43Å; F321-I360 HydrophobicContact CB-CG2 3.76Å; F321-I360 HydrophobicContact CD2-CG2 4.41Å; F321-I360 HydrophobicContact CG-CG2 4.47Å; F321-I360 PolarHBondContact N-O 2.85Å; F321-I360 PolarHBondContact O-N 3.42Å; F321-F362 AromaticContact CD2-CD2 4Å; F321-F362 HydrophobicContact CD2-CD2 4Å; F321-F362 HydrophobicContact CD2-CE2 4Å; F321-F362 HydrophobicContact CE2-CD2 4.05Å; F321-F362 HydrophobicContact CE2-CE2 4.17Å; F321-I379 HydrophobicContact CE1-CD1 4.27Å; F321-I379 HydrophobicContact CE1-CG1 4.32Å; F321-I379 HydrophobicContact CE1-CG2 3.74Å; F321-I379 HydrophobicContact CZ-CD1 3.75Å; F321-I379 HydrophobicContact CZ-CG1 4.12Å; F321-I379 HydrophobicContact CZ-CG2 4.32Å; F321-L383 HydrophobicContact CD1-CD1 3.95Å; F321-L383 HydrophobicContact CE1-CD1 4.09Å; F321-C388 HydrophobicContact CB-CB 4.41Å; F321-C388 HydrophobicContact CD1-CB 4.22Å
322	V	88.6	Confident	69.4	Low	55 Å²	55	66.3 Å²	66.3	33%	0.333	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126	171.8	-176.4	0	0	0	0	108.8	C388 T389 S390	V322-C388 CarbonylContact O-C 3.55Å; V322-C388 WeakPolarHBondContact O-CA 3.48Å; V322-C388 WeakPolarHBondContact O-CB 3.29Å; V322-T389 WeakPolarHBondContact CB-OG1 3.42Å; V322-T389 WeakPolarHBondContact CG1-OG1 3.18Å; V322-T389 PolarHBondContact O-N 2.98Å; V322-T389 PolarHBondContact O-OG1 3.28Å; V322-S390 WeakPolarHBondContact CB-OG 3.4Å; V322-S390 WeakPolarHBondContact CG2-OG 3.13Å; V322-S390 PolarHBondContact N-O 2.89Å
323	K	86.5	Confident	68.9	Low	31 Å²	31	68.9 Å²	68.9	14%	0.135	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	143.5	-178.5	-62.9	177.7	179.5	176.7	0	110.9	N355 S356 K358	K323-N355 PolarHBondContact NZ-OD1 2.96Å; K323-S356 WeakPolarHBondContact CE-O 3.35Å; K323-S356 PolarHBondContact NZ-O 3.31Å; K323-K358 WeakPolarHBondContact CB-O 3.4Å; K323-K358 PolarHBondContact N-O 3.13Å
324	K	82	Confident	68.7	Low	80 Å²	80	71.1 Å²	71.1	35%	0.348	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-60.9	130.3	170.7	-76.3	-179.7	177.3	-172.9	0	109.4	Q326 E384 G387 C388 T389	K324-Q326 PolarHBondContact O-N 3.26Å; K324-Q326 VanDerWaalsContact O-N 3.17Å; K324-E384 IonicContact NZ-OE1 3.48Å; K324-E384 PolarHBondContact NZ-OE1 2.95Å; K324-G387 WeakPolarHBondContact CB-O 3.27Å; K324-G387 PolarHBondContact N-O 2.93Å; K324-C388 WeakPolarHBondContact CE-O 3.28Å; K324-T389 HydrophobicContact CB-CG2 4.23Å; K324-T389 HydrophobicContact CG-CG2 3.46Å; K324-T389 VanDerWaalsContact CG-CG2 3.46Å
325	P	69.1	Low	69.1	Low	111 Å²	111	67.4 Å²	67.4	72%	0.721	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-61.1	120.3	175.8	21.5	-29.8	0	0	0	109.7	R327	P325-R327 PolarHBondContact O-N 3.43Å; P325-R327 VanDerWaalsContact O-N 3.11Å
326	Q	62.8	Low	69.8	Low	124 Å²	124	67.8 Å²	67.8	58%	0.579	37%	0.373	S	S	*	.			trans	-60.6	114.5	-177.8	-86.2	165.1	51.9	0	0	111.1	K324 E332	K324-Q326 PolarHBondContact O-N 3.26Å; K324-Q326 VanDerWaalsContact O-N 3.17Å; Q326-E332 PolarHBondContact NE2-OE1 3.31Å
327	R	51.1	Low	70.4	Confident	240 Å²	240	74.2 Å²	74.2	91%	0.906	40%	0.399	S	S	*	.			trans	-115.7	-3.1	161.1	-73.9	-171.3	172.5	-176.7	-1.2	113.3	P325	P325-R327 PolarHBondContact O-N 3.43Å; P325-R327 VanDerWaalsContact O-N 3.11Å
328	T	46.8	Very low	70.6	Confident	110 Å²	110	78.6 Å²	78.6	68%	0.675	42%	0.415	S	S	*	.	S	Bend	trans	-155.3	115.9	-174.3	38.1	0	0	0	0	113.7	L330	T328-L330 VanDerWaalsContact C-N 3.35Å; T328-L330 PolarHBondContact O-N 3.03Å
329	S	48.9	Very low	70.7	Confident	126 Å²	126	78.2 Å²	78.2	88%	0.881	41%	0.414	S	S	*	.			trans	25.3	23	146.7	60.5	0	0	0	0	124.6
330	L	53.3	Low	70.5	Confident	121 Å²	121	79.7 Å²	79.7	63%	0.634	42%	0.421	S	S	*	.			trans	-98	125.7	165.3	-79.2	157.1	0	0	0	110.3	T328 E332	T328-L330 VanDerWaalsContact C-N 3.35Å; T328-L330 PolarHBondContact O-N 3.03Å; L330-E332 PolarHBondContact O-N 3.49Å; L330-E332 VanDerWaalsContact O-N 3.16Å
331	P	56.3	Low	70.2	Confident	89 Å²	89	82 Å²	82	58%	0.578	44%	0.438	S	S	*	.			trans	-64.9	118	178	23.5	-29.8	0	0	0	109.9	V333 S334	P331-V333 PolarHBondContact O-N 3.28Å; P331-S334 PolarHBondContact O-N 3.1Å
332	E	58.1	Low	70	Confident	72 Å²	72	84 Å²	84	34%	0.336	45%	0.446	S	S	.	.	H	α-helix	trans	-40.9	-36	-179.4	-82.4	-176.4	152	0	0	113.7	Q326 L330 S334 V336 H357	Q326-E332 PolarHBondContact NE2-OE1 3.31Å; L330-E332 PolarHBondContact O-N 3.49Å; L330-E332 VanDerWaalsContact O-N 3.16Å; E332-S334 VanDerWaalsContact C-N 3.27Å; E332-S334 PolarHBondContact O-N 3.33Å; E332-V336 PolarHBondContact O-N 3.31Å; E332-H357 IonicContact OE1-CE1 3.36Å; E332-H357 IonicContact OE1-ND1 3.95Å; E332-H357 PolarHBondContact OE1-ND1 2.95Å; E332-H357 IonicContact OE2-CE1 3.01Å; E332-H357 IonicContact OE2-ND1 3.59Å
333	V	60.7	Low	69.8	Low	94 Å²	94	81.4 Å²	81.4	57%	0.57	43%	0.43	S	S	*	.	H	α-helix	trans	-62.8	-29.5	-175.6	-172.5	0	0	0	0	112.7	P331 K337	P331-V333 PolarHBondContact O-N 3.28Å; V333-K337 HydrophobicContact CG1-CD 4.26Å; V333-K337 VanDerWaalsContact O-CG 3.31Å; V333-K337 WeakPolarHBondContact O-CG 3.29Å; V333-K337 PolarHBondContact O-N 2.81Å
334	S	66.6	Low	69.7	Low	53 Å²	53	84.3 Å²	84.3	37%	0.371	44%	0.444	S	S	.	.	H	α-helix	trans	-77.3	-43.1	-176.2	-169.8	0	0	0	0	112.5	P331 E332 K338	P331-S334 PolarHBondContact O-N 3.1Å; E332-S334 VanDerWaalsContact C-N 3.27Å; E332-S334 PolarHBondContact O-N 3.33Å; S334-K338 WeakPolarHBondContact O-CG 3.48Å; S334-K338 PolarHBondContact O-N 3.28Å
335	C	69.8	Low	69.9	Low	30 Å²	30	84.4 Å²	84.4	20%	0.203	46%	0.455	C	S	.	.	H	α-helix	trans	-70.2	-42.3	-177.2	-61	0	0	0	0	112	K338 L339	C335-K338 PolarHBondContact O-N 2.92Å; C335-L339 PolarHBondContact O-N 2.88Å
336	V	74.5	Confident	70.5	Confident	21 Å²	21	82.8 Å²	82.8	13%	0.127	44%	0.435	C	S	.	.	H	α-helix	trans	-64.3	-44	178.8	173.4	0	0	0	0	111.2	E332 K338 L339 I340 I360	E332-V336 PolarHBondContact O-N 3.31Å; V336-K338 VanDerWaalsContact C-N 3.35Å; V336-K338 PolarHBondContact O-N 3.16Å; V336-L339 PolarHBondContact O-N 3.23Å; V336-I340 HydrophobicContact CG1-CD1 3.62Å; V336-I340 HydrophobicContact CG1-CG1 4.26Å; V336-I340 WeakPolarHBondContact O-CD1 3.4Å; V336-I340 WeakPolarHBondContact O-CG1 3.49Å; V336-I340 PolarHBondContact O-N 3.26Å; V336-I360 HydrophobicContact CG1-CD1 3.64Å
337	K	79.2	Confident	71.5	Confident	140 Å²	140	77.2 Å²	77.2	61%	0.609	41%	0.41	S	S	*	.	H	α-helix	trans	-61.1	-42.3	176.9	-77	-177.8	179.4	-175.2	0	112.5	V333 I340 S341	V333-K337 HydrophobicContact CG1-CD 4.26Å; V333-K337 VanDerWaalsContact O-CG 3.31Å; V333-K337 WeakPolarHBondContact O-CG 3.29Å; V333-K337 PolarHBondContact O-N 2.81Å; K337-I340 PolarHBondContact O-N 3.11Å; K337-S341 PolarHBondContact O-N 3.41Å; K337-S341 PolarHBondContact O-OG 3.48Å; K337-S341 VanDerWaalsContact O-OG 3.08Å
338	K	81.5	Confident	73	Confident	119 Å²	119	70.3 Å²	70.3	52%	0.517	40%	0.396	S	S	.	.	H	α-helix	trans	-59.3	-47.7	174.7	-75.8	178.7	179	-175.2	0	111.3	S334 C335 V336 I340 S341 Y342 F386	S334-K338 WeakPolarHBondContact O-CG 3.48Å; S334-K338 PolarHBondContact O-N 3.28Å; C335-K338 PolarHBondContact O-N 2.92Å; V336-K338 VanDerWaalsContact C-N 3.35Å; V336-K338 PolarHBondContact O-N 3.16Å; K338-I340 PolarHBondContact O-N 3.42Å; K338-S341 WeakPolarHBondContact CA-OG 3.5Å; K338-S341 PolarHBondContact O-N 3.34Å; K338-S341 PolarHBondContact O-OG 3.39Å; K338-Y342 WeakPolarHBondContact O-CB 3.35Å; K338-Y342 PolarHBondContact O-N 3.38Å; K338-F386 HydrophobicContact CB-CD1 4.47Å
339	L	83.3	Confident	74.6	Confident	3 Å²	3	71.1 Å²	71.1	2%	0.016	40%	0.396	C	S	.	.	H	α-helix	trans	-60.5	-44.7	178.5	-176.2	67.1	0	0	0	111.9	F321 C335 V336 Y342 L343 I360 F362 F386	F321-L339 HydrophobicContact CB-CD2 4.4Å; F321-L339 HydrophobicContact CD1-CD1 4.34Å; F321-L339 HydrophobicContact CD1-CD2 4.44Å; F321-L339 HydrophobicContact CD2-CD2 3.94Å; F321-L339 HydrophobicContact CE1-CD1 3.95Å; F321-L339 HydrophobicContact CE2-CD1 4.15Å; F321-L339 HydrophobicContact CE2-CD2 4.27Å; F321-L339 HydrophobicContact CG-CD2 4.02Å; F321-L339 HydrophobicContact CZ-CD1 3.84Å; C335-L339 PolarHBondContact O-N 2.88Å; V336-L339 PolarHBondContact O-N 3.23Å; L339-Y342 WeakPolarHBondContact O-CB 3.43Å; L339-Y342 PolarHBondContact O-N 3.04Å; L339-L343 HydrophobicContact CD1-CD1 4.25Å; L339-L343 HydrophobicContact CG-CD1 4.01Å; L339-L343 WeakPolarHBondContact O-CG 3.37Å; L339-L343 PolarHBondContact O-N 3.05Å; L339-I360 HydrophobicContact CD2-CG2 3.7Å; L339-F362 HydrophobicContact CD2-CE2 3.83Å; L339-F362 HydrophobicContact CD2-CZ 4.2Å; L339-F362 HydrophobicContact CG-CE2 4.22Å; L339-F362 HydrophobicContact CG-CZ 4.26Å; L339-F386 HydrophobicContact CB-CD1 4.22Å; L339-F386 HydrophobicContact CB-CG 4.46Å; L339-F386 HydrophobicContact CD1-CB 4.04Å; L339-F386 HydrophobicContact CD1-CD1 4.1Å; L339-F386 HydrophobicContact CD1-CD2 3.84Å; L339-F386 HydrophobicContact CD1-CE2 4.33Å; L339-F386 HydrophobicContact CD1-CG 3.73Å
340	I	83.4	Confident	76.2	Confident	31 Å²	31	65.3 Å²	65.3	16%	0.159	36%	0.356	C	S	.	.	H	α-helix	trans	-61.1	-52	177.3	-64.6	159.7	0	0	0	110.7	V336 K337 K338 Y342 L343 Q344 I352 F362	V336-I340 HydrophobicContact CG1-CD1 3.62Å; V336-I340 HydrophobicContact CG1-CG1 4.26Å; V336-I340 WeakPolarHBondContact O-CD1 3.4Å; V336-I340 WeakPolarHBondContact O-CG1 3.49Å; V336-I340 PolarHBondContact O-N 3.26Å; K337-I340 PolarHBondContact O-N 3.11Å; K338-I340 PolarHBondContact O-N 3.42Å; I340-Y342 PolarHBondContact O-N 3.38Å; I340-L343 PolarHBondContact O-N 3.16Å; I340-Q344 HydrophobicContact CG2-CG 4.36Å; I340-Q344 WeakPolarHBondContact O-CB 3.31Å; I340-Q344 WeakPolarHBondContact O-CG 3.4Å; I340-Q344 PolarHBondContact O-N 2.82Å; I340-I352 HydrophobicContact CD1-CD1 3.37Å; I340-I352 HydrophobicContact CD1-CG1 4.49Å; I340-I352 HydrophobicContact CG1-CD1 3.66Å; I340-I352 HydrophobicContact CG1-CG1 4.31Å; I340-I352 HydrophobicContact CG2-CD1 4.44Å; I340-F362 HydrophobicContact CG1-CE1 3.86Å; I340-F362 HydrophobicContact CG1-CZ 3.86Å
341	S	83.6	Confident	77.6	Confident	72 Å²	72	65.8 Å²	65.8	50%	0.503	36%	0.355	S	S	.	.	H	α-helix	trans	-61	-32.9	179.6	57.1	0	0	0	0	112.4	K337 K338 S345	K337-S341 PolarHBondContact O-N 3.41Å; K337-S341 PolarHBondContact O-OG 3.48Å; K337-S341 VanDerWaalsContact O-OG 3.08Å; K338-S341 WeakPolarHBondContact CA-OG 3.5Å; K338-S341 PolarHBondContact O-N 3.34Å; K338-S341 PolarHBondContact O-OG 3.39Å; S341-S345 PolarHBondContact O-N 3.23Å
342	Y	83.7	Confident	78.9	Confident	42 Å²	42	65.3 Å²	65.3	17%	0.165	35%	0.346	C	S	.	.	H	α-helix	trans	-70.4	-49.4	177.8	-172.6	-99.6	0	0	0	111.1	K338 L339 I340 Q344 S345 Y346 E378 F386	K338-Y342 WeakPolarHBondContact O-CB 3.35Å; K338-Y342 PolarHBondContact O-N 3.38Å; L339-Y342 WeakPolarHBondContact O-CB 3.43Å; L339-Y342 PolarHBondContact O-N 3.04Å; I340-Y342 PolarHBondContact O-N 3.38Å; Y342-Q344 PolarHBondContact O-N 3.42Å; Y342-S345 WeakPolarHBondContact O-CB 3.28Å; Y342-S345 PolarHBondContact O-N 2.98Å; Y342-S345 VanDerWaalsContact O-N 3.11Å; Y342-S345 PolarHBondContact O-OG 3.35Å; Y342-Y346 HydrophobicContact CD1-CE2 4.36Å; Y342-Y346 HydrophobicContact CE1-CD2 4.46Å; Y342-Y346 AromaticContact CE1-CE2 3.92Å; Y342-Y346 HydrophobicContact CE1-CE2 3.92Å; Y342-Y346 HydrophobicContact CE2-CE2 4.14Å; Y342-Y346 AromaticContact CZ-CE2 3.82Å; Y342-Y346 WeakPolarHBondContact O-CD2 3.41Å; Y342-E378 WeakPolarHBondContact OH-CB 3.46Å; Y342-E378 PolarHBondContact OH-O 3.4Å; Y342-E378 PolarHBondContact OH-OE2 2.94Å; Y342-F386 HydrophobicContact CD1-CE1 4.28Å; Y342-F386 AromaticContact CD1-CE2 3.91Å; Y342-F386 HydrophobicContact CD1-CE2 3.91Å; Y342-F386 AromaticContact CD1-CZ 3.43Å; Y342-F386 HydrophobicContact CD1-CZ 3.43Å; Y342-F386 VanDerWaalsContact CD1-CZ 3.43Å; Y342-F386 HydrophobicContact CD2-CE1 4.3Å; Y342-F386 AromaticContact CD2-CZ 3.75Å; Y342-F386 HydrophobicContact CD2-CZ 3.75Å; Y342-F386 AromaticContact CE1-CE2 3.9Å; Y342-F386 HydrophobicContact CE1-CE2 3.9Å; Y342-F386 AromaticContact CE1-CZ 3.68Å; Y342-F386 HydrophobicContact CE1-CZ 3.68Å; Y342-F386 AromaticContact CE2-CZ 3.98Å; Y342-F386 HydrophobicContact CE2-CZ 3.98Å; Y342-F386 AromaticContact CG-CE1 3.95Å; Y342-F386 HydrophobicContact CG-CE1 3.95Å; Y342-F386 HydrophobicContact CG-CE2 4.36Å; Y342-F386 AromaticContact CG-CZ 3.44Å; Y342-F386 HydrophobicContact CG-CZ 3.44Å; Y342-F386 VanDerWaalsContact CG-CZ 3.44Å; Y342-F386 AromaticContact CZ-CZ 3.92Å
343	L	85.2	Confident	80.1	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-61	-44	177.1	-75.5	164.6	0	0	0	112.1	L319 F321 L339 I340 S345 Y346 V347 F362 L375	L319-L343 HydrophobicContact CD2-CD2 3.71Å; F321-L343 HydrophobicContact CE2-CD1 3.78Å; F321-L343 HydrophobicContact CE2-CD2 4.32Å; F321-L343 HydrophobicContact CZ-CD1 4.33Å; F321-L343 HydrophobicContact CZ-CD2 4.31Å; L339-L343 HydrophobicContact CD1-CD1 4.25Å; L339-L343 HydrophobicContact CG-CD1 4.01Å; L339-L343 WeakPolarHBondContact O-CG 3.37Å; L339-L343 PolarHBondContact O-N 3.05Å; I340-L343 PolarHBondContact O-N 3.16Å; L343-S345 PolarHBondContact O-N 2.82Å; L343-Y346 PolarHBondContact O-N 2.77Å; L343-Y346 VanDerWaalsContact O-N 3.09Å; L343-V347 PolarHBondContact O-N 3.11Å; L343-F362 HydrophobicContact CD1-CD1 3.73Å; L343-F362 HydrophobicContact CD1-CD2 3.44Å; L343-F362 VanDerWaalsContact CD1-CD2 3.44Å; L343-F362 HydrophobicContact CD1-CE1 3.59Å; L343-F362 HydrophobicContact CD1-CE2 3.3Å; L343-F362 HydrophobicContact CD1-CG 3.65Å; L343-F362 HydrophobicContact CD1-CZ 3.38Å; L343-L375 HydrophobicContact CD2-CD1 3.82Å; L343-L375 HydrophobicContact CD2-CD2 4.27Å
344	Q	84.2	Confident	81.2	Confident	91 Å²	91	65.6 Å²	65.6	43%	0.425	35%	0.346	S	S	.	.	H	α-helix	trans	-65.1	-18.6	177.6	-72	179.6	-27.4	0	0	113.5	I340 Y342 V347 P348	I340-Q344 HydrophobicContact CG2-CG 4.36Å; I340-Q344 WeakPolarHBondContact O-CB 3.31Å; I340-Q344 WeakPolarHBondContact O-CG 3.4Å; I340-Q344 PolarHBondContact O-N 2.82Å; Y342-Q344 PolarHBondContact O-N 3.42Å; Q344-V347 WeakPolarHBondContact CA-O 3.32Å; Q344-P348 WeakPolarHBondContact O-CA 3.39Å
345	S	85.3	Confident	82.1	Confident	82 Å²	82	67.3 Å²	67.3	57%	0.573	35%	0.351	S	S	*	.	H	α-helix	trans	-73.9	-28.1	173.7	77	0	0	0	0	113.3	S341 Y342 L343	S341-S345 PolarHBondContact O-N 3.23Å; Y342-S345 WeakPolarHBondContact O-CB 3.28Å; Y342-S345 PolarHBondContact O-N 2.98Å; Y342-S345 VanDerWaalsContact O-N 3.11Å; Y342-S345 PolarHBondContact O-OG 3.35Å; L343-S345 PolarHBondContact O-N 2.82Å
346	Y	83.2	Confident	82.7	Confident	78 Å²	78	67.6 Å²	67.6	31%	0.306	35%	0.354	S	S	.	.	H	α-helix	trans	-94	-41.9	175.5	-70.1	-86.1	0	0	0	111.7	Y342 L343 L375 E378	Y342-Y346 HydrophobicContact CD1-CE2 4.36Å; Y342-Y346 HydrophobicContact CE1-CD2 4.46Å; Y342-Y346 AromaticContact CE1-CE2 3.92Å; Y342-Y346 HydrophobicContact CE1-CE2 3.92Å; Y342-Y346 HydrophobicContact CE2-CE2 4.14Å; Y342-Y346 AromaticContact CZ-CE2 3.82Å; Y342-Y346 WeakPolarHBondContact O-CD2 3.41Å; L343-Y346 PolarHBondContact O-N 2.77Å; L343-Y346 VanDerWaalsContact O-N 3.09Å; Y346-L375 HydrophobicContact CD2-CD1 4Å; Y346-L375 HydrophobicContact CG-CD1 4.04Å; Y346-E378 HydrophobicContact CE1-CG 4.43Å; Y346-E378 WeakPolarHBondContact OH-CG 3.39Å
347	V	83.2	Confident	83	Confident	7 Å²	7	73.5 Å²	73.5	4%	0.042	38%	0.379	C	S	.	.			trans	-129.5	88.9	-176.5	-173.3	0	0	0	0	108.2	L343 Q344 D349 A350 L364 P365 T367 T371 L375	L343-V347 PolarHBondContact O-N 3.11Å; Q344-V347 WeakPolarHBondContact CA-O 3.32Å; V347-D349 PolarHBondContact O-N 3Å; V347-A350 HydrophobicContact CB-CB 4.31Å; V347-A350 HydrophobicContact CG1-CB 4.29Å; V347-A350 WeakPolarHBondContact O-CB 3.17Å; V347-A350 PolarHBondContact O-N 2.72Å; V347-L364 HydrophobicContact CB-CD2 4.33Å; V347-L364 HydrophobicContact CG1-CD2 4.33Å; V347-P365 VanDerWaalsContact CG1-CD 3.47Å; V347-P365 HydrophobicContact CG1-CG 3.57Å; V347-T367 HydrophobicContact CG2-CG2 4.37Å; V347-T371 HydrophobicContact CG2-CG2 4.43Å; V347-L375 HydrophobicContact CG2-CD2 4.43Å
348	P	81.6	Confident	83.2	Confident	94 Å²	94	74.7 Å²	74.7	61%	0.61	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.7	-173.3	-28	35.6	0	0	0	114.2	Q344 A350	Q344-P348 WeakPolarHBondContact O-CA 3.39Å; P348-A350 VanDerWaalsContact C-N 3.26Å; P348-A350 PolarHBondContact O-N 3.06Å
349	D	80.6	Confident	83.6	Confident	127 Å²	127	72.6 Å²	72.6	68%	0.679	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	17.8	-178.8	-56.7	-38.7	0	0	0	112.9	V347 E351 P365	V347-D349 PolarHBondContact O-N 3Å; D349-E351 PolarHBondContact O-N 3.07Å; D349-P365 HydrophobicContact CB-CG 4.06Å
350	A	83	Confident	83.8	Confident	5 Å²	5	72.5 Å²	72.5	4%	0.041	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-66.7	120	173.6	0	0	0	0	0	110.9	V347 P348 K363 L364	V347-A350 HydrophobicContact CB-CB 4.31Å; V347-A350 HydrophobicContact CG1-CB 4.29Å; V347-A350 WeakPolarHBondContact O-CB 3.17Å; V347-A350 PolarHBondContact O-N 2.72Å; P348-A350 VanDerWaalsContact C-N 3.26Å; P348-A350 PolarHBondContact O-N 3.06Å; A350-K363 WeakPolarHBondContact CA-O 3.47Å; A350-L364 HydrophobicContact CB-CD2 3.63Å
351	E	82.7	Confident	84	Confident	131 Å²	131	73.1 Å²	73.1	61%	0.612	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	140.5	179.4	-65.8	-174.6	169.7	0	0	110.9	D349 V353 F362 K363	D349-E351 PolarHBondContact O-N 3.07Å; E351-V353 PolarHBondContact O-N 3.01Å; E351-F362 CarbonylContact O-C 3.58Å; E351-F362 VanDerWaalsContact O-CA 3.29Å; E351-F362 WeakPolarHBondContact O-CA 3.5Å; E351-K363 PolarHBondContact N-O 3.44Å; E351-K363 PolarHBondContact O-N 3.1Å
352	I	84.8	Confident	84.2	Confident	78 Å²	78	69.8 Å²	69.8	40%	0.4	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	122.6	171.7	-57.9	164	0	0	0	108.1	I340 N355 I360 F362	I340-I352 HydrophobicContact CD1-CD1 3.37Å; I340-I352 HydrophobicContact CD1-CG1 4.49Å; I340-I352 HydrophobicContact CG1-CD1 3.66Å; I340-I352 HydrophobicContact CG1-CG1 4.31Å; I340-I352 HydrophobicContact CG2-CD1 4.44Å; I352-N355 HydrophobicContact CG2-CB 4.37Å; I352-I360 HydrophobicContact CG2-CG1 4.46Å; I352-F362 HydrophobicContact CD1-CE1 4.36Å; I352-F362 HydrophobicContact CG1-CD1 3.89Å; I352-F362 HydrophobicContact CG1-CE1 3.53Å; I352-F362 HydrophobicContact CG1-CZ 4.32Å
353	V	82	Confident	84.2	Confident	73 Å²	73	69.1 Å²	69.1	44%	0.442	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-50	179.1	-179.4	0	0	0	0	109.4	F318 E351 E361 K363	F318-V353 HydrophobicContact CD1-CG2 4.05Å; F318-V353 HydrophobicContact CE1-CB 4.42Å; F318-V353 HydrophobicContact CE1-CG1 4.19Å; F318-V353 HydrophobicContact CE1-CG2 3.66Å; E351-V353 PolarHBondContact O-N 3.01Å; V353-E361 HydrophobicContact CB-CG 4.27Å; V353-E361 WeakPolarHBondContact CG1-OE2 3.42Å; V353-E361 PolarHBondContact N-O 3.48Å; V353-K363 HydrophobicContact CG2-CB 3.54Å
354	Q	83.4	Confident	84.1	Confident	100 Å²	100	69.2 Å²	69.2	47%	0.467	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	143.5	-176.8	-178.4	170.6	-28.8	0	0	110.9	I360 E361	Q354-I360 WeakPolarHBondContact O-CA 3.27Å; Q354-E361 HydrophobicContact CB-CB 4.42Å; Q354-E361 PolarHBondContact N-O 3.45Å; Q354-E361 PolarHBondContact O-N 2.79Å
355	N	85.5	Confident	83.7	Confident	88 Å²	88	66.8 Å²	66.8	47%	0.471	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	101.4	175	-179.3	17.8	0	0	0	109.1	K323 I352 I360	K323-N355 PolarHBondContact NZ-OD1 2.96Å; I352-N355 HydrophobicContact CG2-CB 4.37Å; N355-I360 HydrophobicContact CB-CD1 4.43Å; N355-I360 HydrophobicContact CB-CG1 4.27Å
356	S	83.8	Confident	82.9	Confident	36 Å²	36	68.7 Å²	68.7	25%	0.252	35%	0.348	S	S	.	.			trans	-105.6	174.5	176.9	84.1	0	0	0	0	110.9	K323 K358 E359	K323-S356 WeakPolarHBondContact CE-O 3.35Å; K323-S356 PolarHBondContact NZ-O 3.31Å; S356-K358 PolarHBondContact O-N 3.19Å; S356-K358 PolarHBondContact OG-N 3.08Å; S356-K358 VanDerWaalsContact OG-N 3.16Å; S356-E359 PolarHBondContact N-O 2.88Å; S356-E359 VanDerWaalsContact O-O 3.11Å; S356-E359 PolarHBondContact OG-N 3.19Å; S356-E359 VanDerWaalsContact OG-N 3.1Å; S356-E359 PolarHBondContact OG-O 3.41Å
357	H	79.8	Confident	82.1	Confident	145 Å²	145	66.8 Å²	66.8	67%	0.671	34%	0.344	S	S	*	.	S	Bend	trans	-64.8	-22.3	173.3	-69.4	-68.4	0	0	0	113.4	E332	E332-H357 IonicContact OE1-CE1 3.36Å; E332-H357 IonicContact OE1-ND1 3.95Å; E332-H357 PolarHBondContact OE1-ND1 2.95Å; E332-H357 IonicContact OE2-CE1 3.01Å; E332-H357 IonicContact OE2-ND1 3.59Å
358	K	84.5	Confident	81.7	Confident	165 Å²	165	70.5 Å²	70.5	72%	0.717	36%	0.364	S	S	*	.	S	Bend	trans	-98.8	-31.9	-176	-67.5	-176.2	179.2	-179.7	0	113.3	K323 S356	K323-K358 WeakPolarHBondContact CB-O 3.4Å; K323-K358 PolarHBondContact N-O 3.13Å; S356-K358 PolarHBondContact O-N 3.19Å; S356-K358 PolarHBondContact OG-N 3.08Å; S356-K358 VanDerWaalsContact OG-N 3.16Å
359	E	88.4	Confident	81.4	Confident	76 Å²	76	69.5 Å²	69.5	36%	0.355	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	160.3	-172.7	73.9	-154.4	152.3	0	0	111.9	T320 F321 S356	T320-E359 HydrophobicContact CG2-CB 4.24Å; T320-E359 HydrophobicContact CG2-CG 4.44Å; F321-E359 CarbonylContact O-C 3.55Å; F321-E359 WeakPolarHBondContact O-CA 3.41Å; F321-E359 WeakPolarHBondContact O-CB 3.43Å; S356-E359 PolarHBondContact N-O 2.88Å; S356-E359 VanDerWaalsContact O-O 3.11Å; S356-E359 PolarHBondContact OG-N 3.19Å; S356-E359 VanDerWaalsContact OG-N 3.1Å; S356-E359 PolarHBondContact OG-O 3.41Å
360	I	88.2	Confident	81.4	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	131.4	170.1	-175.9	169.7	0	0	0	108.7	T320 F321 V336 L339 I352 Q354 N355 F362	T320-I360 WeakPolarHBondContact CA-O 3.48Å; F321-I360 HydrophobicContact CB-CG2 3.76Å; F321-I360 HydrophobicContact CD2-CG2 4.41Å; F321-I360 HydrophobicContact CG-CG2 4.47Å; F321-I360 PolarHBondContact N-O 2.85Å; F321-I360 PolarHBondContact O-N 3.42Å; V336-I360 HydrophobicContact CG1-CD1 3.64Å; L339-I360 HydrophobicContact CD2-CG2 3.7Å; I352-I360 HydrophobicContact CG2-CG1 4.46Å; Q354-I360 WeakPolarHBondContact O-CA 3.27Å; N355-I360 HydrophobicContact CB-CD1 4.43Å; N355-I360 HydrophobicContact CB-CG1 4.27Å; I360-F362 HydrophobicContact CB-CE2 4.39Å; I360-F362 HydrophobicContact CD1-CE2 3.74Å; I360-F362 HydrophobicContact CD1-CZ 3.57Å; I360-F362 HydrophobicContact CG1-CD2 4.33Å; I360-F362 HydrophobicContact CG1-CE2 3.64Å; I360-F362 HydrophobicContact CG1-CZ 3.95Å; I360-F362 HydrophobicContact CG2-CE2 3.98Å
361	E	87.8	Confident	81.3	Confident	44 Å²	44	69.4 Å²	69.4	21%	0.206	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.1	-175.8	-178.5	175.8	-107.6	0	0	110.3	F318 T320 V353 Q354	F318-E361 HydrophobicContact CB-CG 4.42Å; F318-E361 HydrophobicContact CD1-CG 3.91Å; T320-E361 HydrophobicContact CG2-CB 4.44Å; T320-E361 WeakPolarHBondContact OG1-CG 3.36Å; T320-E361 PolarHBondContact OG1-OE1 3.31Å; V353-E361 HydrophobicContact CB-CG 4.27Å; V353-E361 WeakPolarHBondContact CG1-OE2 3.42Å; V353-E361 PolarHBondContact N-O 3.48Å; Q354-E361 HydrophobicContact CB-CB 4.42Å; Q354-E361 PolarHBondContact N-O 3.45Å; Q354-E361 PolarHBondContact O-N 2.79Å
362	F	87.3	Confident	81.2	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.009	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.3	178.2	-65.7	-93.9	0	0	0	110.1	F318 L319 F321 L339 I340 L343 E351 I352 I360 L364	F318-F362 CarbonylContact C-O 3.5Å; F318-F362 VanDerWaalsContact CA-O 3.28Å; F318-F362 WeakPolarHBondContact CA-O 3.48Å; L319-F362 PolarHBondContact N-O 3.4Å; L319-F362 PolarHBondContact O-N 2.95Å; F321-F362 AromaticContact CD2-CD2 4Å; F321-F362 HydrophobicContact CD2-CD2 4Å; F321-F362 HydrophobicContact CD2-CE2 4Å; F321-F362 HydrophobicContact CE2-CD2 4.05Å; F321-F362 HydrophobicContact CE2-CE2 4.17Å; L339-F362 HydrophobicContact CD2-CE2 3.83Å; L339-F362 HydrophobicContact CD2-CZ 4.2Å; L339-F362 HydrophobicContact CG-CE2 4.22Å; L339-F362 HydrophobicContact CG-CZ 4.26Å; I340-F362 HydrophobicContact CG1-CE1 3.86Å; I340-F362 HydrophobicContact CG1-CZ 3.86Å; L343-F362 HydrophobicContact CD1-CD1 3.73Å; L343-F362 HydrophobicContact CD1-CD2 3.44Å; L343-F362 VanDerWaalsContact CD1-CD2 3.44Å; L343-F362 HydrophobicContact CD1-CE1 3.59Å; L343-F362 HydrophobicContact CD1-CE2 3.3Å; L343-F362 HydrophobicContact CD1-CG 3.65Å; L343-F362 HydrophobicContact CD1-CZ 3.38Å; E351-F362 CarbonylContact O-C 3.58Å; E351-F362 VanDerWaalsContact O-CA 3.29Å; E351-F362 WeakPolarHBondContact O-CA 3.5Å; I352-F362 HydrophobicContact CD1-CE1 4.36Å; I352-F362 HydrophobicContact CG1-CD1 3.89Å; I352-F362 HydrophobicContact CG1-CE1 3.53Å; I352-F362 HydrophobicContact CG1-CZ 4.32Å; I360-F362 HydrophobicContact CB-CE2 4.39Å; I360-F362 HydrophobicContact CD1-CE2 3.74Å; I360-F362 HydrophobicContact CD1-CZ 3.57Å; I360-F362 HydrophobicContact CG1-CD2 4.33Å; I360-F362 HydrophobicContact CG1-CE2 3.64Å; I360-F362 HydrophobicContact CG1-CZ 3.95Å; I360-F362 HydrophobicContact CG2-CE2 3.98Å; F362-L364 HydrophobicContact CB-CD2 4.39Å
363	K	83.9	Confident	81.1	Confident	28 Å²	28	67.5 Å²	67.5	12%	0.122	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	114.6	166.1	-176.1	171.9	-173.7	166.5	0	108.3	F318 A350 E351 V353 D400	F318-K363 HydrophobicContact CE1-CB 4.21Å; F318-K363 HydrophobicContact CE1-CD 4.45Å; F318-K363 HydrophobicContact CE1-CG 4.41Å; F318-K363 HydrophobicContact CZ-CD 4.11Å; F318-K363 HydrophobicContact CZ-CG 4.27Å; A350-K363 WeakPolarHBondContact CA-O 3.47Å; E351-K363 PolarHBondContact N-O 3.44Å; E351-K363 PolarHBondContact O-N 3.1Å; V353-K363 HydrophobicContact CG2-CB 3.54Å; K363-D400 IonicContact NZ-OD1 3.65Å
364	L	82.8	Confident	81.2	Confident	2 Å²	2	68 Å²	68	1%	0.01	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.1	176.7	-55.3	178.8	0	0	0	108.2	G316 C317 L319 V347 A350 F362 L375 F393	G316-L364 CarbonylContact C-O 3.52Å; G316-L364 WeakPolarHBondContact CA-O 3.35Å; C317-L364 PolarHBondContact N-O 2.99Å; C317-L364 PolarHBondContact O-N 3.44Å; L319-L364 HydrophobicContact CB-CD1 3.8Å; L319-L364 HydrophobicContact CB-CG 4.17Å; L319-L364 HydrophobicContact CD2-CD1 3.92Å; V347-L364 HydrophobicContact CB-CD2 4.33Å; V347-L364 HydrophobicContact CG1-CD2 4.33Å; A350-L364 HydrophobicContact CB-CD2 3.63Å; F362-L364 HydrophobicContact CB-CD2 4.39Å; L364-L375 HydrophobicContact CD1-CD2 3.78Å; L364-F393 HydrophobicContact CD1-CE1 3.94Å
365	P	76.6	Confident	81.4	Confident	40 Å²	40	63.2 Å²	63.2	26%	0.26	34%	0.339	S	S	.	.			trans	-50.5	166.1	174.9	28.2	-42.4	0	0	0	112.5	V347 D349 T367	V347-P365 VanDerWaalsContact CG1-CD 3.47Å; V347-P365 HydrophobicContact CG1-CG 3.57Å; D349-P365 HydrophobicContact CB-CG 4.06Å; P365-T367 PolarHBondContact O-N 3.25Å; P365-T367 PolarHBondContact O-OG1 3.29Å
366	I	67.4	Low	81.4	Confident	123 Å²	123	59.9 Å²	59.9	63%	0.631	32%	0.321	S	S	*	.	S	Bend	trans	-53.5	107.1	170.9	-60.3	170.7	0	0	0	107.7
367	T	67.5	Low	81.4	Confident	37 Å²	37	60.3 Å²	60.3	23%	0.227	33%	0.325	C	S	.	.			trans	-113.1	141.9	-176.7	-44.4	0	0	0	0	106.9	V347 P365 T371	V347-T367 HydrophobicContact CG2-CG2 4.37Å; P365-T367 PolarHBondContact O-N 3.25Å; P365-T367 PolarHBondContact O-OG1 3.29Å; T367-T371 VanDerWaalsContact CG2-CB 3.43Å; T367-T371 HydrophobicContact CG2-CG2 3.38Å
368	D	73.9	Confident	81.6	Confident	86 Å²	86	55.8 Å²	55.8	46%	0.46	30%	0.304	S	S	.	.			trans	-61	154.3	175.3	69	91.6	0	0	0	111	V370 T371 L372	D368-V370 PolarHBondContact O-N 3Å; D368-V370 WeakPolarHBondContact OD1-CA 3.22Å; D368-V370 VanDerWaalsContact OD1-CB 3.24Å; D368-V370 WeakPolarHBondContact OD1-CB 3.34Å; D368-V370 PolarHBondContact OD1-N 3.44Å; D368-T371 VanDerWaalsContact CG-OG1 3.32Å; D368-T371 PolarHBondContact O-N 2.91Å; D368-T371 PolarHBondContact OD1-N 3.31Å; D368-T371 PolarHBondContact OD1-OG1 3.3Å; D368-T371 WeakPolarHBondContact OD2-CB 3.45Å; D368-T371 PolarHBondContact OD2-OG1 2.97Å; D368-L372 PolarHBondContact O-N 3.18Å; D368-L372 VanDerWaalsContact O-N 3.13Å
369	A	76.2	Confident	81.6	Confident	72 Å²	72	48 Å²	48	60%	0.595	27%	0.27	S	S	*	.	H	α-helix	trans	-59.7	-30.2	-176	0	0	0	0	0	112.8	L373	A369-L373 WeakPolarHBondContact O-CB 3.37Å; A369-L373 WeakPolarHBondContact O-CG 3.33Å; A369-L373 PolarHBondContact O-N 3.36Å
370	V	79.8	Confident	81.4	Confident	93 Å²	93	47.8 Å²	47.8	56%	0.564	27%	0.271	S	S	*	.	H	α-helix	trans	-70.7	-46.1	-178.2	-176.9	0	0	0	0	110.2	D368 L372 L373 N374	D368-V370 PolarHBondContact O-N 3Å; D368-V370 WeakPolarHBondContact OD1-CA 3.22Å; D368-V370 VanDerWaalsContact OD1-CB 3.24Å; D368-V370 WeakPolarHBondContact OD1-CB 3.34Å; D368-V370 PolarHBondContact OD1-N 3.44Å; V370-L372 VanDerWaalsContact C-N 3.33Å; V370-L372 PolarHBondContact O-N 3.47Å; V370-L373 PolarHBondContact O-N 3.36Å; V370-N374 WeakPolarHBondContact O-CB 3.4Å; V370-N374 VanDerWaalsContact O-CG 3.27Å; V370-N374 PolarHBondContact O-N 2.96Å; V370-N374 PolarHBondContact O-ND2 2.91Å
371	T	82	Confident	81.2	Confident	38 Å²	38	54.7 Å²	54.7	23%	0.233	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-40.7	176.2	-57.8	0	0	0	0	111.5	V347 T367 D368 N374 L375	V347-T371 HydrophobicContact CG2-CG2 4.43Å; T367-T371 VanDerWaalsContact CG2-CB 3.43Å; T367-T371 HydrophobicContact CG2-CG2 3.38Å; D368-T371 VanDerWaalsContact CG-OG1 3.32Å; D368-T371 PolarHBondContact O-N 2.91Å; D368-T371 PolarHBondContact OD1-N 3.31Å; D368-T371 PolarHBondContact OD1-OG1 3.3Å; D368-T371 WeakPolarHBondContact OD2-CB 3.45Å; D368-T371 PolarHBondContact OD2-OG1 2.97Å; T371-N374 PolarHBondContact O-N 2.9Å; T371-L375 WeakPolarHBondContact O-CB 3.46Å; T371-L375 PolarHBondContact O-N 2.92Å
372	L	80.6	Confident	81	Confident	53 Å²	53	54 Å²	54	28%	0.277	30%	0.301	S	S	.	.	H	α-helix	trans	-64.7	-45	176	-164.2	154.7	0	0	0	111.3	D368 V370 N374 L375 V376 F393	D368-L372 PolarHBondContact O-N 3.18Å; D368-L372 VanDerWaalsContact O-N 3.13Å; V370-L372 VanDerWaalsContact C-N 3.33Å; V370-L372 PolarHBondContact O-N 3.47Å; L372-N374 VanDerWaalsContact C-N 3.33Å; L372-N374 PolarHBondContact O-N 2.85Å; L372-L375 WeakPolarHBondContact O-CB 3.25Å; L372-L375 PolarHBondContact O-N 3.45Å; L372-V376 HydrophobicContact CD2-CG2 3.7Å; L372-V376 VanDerWaalsContact O-CG2 3.26Å; L372-V376 WeakPolarHBondContact O-CG2 3.38Å; L372-V376 PolarHBondContact O-N 2.92Å; L372-F393 HydrophobicContact CD1-CE1 4.26Å; L372-F393 HydrophobicContact CD2-CE1 4.35Å; L372-F393 HydrophobicContact CD2-CZ 4.19Å; L372-F393 HydrophobicContact CG-CE1 4.27Å; L372-F393 HydrophobicContact CG-CZ 4.43Å
373	L	82.3	Confident	80.8	Confident	116 Å²	116	55.1 Å²	55.1	61%	0.607	31%	0.307	S	S	*	.	H	α-helix	trans	-59.7	-42.7	175.9	-76	169.6	0	0	0	112.3	A369 V370 V376 S377	A369-L373 WeakPolarHBondContact O-CB 3.37Å; A369-L373 WeakPolarHBondContact O-CG 3.33Å; A369-L373 PolarHBondContact O-N 3.36Å; V370-L373 PolarHBondContact O-N 3.36Å; L373-V376 PolarHBondContact O-N 3.39Å; L373-S377 WeakPolarHBondContact O-CB 3.36Å; L373-S377 PolarHBondContact O-N 2.9Å
374	N	84.4	Confident	80.6	Confident	82 Å²	82	60.8 Å²	60.8	44%	0.439	33%	0.334	S	S	.	.	H	α-helix	trans	-61.3	-47.8	175.4	-72.3	-25.7	0	0	0	110.9	V370 T371 L372 V376 S377 E378	V370-N374 WeakPolarHBondContact O-CB 3.4Å; V370-N374 VanDerWaalsContact O-CG 3.27Å; V370-N374 PolarHBondContact O-N 2.96Å; V370-N374 PolarHBondContact O-ND2 2.91Å; T371-N374 PolarHBondContact O-N 2.9Å; L372-N374 VanDerWaalsContact C-N 3.33Å; L372-N374 PolarHBondContact O-N 2.85Å; N374-V376 PolarHBondContact O-N 3.36Å; N374-S377 PolarHBondContact O-N 2.95Å; N374-S377 PolarHBondContact O-OG 3.09Å; N374-E378 WeakPolarHBondContact O-CB 3.34Å; N374-E378 WeakPolarHBondContact O-CG 3.36Å; N374-E378 PolarHBondContact O-N 3.42Å
375	L	85.8	Confident	80.5	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-57.4	-48	177.4	176.6	66.6	0	0	0	111.8	L319 L343 Y346 V347 L364 T371 L372 E378 I379	L319-L375 HydrophobicContact CD2-CD2 4.2Å; L343-L375 HydrophobicContact CD2-CD1 3.82Å; L343-L375 HydrophobicContact CD2-CD2 4.27Å; Y346-L375 HydrophobicContact CD2-CD1 4Å; Y346-L375 HydrophobicContact CG-CD1 4.04Å; V347-L375 HydrophobicContact CG2-CD2 4.43Å; L364-L375 HydrophobicContact CD1-CD2 3.78Å; T371-L375 WeakPolarHBondContact O-CB 3.46Å; T371-L375 PolarHBondContact O-N 2.92Å; L372-L375 WeakPolarHBondContact O-CB 3.25Å; L372-L375 PolarHBondContact O-N 3.45Å; L375-E378 PolarHBondContact O-N 3.47Å; L375-I379 HydrophobicContact CD1-CD1 3.93Å; L375-I379 HydrophobicContact CD1-CG1 4.23Å; L375-I379 HydrophobicContact CD2-CD1 4.36Å; L375-I379 HydrophobicContact CG-CD1 3.74Å; L375-I379 HydrophobicContact CG-CG1 4.43Å; L375-I379 VanDerWaalsContact O-CG1 3.27Å; L375-I379 WeakPolarHBondContact O-CG1 3.49Å; L375-I379 PolarHBondContact O-N 3.1Å
376	V	85.5	Confident	80.6	Confident	17 Å²	17	63.1 Å²	63.1	10%	0.103	35%	0.35	C	S	.	.	H	α-helix	trans	-58.9	-49.2	178.4	171.1	0	0	0	0	111.2	I11 L372 L373 N374 E378 I379 D380 Y391 F393	I11-V376 HydrophobicContact CD1-CG1 4.26Å; L372-V376 HydrophobicContact CD2-CG2 3.7Å; L372-V376 VanDerWaalsContact O-CG2 3.26Å; L372-V376 WeakPolarHBondContact O-CG2 3.38Å; L372-V376 PolarHBondContact O-N 2.92Å; L373-V376 PolarHBondContact O-N 3.39Å; N374-V376 PolarHBondContact O-N 3.36Å; V376-E378 PolarHBondContact O-N 3.22Å; V376-E378 VanDerWaalsContact O-N 3.14Å; V376-I379 PolarHBondContact O-N 3.26Å; V376-D380 PolarHBondContact O-N 3.26Å; V376-Y391 WeakPolarHBondContact CG1-OH 3.48Å; V376-F393 HydrophobicContact CG2-CE2 3.55Å; V376-F393 HydrophobicContact CG2-CZ 3.68Å
377	S	84.7	Confident	81.3	Confident	46 Å²	46	58.4 Å²	58.4	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-60.5	-28.1	-178.6	77.7	0	0	0	0	113.5	L373 N374 K381	L373-S377 WeakPolarHBondContact O-CB 3.36Å; L373-S377 PolarHBondContact O-N 2.9Å; N374-S377 PolarHBondContact O-N 2.95Å; N374-S377 PolarHBondContact O-OG 3.09Å; S377-K381 WeakPolarHBondContact O-CE 3.44Å; S377-K381 WeakPolarHBondContact O-CG 3.45Å
378	E	83.8	Confident	82.1	Confident	50 Å²	50	56.9 Å²	56.9	23%	0.234	32%	0.322	C	S	.	.	H	α-helix	trans	-89.5	-36.2	-177.2	-77.6	-61.6	132.7	0	0	111.8	Y342 Y346 N374 L375 V376 D380 K381 S382	Y342-E378 WeakPolarHBondContact OH-CB 3.46Å; Y342-E378 PolarHBondContact OH-O 3.4Å; Y342-E378 PolarHBondContact OH-OE2 2.94Å; Y346-E378 HydrophobicContact CE1-CG 4.43Å; Y346-E378 WeakPolarHBondContact OH-CG 3.39Å; N374-E378 WeakPolarHBondContact O-CB 3.34Å; N374-E378 WeakPolarHBondContact O-CG 3.36Å; N374-E378 PolarHBondContact O-N 3.42Å; L375-E378 PolarHBondContact O-N 3.47Å; V376-E378 PolarHBondContact O-N 3.22Å; V376-E378 VanDerWaalsContact O-N 3.14Å; E378-D380 VanDerWaalsContact C-N 3.33Å; E378-K381 PolarHBondContact O-N 3.46Å; E378-K381 IonicContact OE1-NZ 2.68Å; E378-K381 PolarHBondContact OE1-NZ 2.88Å; E378-S382 WeakPolarHBondContact O-CB 3.47Å; E378-S382 PolarHBondContact O-N 3.28Å; E378-S382 PolarHBondContact O-OG 3.3Å
379	I	85.8	Confident	82.6	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-58.7	-46.2	167.5	-69.8	165.9	0	0	0	110.2	L319 F321 L375 V376 K381 S382 L383 Y391	L319-I379 HydrophobicContact CD2-CD1 3.77Å; F321-I379 HydrophobicContact CE1-CD1 4.27Å; F321-I379 HydrophobicContact CE1-CG1 4.32Å; F321-I379 HydrophobicContact CE1-CG2 3.74Å; F321-I379 HydrophobicContact CZ-CD1 3.75Å; F321-I379 HydrophobicContact CZ-CG1 4.12Å; F321-I379 HydrophobicContact CZ-CG2 4.32Å; L375-I379 HydrophobicContact CD1-CD1 3.93Å; L375-I379 HydrophobicContact CD1-CG1 4.23Å; L375-I379 HydrophobicContact CD2-CD1 4.36Å; L375-I379 HydrophobicContact CG-CD1 3.74Å; L375-I379 HydrophobicContact CG-CG1 4.43Å; L375-I379 VanDerWaalsContact O-CG1 3.27Å; L375-I379 WeakPolarHBondContact O-CG1 3.49Å; L375-I379 PolarHBondContact O-N 3.1Å; V376-I379 PolarHBondContact O-N 3.26Å; I379-K381 PolarHBondContact O-N 2.96Å; I379-S382 CarbonylContact O-C 3.52Å; I379-S382 PolarHBondContact O-N 3.09Å; I379-L383 HydrophobicContact CG2-CD1 3.88Å; I379-L383 WeakPolarHBondContact O-CA 3.47Å; I379-L383 WeakPolarHBondContact O-CB 3.41Å; I379-L383 PolarHBondContact O-N 3.12Å; I379-Y391 HydrophobicContact CG2-CD1 3.44Å; I379-Y391 VanDerWaalsContact CG2-CD1 3.44Å; I379-Y391 HydrophobicContact CG2-CD2 4.32Å; I379-Y391 HydrophobicContact CG2-CE1 3.56Å; I379-Y391 HydrophobicContact CG2-CE2 4.42Å; I379-Y391 HydrophobicContact CG2-CG 3.85Å
380	D	83.9	Confident	83.2	Confident	72 Å²	72	54 Å²	54	39%	0.385	30%	0.302	S	S	.	.	H	α-helix	trans	-56.9	-36.5	179.7	-80	-22.1	0	0	0	112.8	V376 E378 Y391	V376-D380 PolarHBondContact O-N 3.26Å; E378-D380 VanDerWaalsContact C-N 3.33Å; D380-Y391 VanDerWaalsContact CG-OH 3.29Å; D380-Y391 WeakPolarHBondContact OD1-CE1 3.47Å; D380-Y391 VanDerWaalsContact OD1-CZ 3.3Å; D380-Y391 PolarHBondContact OD1-OH 2.67Å
381	K	84.4	Confident	83.7	Confident	146 Å²	146	50 Å²	50	64%	0.635	28%	0.277	S	S	*	.	H	α-helix	trans	-75	-30	178	-66.7	169.7	-165.4	167.6	0	113	S377 E378 I379	S377-K381 WeakPolarHBondContact O-CE 3.44Å; S377-K381 WeakPolarHBondContact O-CG 3.45Å; E378-K381 PolarHBondContact O-N 3.46Å; E378-K381 IonicContact OE1-NZ 2.68Å; E378-K381 PolarHBondContact OE1-NZ 2.88Å; I379-K381 PolarHBondContact O-N 2.96Å
382	S	83.5	Confident	83.9	Confident	29 Å²	29	48.7 Å²	48.7	20%	0.203	27%	0.271	C	S	.	.	H	α-helix	trans	-116.5	-0.1	-164.1	-55.5	0	0	0	0	113.9	E378 I379 E384 S385 F386	E378-S382 WeakPolarHBondContact O-CB 3.47Å; E378-S382 PolarHBondContact O-N 3.28Å; E378-S382 PolarHBondContact O-OG 3.3Å; I379-S382 CarbonylContact O-C 3.52Å; I379-S382 PolarHBondContact O-N 3.09Å; S382-E384 VanDerWaalsContact C-N 3.27Å; S382-E384 PolarHBondContact O-N 2.82Å; S382-E384 VanDerWaalsContact O-N 3.16Å; S382-S385 WeakPolarHBondContact O-CB 3.47Å; S382-S385 PolarHBondContact O-N 2.85Å; S382-S385 PolarHBondContact O-OG 3.14Å; S382-F386 VanDerWaalsContact CB-CE2 3.44Å; S382-F386 WeakPolarHBondContact O-CD2 3.15Å; S382-F386 PolarHBondContact O-N 3.02Å
383	L	83	Confident	84.2	Confident	26 Å²	26	47.5 Å²	47.5	14%	0.136	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-52.2	-43.6	-172.8	-168.1	67.9	0	0	0	113.2	F321 I379 S385 F386 C388 T389 Y391	F321-L383 HydrophobicContact CD1-CD1 3.95Å; F321-L383 HydrophobicContact CE1-CD1 4.09Å; I379-L383 HydrophobicContact CG2-CD1 3.88Å; I379-L383 WeakPolarHBondContact O-CA 3.47Å; I379-L383 WeakPolarHBondContact O-CB 3.41Å; I379-L383 PolarHBondContact O-N 3.12Å; L383-S385 VanDerWaalsContact C-N 3.33Å; L383-S385 PolarHBondContact O-N 3.38Å; L383-F386 PolarHBondContact O-N 3Å; L383-C388 HydrophobicContact CD1-CB 3.79Å; L383-C388 HydrophobicContact CG-CB 4.19Å; L383-C388 PolarHBondContact O-N 3.35Å; L383-T389 WeakPolarHBondContact CD2-O 3.42Å; L383-Y391 HydrophobicContact CD1-CD1 3.81Å; L383-Y391 HydrophobicContact CD2-CD1 4.23Å
384	E	79.5	Confident	84	Confident	146 Å²	146	43.9 Å²	43.9	68%	0.682	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-66.9	-34.2	179.4	-60.7	-144.1	111.2	0	0	113	K324 S382 F386 G387	K324-E384 IonicContact NZ-OE1 3.48Å; K324-E384 PolarHBondContact NZ-OE1 2.95Å; S382-E384 VanDerWaalsContact C-N 3.27Å; S382-E384 PolarHBondContact O-N 2.82Å; S382-E384 VanDerWaalsContact O-N 3.16Å; E384-F386 PolarHBondContact O-N 3.23Å; E384-G387 PolarHBondContact O-N 2.66Å
385	S	80.7	Confident	83.5	Confident	77 Å²	77	47.3 Å²	47.3	54%	0.538	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-67.6	-24.4	-179.7	79.9	0	0	0	0	112.5	S382 L383 G387	S382-S385 WeakPolarHBondContact O-CB 3.47Å; S382-S385 PolarHBondContact O-N 2.85Å; S382-S385 PolarHBondContact O-OG 3.14Å; L383-S385 VanDerWaalsContact C-N 3.33Å; L383-S385 PolarHBondContact O-N 3.38Å; S385-G387 VanDerWaalsContact C-N 3.33Å
386	F	78.7	Confident	82.8	Confident	15 Å²	15	47.9 Å²	47.9	7%	0.066	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-87.1	-1.1	174.1	-56.4	-57	0	0	0	113.3	K338 L339 Y342 S382 L383 E384 C388	K338-F386 HydrophobicContact CB-CD1 4.47Å; L339-F386 HydrophobicContact CB-CD1 4.22Å; L339-F386 HydrophobicContact CB-CG 4.46Å; L339-F386 HydrophobicContact CD1-CB 4.04Å; L339-F386 HydrophobicContact CD1-CD1 4.1Å; L339-F386 HydrophobicContact CD1-CD2 3.84Å; L339-F386 HydrophobicContact CD1-CE2 4.33Å; L339-F386 HydrophobicContact CD1-CG 3.73Å; Y342-F386 HydrophobicContact CD1-CE1 4.28Å; Y342-F386 AromaticContact CD1-CE2 3.91Å; Y342-F386 HydrophobicContact CD1-CE2 3.91Å; Y342-F386 AromaticContact CD1-CZ 3.43Å; Y342-F386 HydrophobicContact CD1-CZ 3.43Å; Y342-F386 VanDerWaalsContact CD1-CZ 3.43Å; Y342-F386 HydrophobicContact CD2-CE1 4.3Å; Y342-F386 AromaticContact CD2-CZ 3.75Å; Y342-F386 HydrophobicContact CD2-CZ 3.75Å; Y342-F386 AromaticContact CE1-CE2 3.9Å; Y342-F386 HydrophobicContact CE1-CE2 3.9Å; Y342-F386 AromaticContact CE1-CZ 3.68Å; Y342-F386 HydrophobicContact CE1-CZ 3.68Å; Y342-F386 AromaticContact CE2-CZ 3.98Å; Y342-F386 HydrophobicContact CE2-CZ 3.98Å; Y342-F386 AromaticContact CG-CE1 3.95Å; Y342-F386 HydrophobicContact CG-CE1 3.95Å; Y342-F386 HydrophobicContact CG-CE2 4.36Å; Y342-F386 AromaticContact CG-CZ 3.44Å; Y342-F386 HydrophobicContact CG-CZ 3.44Å; Y342-F386 VanDerWaalsContact CG-CZ 3.44Å; Y342-F386 AromaticContact CZ-CZ 3.92Å; S382-F386 VanDerWaalsContact CB-CE2 3.44Å; S382-F386 WeakPolarHBondContact O-CD2 3.15Å; S382-F386 PolarHBondContact O-N 3.02Å; L383-F386 PolarHBondContact O-N 3Å; E384-F386 PolarHBondContact O-N 3.23Å; F386-C388 VanDerWaalsContact C-N 3.3Å; F386-C388 PolarHBondContact O-N 3.1Å
387	G	81.1	Confident	82.4	Confident	24 Å²	24	48.5 Å²	48.5	25%	0.247	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	26.8	-176.1	0	0	0	0	0	113.5	K324 E384 S385	K324-G387 WeakPolarHBondContact CB-O 3.27Å; K324-G387 PolarHBondContact N-O 2.93Å; E384-G387 PolarHBondContact O-N 2.66Å; S385-G387 VanDerWaalsContact C-N 3.33Å
388	C	84	Confident	82.3	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.027	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	151.2	177.3	-61.1	0	0	0	0	110.8	F321 V322 K324 L383 F386	F321-C388 HydrophobicContact CB-CB 4.41Å; F321-C388 HydrophobicContact CD1-CB 4.22Å; V322-C388 CarbonylContact O-C 3.55Å; V322-C388 WeakPolarHBondContact O-CA 3.48Å; V322-C388 WeakPolarHBondContact O-CB 3.29Å; K324-C388 WeakPolarHBondContact CE-O 3.28Å; L383-C388 HydrophobicContact CD1-CB 3.79Å; L383-C388 HydrophobicContact CG-CB 4.19Å; L383-C388 PolarHBondContact O-N 3.35Å; F386-C388 VanDerWaalsContact C-N 3.3Å; F386-C388 PolarHBondContact O-N 3.1Å
389	T	85.5	Confident	82.2	Confident	64 Å²	64	50.5 Å²	50.5	39%	0.393	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-38.1	176.8	48.8	0	0	0	0	112.6	V322 K324 L383	V322-T389 WeakPolarHBondContact CB-OG1 3.42Å; V322-T389 WeakPolarHBondContact CG1-OG1 3.18Å; V322-T389 PolarHBondContact O-N 2.98Å; V322-T389 PolarHBondContact O-OG1 3.28Å; K324-T389 HydrophobicContact CB-CG2 4.23Å; K324-T389 HydrophobicContact CG-CG2 3.46Å; K324-T389 VanDerWaalsContact CG-CG2 3.46Å; L383-T389 WeakPolarHBondContact CD2-O 3.42Å
390	S	88.2	Confident	81.9	Confident	34 Å²	34	51.9 Å²	51.9	24%	0.238	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	164	-175.2	54.8	0	0	0	0	109.3	V322	V322-S390 WeakPolarHBondContact CB-OG 3.4Å; V322-S390 WeakPolarHBondContact CG2-OG 3.13Å; V322-S390 PolarHBondContact N-O 2.89Å
391	Y	89.8	Confident	81.8	Confident	8 Å²	8	48.6 Å²	48.6	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	162	169.4	67.6	-81.1	0	0	0	109.5	L319 T320 V376 I379 D380 L383 F393	L319-Y391 HydrophobicContact CD1-CD2 3.85Å; L319-Y391 HydrophobicContact CD1-CG 4.46Å; T320-Y391 CarbonylContact O-C 3.51Å; T320-Y391 WeakPolarHBondContact O-CA 3.34Å; V376-Y391 WeakPolarHBondContact CG1-OH 3.48Å; I379-Y391 HydrophobicContact CG2-CD1 3.44Å; I379-Y391 VanDerWaalsContact CG2-CD1 3.44Å; I379-Y391 HydrophobicContact CG2-CD2 4.32Å; I379-Y391 HydrophobicContact CG2-CE1 3.56Å; I379-Y391 HydrophobicContact CG2-CE2 4.42Å; I379-Y391 HydrophobicContact CG2-CG 3.85Å; D380-Y391 VanDerWaalsContact CG-OH 3.29Å; D380-Y391 WeakPolarHBondContact OD1-CE1 3.47Å; D380-Y391 VanDerWaalsContact OD1-CZ 3.3Å; D380-Y391 PolarHBondContact OD1-OH 2.67Å; L383-Y391 HydrophobicContact CD1-CD1 3.81Å; L383-Y391 HydrophobicContact CD2-CD1 4.23Å; Y391-F393 HydrophobicContact CD2-CD2 4.39Å; Y391-F393 AromaticContact CD2-CE2 3.99Å; Y391-F393 HydrophobicContact CD2-CE2 3.99Å; Y391-F393 HydrophobicContact CE2-CD2 4.36Å; Y391-F393 AromaticContact CE2-CE2 3.83Å; Y391-F393 HydrophobicContact CE2-CE2 3.83Å
392	G	87.5	Confident	81.7	Confident	12 Å²	12	43.5 Å²	43.5	12%	0.124	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	151.5	176.2	0	0	0	0	0	110.9	T320	T320-G392 PolarHBondContact N-O 2.8Å; T320-G392 PolarHBondContact O-N 3.2Å
393	F	85.5	Confident	81.5	Confident	28 Å²	28	47 Å²	47	12%	0.123	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138	170.5	-70.9	-94.1	0	0	0	110	C317 F318 L319 L364 L372 V376 Y391	C317-F393 HydrophobicContact CB-CD1 4.35Å; F318-F393 CarbonylContact O-C 3.51Å; F318-F393 VanDerWaalsContact O-CA 3.25Å; F318-F393 WeakPolarHBondContact O-CA 3.4Å; L319-F393 HydrophobicContact CB-CD1 4.32Å; L319-F393 HydrophobicContact CB-CE1 4.1Å; L319-F393 HydrophobicContact CD1-CD1 4.22Å; L319-F393 HydrophobicContact CD1-CD2 4.13Å; L319-F393 HydrophobicContact CD1-CE1 3.89Å; L319-F393 HydrophobicContact CD1-CE2 3.76Å; L319-F393 HydrophobicContact CD1-CG 4.35Å; L319-F393 HydrophobicContact CD1-CZ 3.65Å; L319-F393 HydrophobicContact CD2-CE1 4.37Å; L319-F393 HydrophobicContact CD2-CZ 4.26Å; L319-F393 HydrophobicContact CG-CE1 4.33Å; L319-F393 HydrophobicContact CG-CZ 4.4Å; L364-F393 HydrophobicContact CD1-CE1 3.94Å; L372-F393 HydrophobicContact CD1-CE1 4.26Å; L372-F393 HydrophobicContact CD2-CE1 4.35Å; L372-F393 HydrophobicContact CD2-CZ 4.19Å; L372-F393 HydrophobicContact CG-CE1 4.27Å; L372-F393 HydrophobicContact CG-CZ 4.43Å; V376-F393 HydrophobicContact CG2-CE2 3.55Å; V376-F393 HydrophobicContact CG2-CZ 3.68Å; Y391-F393 HydrophobicContact CD2-CD2 4.39Å; Y391-F393 AromaticContact CD2-CE2 3.99Å; Y391-F393 HydrophobicContact CD2-CE2 3.99Å; Y391-F393 HydrophobicContact CE2-CD2 4.36Å; Y391-F393 AromaticContact CE2-CE2 3.83Å; Y391-F393 HydrophobicContact CE2-CE2 3.83Å
394	S	79.6	Confident	81.3	Confident	39 Å²	39	46.8 Å²	46.8	27%	0.273	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	150.5	167	44.4	0	0	0	0	109.9	F318	F318-S394 VanDerWaalsContact CB-OG 3.31Å; F318-S394 WeakPolarHBondContact CB-OG 3.25Å; F318-S394 PolarHBondContact N-O 3.4Å; F318-S394 PolarHBondContact O-N 3.05Å
395	E	72.5	Confident	81.4	Confident	155 Å²	155	40.8 Å²	40.8	72%	0.724	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82	149.9	169.8	-67.1	-174.4	165.7	0	0	109.6
396	G	71.3	Confident	81.2	Confident	12 Å²	12	38.8 Å²	38.8	12%	0.124	22%	0.219	C	C	.	.			trans	-66	142	173.1	0	0	0	0	0	111.8	F318 D400	F318-G396 VanDerWaalsContact CE2-CA 3.45Å; G396-D400 WeakPolarHBondContact CA-OD2 3.41Å
397	G	77.6	Confident	80.8	Confident	31 Å²	31	42.5 Å²	42.5	32%	0.32	24%	0.235	S	C	.	.			trans	-86.3	-179.2	177.5	0	0	0	0	0	112.4	E399 D400 V401	G397-E399 PolarHBondContact O-N 3.32Å; G397-E399 VanDerWaalsContact O-N 3.16Å; G397-D400 PolarHBondContact N-OD2 3.22Å; G397-D400 VanDerWaalsContact N-OD2 3.08Å; G397-D400 WeakPolarHBondContact O-CB 3.44Å; G397-D400 PolarHBondContact O-N 2.98Å; G397-V401 PolarHBondContact O-N 3.46Å
398	L	81.5	Confident	79.8	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-57.6	-27.3	169.9	-175.7	65.4	0	0	0	112.2	L124 L282 E286 I292 I294 L309 D400 V401 M402	L124-L398 HydrophobicContact CD2-CD2 4.31Å; L282-L398 HydrophobicContact CD1-CB 4.04Å; L282-L398 HydrophobicContact CD1-CD2 4.06Å; L282-L398 HydrophobicContact CD1-CG 3.81Å; L282-L398 HydrophobicContact CD2-CB 4.19Å; L282-L398 HydrophobicContact CD2-CD2 4.32Å; L282-L398 HydrophobicContact CG-CB 4.29Å; L282-L398 HydrophobicContact CG-CD2 3.84Å; L282-L398 HydrophobicContact CG-CG 4.13Å; E286-L398 HydrophobicContact CB-CD2 4.39Å; I292-L398 HydrophobicContact CD1-CD1 4.03Å; I292-L398 HydrophobicContact CD1-CD2 3.42Å; I292-L398 VanDerWaalsContact CD1-CD2 3.42Å; I292-L398 HydrophobicContact CD1-CG 4.38Å; I294-L398 HydrophobicContact CD1-CD1 4.38Å; L309-L398 HydrophobicContact CD1-CD1 4.11Å; L398-D400 VanDerWaalsContact C-N 3.27Å; L398-D400 PolarHBondContact O-N 3.45Å; L398-V401 HydrophobicContact CD1-CB 4.39Å; L398-V401 WeakPolarHBondContact O-CB 3.44Å; L398-V401 PolarHBondContact O-N 3.29Å; L398-M402 PolarHBondContact O-N 2.92Å
399	E	82.3	Confident	78.3	Confident	137 Å²	137	46.7 Å²	46.7	64%	0.64	25%	0.247	S	C	*	.	H	α-helix	trans	-58.2	-40.4	174.8	-66.5	-170.3	171.2	0	0	111.6	L282 G397 M402 F403	L282-E399 HydrophobicContact CD1-CB 4.29Å; L282-E399 HydrophobicContact CD1-CG 3.7Å; L282-E399 HydrophobicContact CD2-CG 3.68Å; L282-E399 HydrophobicContact CG-CG 4.24Å; G397-E399 PolarHBondContact O-N 3.32Å; G397-E399 VanDerWaalsContact O-N 3.16Å; E399-M402 PolarHBondContact O-N 3Å; E399-F403 WeakPolarHBondContact O-CB 3.32Å; E399-F403 PolarHBondContact O-N 2.86Å
400	D	79.2	Confident	76.4	Confident	30 Å²	30	49.9 Å²	49.9	16%	0.16	26%	0.257	C	S	.	.	H	α-helix	trans	-70.3	-37.4	178.4	-69.3	-58.3	0	0	0	112.8	F318 K363 G396 G397 L398 M402 F403 T404	F318-D400 WeakPolarHBondContact CE2-OD2 3.22Å; F318-D400 VanDerWaalsContact CZ-CG 3.43Å; F318-D400 WeakPolarHBondContact CZ-OD1 3.35Å; F318-D400 VanDerWaalsContact CZ-OD2 3.28Å; F318-D400 WeakPolarHBondContact CZ-OD2 3.18Å; K363-D400 IonicContact NZ-OD1 3.65Å; G396-D400 WeakPolarHBondContact CA-OD2 3.41Å; G397-D400 PolarHBondContact N-OD2 3.22Å; G397-D400 VanDerWaalsContact N-OD2 3.08Å; G397-D400 WeakPolarHBondContact O-CB 3.44Å; G397-D400 PolarHBondContact O-N 2.98Å; L398-D400 VanDerWaalsContact C-N 3.27Å; L398-D400 PolarHBondContact O-N 3.45Å; D400-M402 VanDerWaalsContact C-N 3.35Å; D400-F403 PolarHBondContact O-N 2.88Å; D400-T404 WeakPolarHBondContact O-CB 3.44Å; D400-T404 PolarHBondContact O-N 3.23Å; D400-T404 PolarHBondContact O-OG1 3.5Å
401	V	82.5	Confident	74.2	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-50.8	173.3	-171.1	0	0	0	0	108.9	I294 L309 M310 G397 L398 F403 T404 E405	I294-V401 HydrophobicContact CD1-CB 4.42Å; I294-V401 HydrophobicContact CD1-CG1 3.91Å; L309-V401 HydrophobicContact CB-CG1 4.34Å; M310-V401 HydrophobicContact CG-CG2 4.42Å; G397-V401 PolarHBondContact O-N 3.46Å; L398-V401 HydrophobicContact CD1-CB 4.39Å; L398-V401 WeakPolarHBondContact O-CB 3.44Å; L398-V401 PolarHBondContact O-N 3.29Å; V401-F403 PolarHBondContact O-N 3.03Å; V401-T404 PolarHBondContact O-N 3.35Å; V401-E405 HydrophobicContact CG1-CG 4.5Å; V401-E405 WeakPolarHBondContact O-CB 3.48Å; V401-E405 WeakPolarHBondContact O-CG 3.26Å; V401-E405 PolarHBondContact O-N 3.16Å
402	M	82.3	Confident	72.1	Confident	39 Å²	39	57.4 Å²	57.4	19%	0.192	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-45.8	179	-171.8	178.9	-176	0	0	111.3	L124 L282 I294 L398 E399 D400 T406	L124-M402 HydrophobicContact CD2-SD 4.22Å; L124-M402 HydrophobicContact CG-SD 4.39Å; L282-M402 HydrophobicContact CD1-SD 4.35Å; I294-M402 HydrophobicContact CD1-CB 4.5Å; L398-M402 PolarHBondContact O-N 2.92Å; E399-M402 PolarHBondContact O-N 3Å; D400-M402 VanDerWaalsContact C-N 3.35Å; M402-T406 HydrophobicContact CG-CG2 4.29Å; M402-T406 VanDerWaalsContact O-CB 3.25Å; M402-T406 WeakPolarHBondContact O-CB 3.48Å; M402-T406 WeakPolarHBondContact O-CG2 3.23Å; M402-T406 PolarHBondContact O-N 2.84Å; M402-T406 PolarHBondContact O-OG1 3.34Å
403	F	80.2	Confident	70.1	Confident	103 Å²	103	59.5 Å²	59.5	45%	0.452	31%	0.314	S	S	.	.	H	α-helix	trans	-65	-44.5	179.3	-174.6	-109.5	0	0	0	112.7	E399 D400 V401 T406 K407	E399-F403 WeakPolarHBondContact O-CB 3.32Å; E399-F403 PolarHBondContact O-N 2.86Å; D400-F403 PolarHBondContact O-N 2.88Å; V401-F403 PolarHBondContact O-N 3.03Å; F403-T406 WeakPolarHBondContact CA-OG1 3.36Å; F403-T406 PolarHBondContact O-N 3.07Å; F403-T406 PolarHBondContact O-OG1 3.12Å; F403-K407 HydrophobicContact CD1-CD 3.95Å; F403-K407 HydrophobicContact CD2-CD 4.44Å; F403-K407 HydrophobicContact CD2-CG 4.5Å; F403-K407 HydrophobicContact CE1-CD 3.52Å; F403-K407 VanDerWaalsContact CE1-CE 3.42Å; F403-K407 HydrophobicContact CE1-CG 4.5Å; F403-K407 HydrophobicContact CE2-CD 4.03Å; F403-K407 VanDerWaalsContact CE2-CE 3.5Å; F403-K407 HydrophobicContact CE2-CG 4.38Å; F403-K407 HydrophobicContact CG-CD 4.44Å; F403-K407 HydrophobicContact CZ-CD 3.63Å; F403-K407 HydrophobicContact CZ-CG 4.45Å; F403-K407 VanDerWaalsContact O-CB 3.31Å; F403-K407 WeakPolarHBondContact O-CB 3.4Å; F403-K407 PolarHBondContact O-N 3.38Å
404	T	78.8	Confident	67.7	Low	22 Å²	22	67.6 Å²	67.6	14%	0.135	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-46.5	-179.3	-58.4	0	0	0	0	110.8	D400 V401 R408	D400-T404 WeakPolarHBondContact O-CB 3.44Å; D400-T404 PolarHBondContact O-N 3.23Å; D400-T404 PolarHBondContact O-OG1 3.5Å; V401-T404 PolarHBondContact O-N 3.35Å; T404-R408 WeakPolarHBondContact O-CG 3.49Å; T404-R408 PolarHBondContact O-N 3.33Å
405	E	80.3	Confident	65.9	Low	19 Å²	19	74.5 Å²	74.5	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-73.6	-33.2	-178.6	-66.7	-49.3	136.5	0	0	113	K301 V401 R408 C409	K301-E405 HydrophobicContact CB-CB 3.9Å; K301-E405 HydrophobicContact CB-CG 4.39Å; K301-E405 HydrophobicContact CG-CB 4.4Å; V401-E405 HydrophobicContact CG1-CG 4.5Å; V401-E405 WeakPolarHBondContact O-CB 3.48Å; V401-E405 WeakPolarHBondContact O-CG 3.26Å; V401-E405 PolarHBondContact O-N 3.16Å; E405-R408 VanDerWaalsContact CD-NH1 3.35Å; E405-R408 IonicContact OE1-CZ 2.64Å; E405-R408 IonicContact OE1-NH1 3.74Å; E405-R408 PolarHBondContact OE1-NH1 2.79Å; E405-R408 IonicContact OE2-NH1 3.87Å; E405-R408 PolarHBondContact OE2-NH1 3.48Å; E405-C409 PolarHBondContact O-SG 3.03Å
406	T	77.8	Confident	64.5	Low	36 Å²	36	73.6 Å²	73.6	22%	0.221	37%	0.369	C	S	.	.	H	α-helix	trans	-74.5	-39.9	176.3	56.4	0	0	0	0	112.6	M402 F403 R408 C409	M402-T406 HydrophobicContact CG-CG2 4.29Å; M402-T406 VanDerWaalsContact O-CB 3.25Å; M402-T406 WeakPolarHBondContact O-CB 3.48Å; M402-T406 WeakPolarHBondContact O-CG2 3.23Å; M402-T406 PolarHBondContact O-N 2.84Å; M402-T406 PolarHBondContact O-OG1 3.34Å; F403-T406 WeakPolarHBondContact CA-OG1 3.36Å; F403-T406 PolarHBondContact O-N 3.07Å; F403-T406 PolarHBondContact O-OG1 3.12Å; T406-R408 PolarHBondContact O-N 3.13Å; T406-C409 VanDerWaalsContact O-CB 3.27Å; T406-C409 WeakPolarHBondContact O-CB 3.16Å; T406-C409 PolarHBondContact O-N 2.78Å
407	K	70.1	Confident	62.9	Low	93 Å²	93	83.7 Å²	83.7	40%	0.404	42%	0.415	S	S	.	.	H	α-helix	trans	-63.8	-37.8	177	-89.1	-171.4	162.8	178.7	0	113.3	F403 C409 Q410 L411	F403-K407 HydrophobicContact CD1-CD 3.95Å; F403-K407 HydrophobicContact CD2-CD 4.44Å; F403-K407 HydrophobicContact CD2-CG 4.5Å; F403-K407 HydrophobicContact CE1-CD 3.52Å; F403-K407 VanDerWaalsContact CE1-CE 3.42Å; F403-K407 HydrophobicContact CE1-CG 4.5Å; F403-K407 HydrophobicContact CE2-CD 4.03Å; F403-K407 VanDerWaalsContact CE2-CE 3.5Å; F403-K407 HydrophobicContact CE2-CG 4.38Å; F403-K407 HydrophobicContact CG-CD 4.44Å; F403-K407 HydrophobicContact CZ-CD 3.63Å; F403-K407 HydrophobicContact CZ-CG 4.45Å; F403-K407 VanDerWaalsContact O-CB 3.31Å; F403-K407 WeakPolarHBondContact O-CB 3.4Å; F403-K407 PolarHBondContact O-N 3.38Å; K407-C409 PolarHBondContact O-N 2.67Å; K407-C409 VanDerWaalsContact O-N 3.15Å; K407-Q410 PolarHBondContact O-N 3.4Å; K407-L411 PolarHBondContact O-N 3.26Å; K407-L411 VanDerWaalsContact O-N 3.07Å
408	R	59.8	Low	62.2	Low	89 Å²	89	86.4 Å²	86.4	34%	0.336	42%	0.42	S	S	.	.	H	α-helix	trans	-53.7	-35.9	174.8	-80.3	-177.6	-175.6	149.2	10.4	111.9	K314 T404 E405 T406 Q410 L411 V412	K314-R408 VanDerWaalsContact CE-NH2 3.28Å; K314-R408 VanDerWaalsContact CG-NH2 3.31Å; T404-R408 WeakPolarHBondContact O-CG 3.49Å; T404-R408 PolarHBondContact O-N 3.33Å; E405-R408 VanDerWaalsContact CD-NH1 3.35Å; E405-R408 IonicContact OE1-CZ 2.64Å; E405-R408 IonicContact OE1-NH1 3.74Å; E405-R408 PolarHBondContact OE1-NH1 2.79Å; E405-R408 IonicContact OE2-NH1 3.87Å; E405-R408 PolarHBondContact OE2-NH1 3.48Å; T406-R408 PolarHBondContact O-N 3.13Å; R408-Q410 PolarHBondContact O-N 3Å; R408-L411 PolarHBondContact O-N 3.25Å; R408-V412 WeakPolarHBondContact O-CB 3.43Å; R408-V412 VanDerWaalsContact O-CG2 3.25Å; R408-V412 WeakPolarHBondContact O-CG2 3.19Å; R408-V412 PolarHBondContact O-N 2.89Å
409	C	52	Low	61.1	Low	27 Å²	27	90.8 Å²	90.8	18%	0.182	44%	0.442	C	S	.	.	H	α-helix	trans	-66.1	-39.3	178.1	-54.7	0	0	0	0	112.4	K301 E405 T406 K407 A413	K301-C409 VanDerWaalsContact CD-SG 3.56Å; K301-C409 WeakPolarHBondContact CE-SG 3.35Å; K301-C409 PolarHBondContact NZ-SG 3.06Å; E405-C409 PolarHBondContact O-SG 3.03Å; T406-C409 VanDerWaalsContact O-CB 3.27Å; T406-C409 WeakPolarHBondContact O-CB 3.16Å; T406-C409 PolarHBondContact O-N 2.78Å; K407-C409 PolarHBondContact O-N 2.67Å; K407-C409 VanDerWaalsContact O-N 3.15Å; C409-A413 WeakPolarHBondContact O-CB 3.26Å; C409-A413 PolarHBondContact O-N 3.03Å
410	Q	46	Very low	60	Low	131 Å²	131	88.3 Å²	88.3	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-70.8	-37.9	178.9	-65.1	-176.3	-10.3	0	0	111.8	K407 R408 R414	K407-Q410 PolarHBondContact O-N 3.4Å; R408-Q410 PolarHBondContact O-N 3Å; Q410-R414 WeakPolarHBondContact O-CG 3.33Å; Q410-R414 PolarHBondContact O-N 3.23Å; Q410-R414 VanDerWaalsContact O-N 3.1Å
411	L	40.7	Very low	58.8	Low	115 Å²	115	91.7 Å²	91.7	60%	0.602	45%	0.447	S	S	*	.	H	α-helix	trans	-71	-40.7	177.7	-71.6	168.9	0	0	0	112.4	K407 R408 R414 K415	K407-L411 PolarHBondContact O-N 3.26Å; K407-L411 VanDerWaalsContact O-N 3.07Å; R408-L411 PolarHBondContact O-N 3.25Å; L411-R414 PolarHBondContact O-N 3.1Å; L411-K415 PolarHBondContact O-N 2.99Å
412	V	47	Very low	57.4	Low	84 Å²	84	97.3 Å²	97.3	51%	0.509	47%	0.474	S	S	.	.	H	α-helix	trans	-68.9	-40.4	175.6	174.9	0	0	0	0	110.9	R408 R414 K415 N416	R408-V412 WeakPolarHBondContact O-CB 3.43Å; R408-V412 VanDerWaalsContact O-CG2 3.25Å; R408-V412 WeakPolarHBondContact O-CG2 3.19Å; R408-V412 PolarHBondContact O-N 2.89Å; V412-R414 VanDerWaalsContact C-N 3.28Å; V412-R414 PolarHBondContact O-N 2.87Å; V412-K415 PolarHBondContact O-N 3.25Å; V412-N416 PolarHBondContact O-N 3.31Å
413	A	44.3	Very low	55.7	Low	57 Å²	57	101.2 Å²	101.2	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-34.1	175.5	0	0	0	0	0	112.7	C409 M417	C409-A413 WeakPolarHBondContact O-CB 3.26Å; C409-A413 PolarHBondContact O-N 3.03Å; A413-M417 PolarHBondContact O-N 2.75Å
414	R	36.6	Very low	53.9	Low	198 Å²	198	101.1 Å²	101.1	75%	0.747	50%	0.496	S	S	*	.	H	α-helix	trans	-75.3	-21.9	175.2	-78.5	-176.3	179.5	-178.3	1	114.6	Q410 L411 V412	Q410-R414 WeakPolarHBondContact O-CG 3.33Å; Q410-R414 PolarHBondContact O-N 3.23Å; Q410-R414 VanDerWaalsContact O-N 3.1Å; L411-R414 PolarHBondContact O-N 3.1Å; V412-R414 VanDerWaalsContact C-N 3.28Å; V412-R414 PolarHBondContact O-N 2.87Å
415	K	42.2	Very low	52	Low	183 Å²	183	107.2 Å²	107.2	80%	0.796	52%	0.524	S	S	*	.	H	α-helix	trans	-84.8	-18.7	175	-79.1	-172	175	-175.3	0	113.2	L411 V412	L411-K415 PolarHBondContact O-N 2.99Å; V412-K415 PolarHBondContact O-N 3.25Å
416	N	42.7	Very low	49.7	Very low	137 Å²	137	114.5 Å²	114.5	73%	0.733	56%	0.56	S	S	*	*			trans	-104.2	3.9	-179.6	-67.4	-15.5	0	0	0	113.4	V412	V412-N416 PolarHBondContact O-N 3.31Å
417	M	37	Very low	47.1	Very low	224 Å²	224	121.6 Å²	121.6	100%	1.103	59%	0.591	S	S	*	*			trans	-103.5	0	161.6	-83.3	-174.4	156.7	0	0	108.1	A413	A413-M417 PolarHBondContact O-N 2.75Å

Retrieved 417 of 417 residues in 113.3 ms (Link to these results)

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