A0A087XJR2_POEFO Loading...

Serine/threonine-protein kinase receptor

AlphaFold DB , UniProt , Accession A0A087XJR2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 536 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	31.5	Very low	29.7	Very low	227 Å²	227	156.5 Å²	156.5	100%	1.118	80%	0.803	S	S	*	*				0	92.5	0	-79.3	175.5	-68	0	0	105.8
2	E	32	Very low	29.6	Very low	172 Å²	172	149.4 Å²	149.4	80%	0.804	80%	0.798	S	S	*	*				74.4	125.3	101.2	-75.1	-163.7	174.5	0	0	110
3	L	29.3	Very low	29.9	Very low	142 Å²	142	146 Å²	146	74%	0.743	80%	0.803	S	S	*	*			cis	-161	141.2	36	-118.4	135.9	0	0	0	110.6
4	L	29.8	Very low	30.1	Very low	131 Å²	131	144.7 Å²	144.7	69%	0.686	80%	0.801	S	S	*	*			trans	-54.5	150.3	158.9	-80.3	77.6	0	0	0	111.5	F6	L4-F6 HydrophobicContact CD2-CD2 4.01Å; L4-F6 HydrophobicContact CD2-CE2 4.02Å
5	R	30.3	Very low	30.1	Very low	244 Å²	244	146.5 Å²	146.5	92%	0.921	81%	0.808	S	S	*	*				-145.1	121.4	125.3	-79.1	-156.5	174.8	171.6	-1.5	112.2
6	F	30	Very low	30.3	Very low	169 Å²	169	150.2 Å²	150.2	74%	0.741	81%	0.814	S	S	*	*			trans	-62.4	147.5	159.8	-91.2	-115.6	0	0	0	111.3	L4 V8	L4-F6 HydrophobicContact CD2-CD2 4.01Å; L4-F6 HydrophobicContact CD2-CE2 4.02Å; F6-V8 HydrophobicContact CD1-CG2 3.94Å; F6-V8 HydrophobicContact CE1-CG2 4.38Å
7	S	29.3	Very low	30.1	Very low	123 Å²	123	145.2 Å²	145.2	86%	0.86	81%	0.806	S	S	*	*			trans	-149.1	131.8	130	67.6	0	0	0	0	110.6
8	V	30.8	Very low	30.3	Very low	99 Å²	99	145.8 Å²	145.8	60%	0.6	81%	0.805	S	S	*	*			trans	-95.4	163.2	-170.9	150.5	0	0	0	0	110.3	F6	F6-V8 HydrophobicContact CD1-CG2 3.94Å; F6-V8 HydrophobicContact CE1-CG2 4.38Å
9	F	29.3	Very low	30.5	Very low	185 Å²	185	144.9 Å²	144.9	81%	0.811	80%	0.804	S	S	*	*			trans	98.8	107.7	151.1	-92.6	-54.7	0	0	0	121
10	C	26.6	Very low	30.5	Very low	100 Å²	100	145.5 Å²	145.5	68%	0.676	81%	0.805	S	S	*	*				109.7	120.8	113.3	-122.9	0	0	0	0	120.2
11	C	28.3	Very low	30.4	Very low	129 Å²	129	145.7 Å²	145.7	87%	0.872	80%	0.804	S	S	*	*			trans	58.3	128.2	141.6	-79.2	0	0	0	0	121.1
12	G	28.2	Very low	30.5	Very low	72 Å²	72	140.5 Å²	140.5	74%	0.742	79%	0.787	S	S	*	*			trans	148.1	76.3	151.3	0	0	0	0	0	113.4	V14	G12-V14 PolarHBondContact O-N 2.86Å
13	A	34.2	Very low	30.3	Very low	105 Å²	105	138.5 Å²	138.5	87%	0.868	79%	0.786	S	S	*	*			trans	-68.2	119.1	160.2	0	0	0	0	0	108.7
14	V	31.5	Very low	30.4	Very low	128 Å²	128	139.5 Å²	139.5	78%	0.776	79%	0.787	S	S	*	*			trans	-137.6	105.3	160.9	-178.5	0	0	0	0	107.6	G12	G12-V14 PolarHBondContact O-N 2.86Å
15	L	31.2	Very low	30.4	Very low	172 Å²	172	138.6 Å²	138.6	90%	0.901	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66	123.4	170.3	-94.1	138.8	0	0	0	109.3
16	F	32.2	Very low	30.5	Very low	205 Å²	205	133.8 Å²	133.8	90%	0.899	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-76.4	124.2	168	-112.6	-96	0	0	0	109.4
17	G	28.1	Very low	30.7	Very low	66 Å²	66	131.2 Å²	131.2	68%	0.68	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-71.7	139	172.6	0	0	0	0	0	112.2
18	I	32.9	Very low	30.9	Very low	156 Å²	156	130.3 Å²	130.3	80%	0.8	77%	0.771	S	S	*	*			trans	-120.2	114.5	150.1	-67.4	178.8	0	0	0	105.7	L20	I18-L20 PolarHBondContact O-N 3.27Å
19	V	34.9	Very low	31.2	Very low	129 Å²	129	129.5 Å²	129.5	78%	0.782	78%	0.775	S	S	*	*			trans	-67.9	103.1	174.8	173.7	0	0	0	0	107.7	L21	V19-L21 HydrophobicContact CG1-CG 4.39Å
20	L	30.4	Very low	31.6	Very low	156 Å²	156	127.4 Å²	127.4	82%	0.817	77%	0.771	S	S	*	*			trans	-103.3	106.8	156.9	-76.9	166.1	0	0	0	106.1	I18 P22	I18-L20 PolarHBondContact O-N 3.27Å; L20-P22 WeakPolarHBondContact O-CD 3.3Å
21	L	28.3	Very low	32.7	Very low	150 Å²	150	126.8 Å²	126.8	79%	0.785	77%	0.766	S	S	*	*			trans	-59.1	121.2	168.5	-73.6	160.5	0	0	0	107.9	V19 V23	V19-L21 HydrophobicContact CG1-CG 4.39Å; L21-V23 PolarHBondContact O-N 2.71Å
22	P	32.3	Very low	33.9	Very low	118 Å²	118	126.6 Å²	126.6	77%	0.766	76%	0.76	S	S	*	*			trans	-70	121.3	164.2	19.8	-12.2	0	0	0	107.2	L20 E24	L20-P22 WeakPolarHBondContact O-CD 3.3Å; P22-E24 PolarHBondContact O-N 3.44Å
23	V	29.3	Very low	35.6	Very low	129 Å²	129	130 Å²	130	78%	0.782	75%	0.751	S	S	*	*			trans	-59.1	114.2	161.3	172.1	0	0	0	0	106.3	L21 T25	L21-V23 PolarHBondContact O-N 2.71Å; V23-T25 VanDerWaalsContact C-N 3.32Å; V23-T25 PolarHBondContact O-N 2.87Å
24	E	30.8	Very low	37.6	Very low	164 Å²	164	126.8 Å²	126.8	77%	0.766	72%	0.718	S	S	*	*			trans	-61.7	95.8	167.5	-77	-179.8	163.1	0	0	108.3	P22 N26	P22-E24 PolarHBondContact O-N 3.44Å; E24-N26 PolarHBondContact O-N 2.83Å; E24-N26 VanDerWaalsContact O-N 3.09Å
25	T	30.8	Very low	40.3	Very low	112 Å²	112	123 Å²	123	69%	0.687	69%	0.693	S	S	*	*			trans	-72	92.7	151.8	50.8	0	0	0	0	106.2	V23 T27	V23-T25 VanDerWaalsContact C-N 3.32Å; V23-T25 PolarHBondContact O-N 2.87Å; T25-T27 PolarHBondContact O-N 3.17Å
26	N	31	Very low	43.2	Very low	142 Å²	142	114.8 Å²	114.8	76%	0.759	65%	0.65	S	S	*	*			trans	-65.2	72.8	159.1	-92.6	-23.5	0	0	0	108.4	E24 S28	E24-N26 PolarHBondContact O-N 2.83Å; E24-N26 VanDerWaalsContact O-N 3.09Å; N26-S28 PolarHBondContact O-N 3.35Å
27	T	34.1	Very low	46.1	Very low	116 Å²	116	107.6 Å²	107.6	71%	0.712	62%	0.617	S	S	*	*			trans	-75.1	91.2	145.6	48.7	0	0	0	0	104.9	T25 A29	T25-T27 PolarHBondContact O-N 3.17Å; T27-A29 PolarHBondContact O-N 2.95Å
28	S	33.9	Very low	49.1	Very low	103 Å²	103	106.2 Å²	106.2	72%	0.72	59%	0.592	S	S	*	*			trans	-63.1	79.9	155.4	49.6	0	0	0	0	106.7	N26 I30	N26-S28 PolarHBondContact O-N 3.35Å; S28-I30 VanDerWaalsContact C-N 3.25Å; S28-I30 PolarHBondContact O-N 2.97Å
29	A	37.7	Very low	51.8	Low	82 Å²	82	99.3 Å²	99.3	68%	0.678	56%	0.558	S	S	*	*			trans	-57.8	103.8	155.2	0	0	0	0	0	104.1	T27 P31	T27-A29 PolarHBondContact O-N 2.95Å; A29-P31 VanDerWaalsContact O-CD 3.23Å; A29-P31 WeakPolarHBondContact O-CD 3.34Å
30	I	37.9	Very low	54.3	Low	142 Å²	142	100.1 Å²	100.1	73%	0.728	56%	0.558	S	S	*	*			trans	-56.3	115.1	170.2	-61.2	170.3	0	0	0	104.2	S28 V32	S28-I30 VanDerWaalsContact C-N 3.25Å; S28-I30 PolarHBondContact O-N 2.97Å; I30-V32 PolarHBondContact O-N 3.17Å
31	P	48.8	Very low	57.1	Low	87 Å²	87	97.5 Å²	97.5	57%	0.565	54%	0.544	S	S	*	.			trans	-59.9	120.5	179.5	22.5	-29.4	0	0	0	106.6	A29 R33 Y65	A29-P31 VanDerWaalsContact O-CD 3.23Å; A29-P31 WeakPolarHBondContact O-CD 3.34Å; P31-R33 PolarHBondContact O-N 2.84Å; P31-R33 VanDerWaalsContact O-N 3.09Å; P31-Y65 HydrophobicContact CG-CD1 4.44Å
32	V	53.9	Low	60	Low	124 Å²	124	93.6 Å²	93.6	75%	0.752	52%	0.519	S	S	*	.			trans	-55.6	121.6	176.3	-178.5	0	0	0	0	106.3	I30 Q34	I30-V32 PolarHBondContact O-N 3.17Å; V32-Q34 PolarHBondContact O-N 3.33Å; V32-Q34 VanDerWaalsContact O-N 3.08Å
33	R	64.4	Low	62.7	Low	145 Å²	145	91.6 Å²	91.6	55%	0.547	51%	0.512	S	S	.	.			trans	-59.1	114.6	-177.2	-86.8	177.2	175.9	-162.9	2.2	109	P31 L35 I61 Y65	P31-R33 PolarHBondContact O-N 2.84Å; P31-R33 VanDerWaalsContact O-N 3.09Å; R33-L35 PolarHBondContact O-N 3.31Å; R33-I61 HydrophobicContact CB-CB 4.42Å; R33-I61 HydrophobicContact CB-CD1 3.7Å; R33-I61 HydrophobicContact CB-CG1 4Å; R33-I61 HydrophobicContact CB-CG2 3.56Å; R33-I61 HydrophobicContact CG-CG2 3.91Å; R33-Y65 PolarHBondContact NH2-OH 2.87Å; R33-Y65 VanDerWaalsContact NH2-OH 3.12Å
34	Q	74.7	Confident	65.5	Low	37 Å²	37	86.5 Å²	86.5	17%	0.173	48%	0.481	C	S	.	.			trans	-63.1	121.4	-174	175.4	66.8	44.5	0	0	111.2	V32 I61 E126	V32-Q34 PolarHBondContact O-N 3.33Å; V32-Q34 VanDerWaalsContact O-N 3.08Å; Q34-I61 WeakPolarHBondContact O-CA 3.1Å; Q34-E126 PolarHBondContact NE2-O 3.4Å
35	L	88.4	Confident	68.2	Low	47 Å²	47	85.6 Å²	85.6	25%	0.246	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	129.2	173.7	-117.9	78.6	0	0	0	110.4	R33 T59 A60 I61 E127 E128	R33-L35 PolarHBondContact O-N 3.31Å; L35-T59 HydrophobicContact CB-CG2 4.21Å; L35-T59 HydrophobicContact CD2-CG2 3.34Å; L35-T59 HydrophobicContact CG-CG2 3.63Å; L35-A60 WeakPolarHBondContact CA-O 3.41Å; L35-I61 HydrophobicContact CD1-CD1 4.09Å; L35-I61 HydrophobicContact CD1-CG1 3.62Å; L35-E127 HydrophobicContact CB-CB 4.15Å; L35-E127 HydrophobicContact CB-CG 4.24Å; L35-E128 PolarHBondContact O-N 2.83Å
36	C	92.1	Very high	70.9	Confident	1 Å²	1	80.6 Å²	80.6	1%	0.007	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	151.4	175.5	-52.3	0	0	0	0	111	F38 T59 A60 C69	C36-F38 HydrophobicContact CB-CD2 4.42Å; C36-F38 HydrophobicContact CB-CE1 4.42Å; C36-F38 HydrophobicContact CB-CE2 3.56Å; C36-F38 HydrophobicContact CB-CZ 3.53Å; C36-F38 WeakPolarHBondContact O-CD2 3.25Å; C36-F38 WeakPolarHBondContact O-CE2 3.38Å; C36-T59 WeakPolarHBondContact O-CA 3.27Å; C36-T59 WeakPolarHBondContact O-CG2 3.43Å; C36-A60 PolarHBondContact N-O 2.79Å; C36-A60 PolarHBondContact O-N 3.07Å; C36-C69 VanDerWaalsContact CA-SG 3.57Å; C36-C69 HydrophobicContact CB-CB 3.69Å; C36-C69 WeakPolarHBondContact CB-SG 3.38Å; C36-C69 WeakPolarHBondContact SG-CA 3.26Å; C36-C69 WeakPolarHBondContact SG-CB 3.4Å; C36-C69 CovalentContact SG-SG 2.01Å; C36-C69 PolarHBondContact SG-SG 3.49Å
37	R	92.9	Very high	73.4	Confident	53 Å²	53	77.5 Å²	77.5	20%	0.2	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.9	166.8	-73.7	-79.9	-178.3	176.3	-10.9	110.7	C56 I58 T59 T84 E128 N130 D131	R37-C56 PolarHBondContact NH1-O 2.86Å; R37-I58 CarbonylContact C-O 3.51Å; R37-I58 WeakPolarHBondContact CA-O 3.28Å; R37-T59 WeakPolarHBondContact CD-OG1 3.17Å; R37-T59 PolarHBondContact NE-OG1 3.46Å; R37-T84 WeakPolarHBondContact O-CB 3.21Å; R37-T84 PolarHBondContact O-OG1 2.86Å; R37-E128 HydrophobicContact CG-CB 4.27Å; R37-E128 HydrophobicContact CG-CG 4.41Å; R37-E128 IonicContact CZ-OE1 2.68Å; R37-E128 IonicContact CZ-OE2 3.54Å; R37-E128 VanDerWaalsContact CZ-OE2 3.32Å; R37-E128 IonicContact NE-OE1 3.13Å; R37-E128 PolarHBondContact NE-OE1 3.35Å; R37-E128 IonicContact NE-OE2 2.79Å; R37-E128 PolarHBondContact NE-OE2 2.66Å; R37-E128 IonicContact NH2-OE1 2.67Å; R37-E128 PolarHBondContact NH2-OE1 3.29Å; R37-E128 IonicContact NH2-OE2 3.59Å; R37-E128 PolarHBondContact NH2-OE2 3.43Å; R37-N130 PolarHBondContact N-OD1 3.2Å; R37-N130 PolarHBondContact O-ND2 2.8Å; R37-D131 HydrophobicContact CG-CB 4.18Å; R37-D131 IonicContact NE-OD1 2.92Å
38	F	92.3	Very high	75.7	Confident	37 Å²	37	72.7 Å²	72.7	16%	0.162	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	133.9	-178.3	-68.5	-78.5	0	0	0	113.4	C36 C56 I58 A60 T84 C86	C36-F38 HydrophobicContact CB-CD2 4.42Å; C36-F38 HydrophobicContact CB-CE1 4.42Å; C36-F38 HydrophobicContact CB-CE2 3.56Å; C36-F38 HydrophobicContact CB-CZ 3.53Å; C36-F38 WeakPolarHBondContact O-CD2 3.25Å; C36-F38 WeakPolarHBondContact O-CE2 3.38Å; F38-C56 WeakPolarHBondContact O-CB 3.29Å; F38-I58 HydrophobicContact CB-CB 4.07Å; F38-I58 HydrophobicContact CB-CG2 4.03Å; F38-I58 PolarHBondContact N-O 2.87Å; F38-A60 HydrophobicContact CD2-CB 3.61Å; F38-A60 HydrophobicContact CE2-CB 3.63Å; F38-A60 WeakPolarHBondContact CE2-O 3.11Å; F38-T84 WeakPolarHBondContact CA-OG1 3.42Å; F38-C86 HydrophobicContact CE1-CB 4.45Å; F38-C86 WeakPolarHBondContact CE1-SG 3.26Å; F38-C86 WeakPolarHBondContact CZ-SG 3.44Å
39	C	87.9	Confident	78.2	Confident	11 Å²	11	76 Å²	76	7%	0.074	41%	0.409	C	S	.	.			trans	-154.6	135.5	166.7	34.1	0	0	0	0	110	C56 T84	C39-C56 HydrophobicContact CB-CB 3.56Å; C39-C56 WeakPolarHBondContact CB-SG 3.28Å; C39-C56 WeakPolarHBondContact SG-CB 3.12Å; C39-C56 CovalentContact SG-SG 2.02Å; C39-C56 PolarHBondContact SG-SG 3.1Å; C39-T84 PolarHBondContact N-OG1 2.9Å; C39-T84 PolarHBondContact O-N 2.9Å; C39-T84 VanDerWaalsContact O-N 3.11Å
40	D	88.5	Confident	80.5	Confident	147 Å²	147	73.9 Å²	73.9	79%	0.786	40%	0.396	S	S	*	.			trans	-62.3	162.7	167.2	-62.4	-38.4	0	0	0	110.6	R42	D40-R42 WeakPolarHBondContact O-CG 3.24Å; D40-R42 PolarHBondContact O-N 2.78Å
41	L	89.9	Confident	83	Confident	101 Å²	101	71.8 Å²	71.8	53%	0.529	39%	0.39	S	S	.	.	S	Bend	trans	-53.7	114.2	-179.7	-175.2	71.8	0	0	0	111.6	E83	L41-E83 HydrophobicContact CB-CB 4.32Å; L41-E83 HydrophobicContact CD1-CB 4.12Å; L41-E83 HydrophobicContact CD1-CG 4.38Å
42	R	88.6	Confident	85	Confident	67 Å²	67	68.4 Å²	68.4	25%	0.253	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	164.3	-176.6	65.9	-172.5	-169.9	145	17.5	112.2	D40 E55 C56 T81 F82	D40-R42 WeakPolarHBondContact O-CG 3.24Å; D40-R42 PolarHBondContact O-N 2.78Å; R42-E55 PolarHBondContact NH1-O 2.77Å; R42-E55 VanDerWaalsContact NH2-CA 3.35Å; R42-E55 PolarHBondContact NH2-O 2.79Å; R42-C56 PolarHBondContact NH2-SG 3.42Å; R42-T81 CarbonylContact O-C 3.58Å; R42-T81 WeakPolarHBondContact O-CA 3.47Å; R42-F82 PolarHBondContact N-O 2.9Å; R42-F82 PolarHBondContact O-N 3.43Å
43	A	88.9	Confident	86.7	Confident	76 Å²	76	68.6 Å²	68.6	63%	0.628	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	147.1	173	0	0	0	0	0	110.9	I80	A43-I80 WeakPolarHBondContact CA-O 3.38Å
44	T	88.6	Confident	87.8	Confident	22 Å²	22	62 Å²	62	14%	0.135	33%	0.334	C	S	.	.			trans	-136.4	146.1	175.7	-176.6	0	0	0	0	112	C46 I80 F82	T44-C46 VanDerWaalsContact C-N 3.25Å; T44-C46 HydrophobicContact CG2-CB 4.24Å; T44-C46 PolarHBondContact OG1-N 3.39Å; T44-C46 VanDerWaalsContact OG1-N 3.17Å; T44-I80 HydrophobicContact CG2-CB 4.43Å; T44-I80 HydrophobicContact CG2-CG2 3.58Å; T44-I80 PolarHBondContact N-O 3.16Å; T44-F82 HydrophobicContact CG2-CB 3.7Å
45	N	86.6	Confident	88.3	Confident	145 Å²	145	66 Å²	66	78%	0.775	35%	0.353	S	S	*	.			trans	-82.6	-0.6	172.3	-66.8	-35.7	0	0	0	113	P47	N45-P47 WeakPolarHBondContact O-CD 3.28Å
46	C	87.4	Confident	88.1	Confident	8 Å²	8	63.8 Å²	63.8	5%	0.054	34%	0.342	C	S	.	.			trans	-68.3	118.2	179.4	178.9	0	0	0	0	111	T44 G48 C52 W73 F135	T44-C46 VanDerWaalsContact C-N 3.25Å; T44-C46 HydrophobicContact CG2-CB 4.24Å; T44-C46 PolarHBondContact OG1-N 3.39Å; T44-C46 VanDerWaalsContact OG1-N 3.17Å; C46-G48 PolarHBondContact O-N 3.17Å; C46-G48 VanDerWaalsContact O-N 3.07Å; C46-C52 VanDerWaalsContact CA-SG 3.59Å; C46-C52 HydrophobicContact CB-CB 3.69Å; C46-C52 WeakPolarHBondContact CB-SG 3.47Å; C46-C52 WeakPolarHBondContact SG-CB 3.45Å; C46-C52 CovalentContact SG-SG 2.04Å; C46-C52 PolarHBondContact SG-SG 3.31Å; C46-W73 PolarHBondContact O-NE1 3.27Å; C46-F135 WeakPolarHBondContact SG-CE2 3.38Å
47	P	84.1	Confident	87.6	Confident	76 Å²	76	70.8 Å²	70.8	49%	0.494	38%	0.379	S	S	.	.			trans	-76.6	3.3	-169.3	31.2	-37.1	0	0	0	114.6	N45 R49	N45-P47 WeakPolarHBondContact O-CD 3.28Å; P47-R49 HydrophobicContact CB-CG 4.23Å; P47-R49 HydrophobicContact CG-CG 3.93Å
48	G	83.2	Confident	87.3	Confident	16 Å²	16	72.9 Å²	72.9	17%	0.165	39%	0.393	C	S	.	.	S	Bend	trans	74.5	25.2	-177.2	0	0	0	0	0	114.3	C46 F135	C46-G48 PolarHBondContact O-N 3.17Å; C46-G48 VanDerWaalsContact O-N 3.07Å; G48-F135 VanDerWaalsContact C-CG 3.49Å; G48-F135 WeakPolarHBondContact O-CD1 3.08Å
49	R	85.3	Confident	87.2	Confident	171 Å²	171	73.4 Å²	73.4	65%	0.645	40%	0.399	S	S	*	.	S	Bend	trans	-148.3	147.7	177.1	60.3	179.8	-177.7	-168.8	-0.4	110.7	P47 L137	P47-R49 HydrophobicContact CB-CG 4.23Å; P47-R49 HydrophobicContact CG-CG 3.93Å; R49-L137 HydrophobicContact CB-CD1 3.57Å
50	G	86.3	Confident	87.2	Confident	39 Å²	39	74.7 Å²	74.7	40%	0.402	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	73.4	-149.4	179.9	0	0	0	0	0	112.7	F135	G50-F135 PolarHBondContact O-N 3.31Å
51	V	90.3	Very high	87.2	Confident	97 Å²	97	71 Å²	71	59%	0.588	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	131	177.5	-175.6	0	0	0	0	108.7	H132 I133 I134	V51-H132 HydrophobicContact CG1-CB 4.31Å; V51-I133 WeakPolarHBondContact CA-O 3.36Å; V51-I134 HydrophobicContact CG1-CG1 4.34Å; V51-I134 HydrophobicContact CG2-CG1 4.2Å; V51-I134 HydrophobicContact CG2-CG2 4.28Å
52	C	90.5	Very high	87.1	Confident	16 Å²	16	66.8 Å²	66.8	11%	0.108	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	140.6	173	-62.8	0	0	0	0	109.7	C46 H132 I133	C46-C52 VanDerWaalsContact CA-SG 3.59Å; C46-C52 HydrophobicContact CB-CB 3.69Å; C46-C52 WeakPolarHBondContact CB-SG 3.47Å; C46-C52 WeakPolarHBondContact SG-CB 3.45Å; C46-C52 CovalentContact SG-SG 2.04Å; C46-C52 PolarHBondContact SG-SG 3.31Å; C52-H132 WeakPolarHBondContact O-CA 3.35Å; C52-I133 HydrophobicContact CB-CD1 4.11Å; C52-I133 HydrophobicContact CB-CG1 3.76Å; C52-I133 PolarHBondContact N-O 3.42Å; C52-I133 PolarHBondContact O-N 2.77Å
53	K	90.4	Very high	86.9	Confident	128 Å²	128	68.5 Å²	68.5	56%	0.557	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	137.8	164.4	-171.7	170	-177.3	165.3	0	109.3	D131	K53-D131 WeakPolarHBondContact CA-O 3.32Å; K53-D131 WeakPolarHBondContact CE-OD1 3.39Å; K53-D131 WeakPolarHBondContact CE-OD2 3.27Å; K53-D131 IonicContact NZ-OD2 3.47Å
54	V	86.5	Confident	86.7	Confident	7 Å²	7	70.6 Å²	70.6	4%	0.042	39%	0.386	C	S	.	.			trans	-85.5	114	179.6	173.8	0	0	0	0	108.4	C56 F82 N130 D131 I133	V54-C56 HydrophobicContact CG1-CB 3.79Å; V54-C56 WeakPolarHBondContact CG1-SG 3.38Å; V54-C56 PolarHBondContact O-N 3.26Å; V54-F82 HydrophobicContact CB-CE1 4.3Å; V54-F82 HydrophobicContact CB-CZ 4.38Å; V54-F82 HydrophobicContact CG1-CD1 4.28Å; V54-F82 HydrophobicContact CG1-CE1 3.37Å; V54-F82 HydrophobicContact CG1-CZ 3.85Å; V54-F82 HydrophobicContact CG2-CE1 3.95Å; V54-F82 HydrophobicContact CG2-CE2 4.34Å; V54-F82 HydrophobicContact CG2-CZ 3.56Å; V54-N130 VanDerWaalsContact CG2-O 3.29Å; V54-N130 WeakPolarHBondContact CG2-O 3.28Å; V54-D131 WeakPolarHBondContact CB-O 3.22Å; V54-D131 PolarHBondContact N-O 3.23Å; V54-I133 HydrophobicContact CG2-CB 4.48Å; V54-I133 HydrophobicContact CG2-CD1 4.33Å; V54-I133 HydrophobicContact CG2-CG1 4.17Å; V54-I133 HydrophobicContact CG2-CG2 3.68Å
55	E	86.3	Confident	86.4	Confident	120 Å²	120	76.8 Å²	76.8	56%	0.561	41%	0.408	S	S	*	.			trans	-78.2	39	-175.4	-60.7	173	164.2	0	0	112.7	R42	R42-E55 PolarHBondContact NH1-O 2.77Å; R42-E55 VanDerWaalsContact NH2-CA 3.35Å; R42-E55 PolarHBondContact NH2-O 2.79Å
56	C	84.8	Confident	86.5	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.014	40%	0.398	C	S	.	.			trans	-94.5	129.6	-170.2	-60.3	0	0	0	0	111.2	R37 F38 C39 R42 V54	R37-C56 PolarHBondContact NH1-O 2.86Å; F38-C56 WeakPolarHBondContact O-CB 3.29Å; C39-C56 HydrophobicContact CB-CB 3.56Å; C39-C56 WeakPolarHBondContact CB-SG 3.28Å; C39-C56 WeakPolarHBondContact SG-CB 3.12Å; C39-C56 CovalentContact SG-SG 2.02Å; C39-C56 PolarHBondContact SG-SG 3.1Å; R42-C56 PolarHBondContact NH2-SG 3.42Å; V54-C56 HydrophobicContact CG1-CB 3.79Å; V54-C56 WeakPolarHBondContact CG1-SG 3.38Å; V54-C56 PolarHBondContact O-N 3.26Å
57	D	80.9	Confident	86.7	Confident	148 Å²	148	76.5 Å²	76.5	79%	0.791	40%	0.404	S	S	*	.			trans	-86.8	-8	-167.1	-56.9	-42.3	0	0	0	113.7
58	I	86.5	Confident	87.1	Confident	97 Å²	97	73.3 Å²	73.3	50%	0.497	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.1	-176.5	-55.3	172.7	0	0	0	108.4	R37 F38	R37-I58 CarbonylContact C-O 3.51Å; R37-I58 WeakPolarHBondContact CA-O 3.28Å; F38-I58 HydrophobicContact CB-CB 4.07Å; F38-I58 HydrophobicContact CB-CG2 4.03Å; F38-I58 PolarHBondContact N-O 2.87Å
59	T	89.3	Confident	87.6	Confident	47 Å²	47	72.5 Å²	72.5	29%	0.288	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130	163.3	-58.5	0	0	0	0	107.3	L35 C36 R37 E128	L35-T59 HydrophobicContact CB-CG2 4.21Å; L35-T59 HydrophobicContact CD2-CG2 3.34Å; L35-T59 HydrophobicContact CG-CG2 3.63Å; C36-T59 WeakPolarHBondContact O-CA 3.27Å; C36-T59 WeakPolarHBondContact O-CG2 3.43Å; R37-T59 WeakPolarHBondContact CD-OG1 3.17Å; R37-T59 PolarHBondContact NE-OG1 3.46Å; T59-E128 WeakPolarHBondContact CB-OE1 3.48Å; T59-E128 HydrophobicContact CG2-CG 3.81Å; T59-E128 WeakPolarHBondContact CG2-OE1 3.46Å; T59-E128 PolarHBondContact OG1-OE1 2.89Å
60	A	88.2	Confident	88	Confident	39 Å²	39	64.4 Å²	64.4	32%	0.322	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	174.4	178.5	0	0	0	0	0	111.5	L35 C36 F38	L35-A60 WeakPolarHBondContact CA-O 3.41Å; C36-A60 PolarHBondContact N-O 2.79Å; C36-A60 PolarHBondContact O-N 3.07Å; F38-A60 HydrophobicContact CD2-CB 3.61Å; F38-A60 HydrophobicContact CE2-CB 3.63Å; F38-A60 WeakPolarHBondContact CE2-O 3.11Å
61	I	89.6	Confident	88.4	Confident	70 Å²	70	62.5 Å²	62.5	36%	0.359	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	142.8	172.8	-71	161	0	0	0	108.3	R33 Q34 L35	R33-I61 HydrophobicContact CB-CB 4.42Å; R33-I61 HydrophobicContact CB-CD1 3.7Å; R33-I61 HydrophobicContact CB-CG1 4Å; R33-I61 HydrophobicContact CB-CG2 3.56Å; R33-I61 HydrophobicContact CG-CG2 3.91Å; Q34-I61 WeakPolarHBondContact O-CA 3.1Å; L35-I61 HydrophobicContact CD1-CD1 4.09Å; L35-I61 HydrophobicContact CD1-CG1 3.62Å
62	C	87.6	Confident	88.5	Confident	11 Å²	11	57.9 Å²	57.9	7%	0.074	30%	0.298	C	S	.	.			trans	-62.3	133.2	172.5	-70	0	0	0	0	112.5	E64 E67 C86	C62-E64 VanDerWaalsContact C-N 3.29Å; C62-E64 PolarHBondContact O-N 3.2Å; C62-E67 HydrophobicContact CB-CB 3.62Å; C62-C86 WeakPolarHBondContact CA-SG 3.4Å; C62-C86 HydrophobicContact CB-CB 3.72Å; C62-C86 WeakPolarHBondContact CB-SG 3.31Å; C62-C86 WeakPolarHBondContact SG-CB 3.47Å; C62-C86 CovalentContact SG-SG 2.03Å; C62-C86 PolarHBondContact SG-SG 3.35Å
63	P	83.8	Confident	88.6	Confident	104 Å²	104	57.4 Å²	57.4	68%	0.675	29%	0.294	S	S	*	.	S	Bend	trans	-55.1	-41.2	-178.1	-27.5	33.8	0	0	0	114.2	E67	P63-E67 VanDerWaalsContact CD-OE2 3.29Å; P63-E67 WeakPolarHBondContact CD-OE2 3.19Å
64	E	85.8	Confident	88.7	Confident	120 Å²	120	53.4 Å²	53.4	56%	0.561	28%	0.275	S	S	*	.	S	Bend	trans	-103.1	147.2	-177	-61.2	-63.7	153.2	0	0	111.8	C62 N66 E67	C62-E64 VanDerWaalsContact C-N 3.29Å; C62-E64 PolarHBondContact O-N 3.2Å; E64-N66 PolarHBondContact O-N 2.85Å; E64-E67 HydrophobicContact CB-CG 3.89Å; E64-E67 PolarHBondContact N-OE2 2.81Å; E64-E67 VanDerWaalsContact N-OE2 3.13Å; E64-E67 PolarHBondContact O-N 2.88Å
65	Y	82.3	Confident	88.8	Confident	151 Å²	151	56.8 Å²	56.8	59%	0.592	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.5	-175.5	-74.1	-84.2	0	0	0	114.7	P31 R33	P31-Y65 HydrophobicContact CG-CD1 4.44Å; R33-Y65 PolarHBondContact NH2-OH 2.87Å; R33-Y65 VanDerWaalsContact NH2-OH 3.12Å
66	N	87.3	Confident	88.7	Confident	105 Å²	105	57.7 Å²	57.7	56%	0.561	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-5.5	-173.7	-45.6	-12.8	0	0	0	112	E64 P89	E64-N66 PolarHBondContact O-N 2.85Å; N66-P89 WeakPolarHBondContact O-CD 3.38Å
67	E	91.3	Very high	88.6	Confident	42 Å²	42	63.9 Å²	63.9	20%	0.196	32%	0.324	C	S	.	.			trans	-82.4	146.4	-174.6	-72.8	178.2	146.3	0	0	111.8	C62 P63 E64 C86 H87 D88	C62-E67 HydrophobicContact CB-CB 3.62Å; P63-E67 VanDerWaalsContact CD-OE2 3.29Å; P63-E67 WeakPolarHBondContact CD-OE2 3.19Å; E64-E67 HydrophobicContact CB-CG 3.89Å; E64-E67 PolarHBondContact N-OE2 2.81Å; E64-E67 VanDerWaalsContact N-OE2 3.13Å; E64-E67 PolarHBondContact O-N 2.88Å; E67-C86 HydrophobicContact CB-CB 3.99Å; E67-C86 HydrophobicContact CG-CB 4.29Å; E67-C86 WeakPolarHBondContact OE2-CB 3.25Å; E67-H87 WeakPolarHBondContact CA-O 3.37Å; E67-D88 HydrophobicContact CG-CB 4.47Å
68	V	92.9	Very high	88.4	Confident	9 Å²	9	64.2 Å²	64.2	6%	0.055	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	161.1	176.8	-59.2	0	0	0	0	110.7	V70 H87 P89 L98 Y101	V68-V70 HydrophobicContact CG2-CG2 3.95Å; V68-V70 PolarHBondContact O-N 2.83Å; V68-H87 PolarHBondContact N-O 3.09Å; V68-H87 PolarHBondContact O-N 2.9Å; V68-P89 HydrophobicContact CB-CG 4.46Å; V68-P89 HydrophobicContact CG1-CG 3.85Å; V68-P89 HydrophobicContact CG2-CG 3.77Å; V68-L98 HydrophobicContact CG2-CD1 4.31Å; V68-Y101 HydrophobicContact CG1-CD2 4Å; V68-Y101 HydrophobicContact CG1-CG 4.41Å
69	C	93.7	Very high	88.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	122.1	173.4	-44.3	0	0	0	0	109.1	C36 S122 C123 N130	C36-C69 VanDerWaalsContact CA-SG 3.57Å; C36-C69 HydrophobicContact CB-CB 3.69Å; C36-C69 WeakPolarHBondContact CB-SG 3.38Å; C36-C69 WeakPolarHBondContact SG-CA 3.26Å; C36-C69 WeakPolarHBondContact SG-CB 3.4Å; C36-C69 CovalentContact SG-SG 2.01Å; C36-C69 PolarHBondContact SG-SG 3.49Å; C69-S122 WeakPolarHBondContact O-CA 3.31Å; C69-C123 PolarHBondContact N-O 2.92Å; C69-C123 PolarHBondContact O-N 3.01Å; C69-N130 HydrophobicContact CB-CB 4.24Å
70	V	94.5	Very high	88.4	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130.4	175.1	-174.6	0	0	0	0	109.7	V68 I72 T84 V85 H87 L93 L98 I120 C121	V68-V70 HydrophobicContact CG2-CG2 3.95Å; V68-V70 PolarHBondContact O-N 2.83Å; V70-I72 HydrophobicContact CG1-CD1 4.42Å; V70-I72 HydrophobicContact CG1-CG1 4.12Å; V70-T84 CarbonylContact O-C 3.52Å; V70-T84 WeakPolarHBondContact O-CA 3.3Å; V70-T84 WeakPolarHBondContact O-CB 3.12Å; V70-V85 HydrophobicContact CB-CG2 3.92Å; V70-V85 WeakPolarHBondContact CB-O 3.25Å; V70-V85 HydrophobicContact CG1-CG2 4.37Å; V70-V85 PolarHBondContact N-O 3.17Å; V70-V85 PolarHBondContact O-N 2.87Å; V70-H87 HydrophobicContact CG2-CB 3.89Å; V70-L93 HydrophobicContact CB-CD2 4.4Å; V70-L93 HydrophobicContact CG1-CD2 3.78Å; V70-L93 HydrophobicContact CG2-CD2 4.45Å; V70-L98 HydrophobicContact CG2-CD1 3.56Å; V70-I120 HydrophobicContact CG1-CD1 3.88Å; V70-I120 HydrophobicContact CG1-CG1 3.77Å; V70-C121 WeakPolarHBondContact CA-O 3.33Å; V70-C121 WeakPolarHBondContact CG1-O 3.42Å
71	S	93.9	Very high	88.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.7	173.8	-64.9	0	0	0	0	110.6	T84 I120 C121 N130	S71-T84 VanDerWaalsContact OG-CG2 3.3Å; S71-T84 WeakPolarHBondContact OG-CG2 3.32Å; S71-I120 WeakPolarHBondContact O-CA 3.26Å; S71-C121 PolarHBondContact N-O 3.11Å; S71-C121 PolarHBondContact O-N 2.9Å; S71-N130 WeakPolarHBondContact OG-CB 3.2Å; S71-N130 PolarHBondContact OG-ND2 3.11Å
72	I	93	Very high	88.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	128.1	-173.1	-60.5	158.9	0	0	0	109.1	V70 R74 F82 E83 V85 L93 Y94 F118 F119 I120	V70-I72 HydrophobicContact CG1-CD1 4.42Å; V70-I72 HydrophobicContact CG1-CG1 4.12Å; I72-R74 HydrophobicContact CG2-CG 4.07Å; I72-R74 VanDerWaalsContact CG2-CZ 3.41Å; I72-F82 VanDerWaalsContact O-CA 3.32Å; I72-F82 WeakPolarHBondContact O-CA 3.44Å; I72-F82 VanDerWaalsContact O-CD2 3.29Å; I72-F82 WeakPolarHBondContact O-CD2 3.36Å; I72-E83 HydrophobicContact CB-CG 3.81Å; I72-E83 HydrophobicContact CD1-CG 4Å; I72-E83 VanDerWaalsContact CD1-OE1 3.3Å; I72-E83 WeakPolarHBondContact CD1-OE1 3.45Å; I72-E83 HydrophobicContact CG1-CG 4.46Å; I72-E83 HydrophobicContact CG2-CG 4.41Å; I72-E83 PolarHBondContact N-O 2.88Å; I72-E83 PolarHBondContact O-N 2.86Å; I72-V85 HydrophobicContact CD1-CG2 4.32Å; I72-L93 HydrophobicContact CD1-CD2 4.36Å; I72-Y94 HydrophobicContact CD1-CD2 4.35Å; I72-Y94 HydrophobicContact CD1-CE2 3.61Å; I72-F118 HydrophobicContact CG2-CD2 4.13Å; I72-F118 HydrophobicContact CG2-CE2 3.35Å; I72-F118 HydrophobicContact CG2-CZ 4.08Å; I72-F119 WeakPolarHBondContact CA-O 3.39Å; I72-I120 HydrophobicContact CD1-CD1 4.5Å; I72-I120 HydrophobicContact CG1-CD1 4.02Å; I72-I120 HydrophobicContact CG1-CG1 3.94Å
73	W	93	Very high	88.9	Confident	5 Å²	5	60.1 Å²	60.1	2%	0.019	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.1	176.8	-176.5	100.2	0	0	0	109.3	C46 K75 I80 F82 M108 K117 F119 F135	C46-W73 PolarHBondContact O-NE1 3.27Å; W73-K75 HydrophobicContact CH2-CB 3.41Å; W73-K75 VanDerWaalsContact CH2-CB 3.41Å; W73-K75 HydrophobicContact CH2-CD 4.09Å; W73-K75 HydrophobicContact CH2-CG 4.34Å; W73-K75 HydrophobicContact CZ2-CB 4.26Å; W73-K75 HydrophobicContact CZ3-CB 3.55Å; W73-I80 HydrophobicContact CD2-CG2 4.25Å; W73-I80 HydrophobicContact CH2-CG2 4.28Å; W73-I80 HydrophobicContact CZ2-CB 4.45Å; W73-I80 HydrophobicContact CZ2-CD1 4.2Å; W73-I80 HydrophobicContact CZ2-CG1 4.33Å; W73-I80 HydrophobicContact CZ2-CG2 3.31Å; W73-F82 HydrophobicContact CB-CD2 4.14Å; W73-M108 HydrophobicContact CB-CE 4.08Å; W73-M108 HydrophobicContact CB-SD 4.44Å; W73-K117 HydrophobicContact CZ3-CB 4.34Å; W73-F119 HydrophobicContact CB-CB 4.31Å; W73-F119 HydrophobicContact CE3-CB 4.47Å; W73-F119 AromaticContact CE3-CD2 3.71Å; W73-F119 HydrophobicContact CE3-CD2 3.71Å; W73-F119 HydrophobicContact CE3-CE2 4.45Å; W73-F119 HydrophobicContact CE3-CG 4.47Å; W73-F119 AromaticContact CZ3-CD2 3.91Å; W73-F119 HydrophobicContact CZ3-CD2 3.91Å; W73-F119 HydrophobicContact CZ3-CE2 4.22Å; W73-F119 PolarHBondContact N-O 2.9Å; W73-F119 PolarHBondContact O-N 2.61Å; W73-F135 HydrophobicContact CB-CE1 4.37Å; W73-F135 HydrophobicContact CB-CZ 4.06Å; W73-F135 AromaticContact CD1-CZ 3.86Å; W73-F135 HydrophobicContact CD2-CE1 4.14Å; W73-F135 HydrophobicContact CD2-CZ 4.08Å; W73-F135 HydrophobicContact CE3-CE1 4.4Å; W73-F135 HydrophobicContact CG-CE1 4.15Å; W73-F135 AromaticContact CG-CZ 3.74Å; W73-F135 HydrophobicContact CG-CZ 3.74Å
74	R	91.3	Very high	89.4	Confident	45 Å²	45	55.5 Å²	55.5	17%	0.17	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141	-179.9	-46.9	-160.6	173.3	74.4	-3.6	110.7	I72 I80 T81 E83 Y94 K117 F118	I72-R74 HydrophobicContact CG2-CG 4.07Å; I72-R74 VanDerWaalsContact CG2-CZ 3.41Å; R74-I80 WeakPolarHBondContact O-CA 3.42Å; R74-T81 PolarHBondContact N-O 3.33Å; R74-T81 PolarHBondContact O-N 2.92Å; R74-E83 IonicContact CZ-OE1 3.98Å; R74-E83 IonicContact NH1-OE1 2.81Å; R74-E83 PolarHBondContact NH1-OE1 2.82Å; R74-E83 IonicContact NH1-OE2 3.28Å; R74-E83 IonicContact NH2-OE1 2.82Å; R74-E83 PolarHBondContact NH2-OE1 3.33Å; R74-Y94 PolarHBondContact NH2-OH 2.83Å; R74-Y94 VanDerWaalsContact NH2-OH 3.16Å; R74-K117 WeakPolarHBondContact CA-O 3.38Å; R74-F118 HydrophobicContact CG-CD2 3.88Å; R74-F118 HydrophobicContact CG-CE2 4.32Å
75	K	88	Confident	89.7	Confident	78 Å²	78	51.9 Å²	51.9	34%	0.339	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.6	166.7	177.4	172.6	-177.5	170.3	0	110.2	W73 D77 N79 I80 S116 K117	W73-K75 HydrophobicContact CH2-CB 3.41Å; W73-K75 VanDerWaalsContact CH2-CB 3.41Å; W73-K75 HydrophobicContact CH2-CD 4.09Å; W73-K75 HydrophobicContact CH2-CG 4.34Å; W73-K75 HydrophobicContact CZ2-CB 4.26Å; W73-K75 HydrophobicContact CZ3-CB 3.55Å; K75-D77 WeakPolarHBondContact CE-O 3.45Å; K75-N79 WeakPolarHBondContact CA-O 3.39Å; K75-I80 HydrophobicContact CB-CG1 4.45Å; K75-I80 HydrophobicContact CD-CG1 4.27Å; K75-I80 HydrophobicContact CG-CG1 4.22Å; K75-S116 WeakPolarHBondContact O-CB 3.35Å; K75-K117 HydrophobicContact CB-CB 4.35Å; K75-K117 PolarHBondContact N-O 2.99Å; K75-K117 PolarHBondContact O-N 3.3Å; K75-K117 VanDerWaalsContact O-N 3.09Å
76	K	85.3	Confident	90.2	Very high	139 Å²	139	45.8 Å²	45.8	60%	0.604	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	115.9	171.1	-171.4	178.4	179.4	-178	0	107.6	D78 N79	K76-D78 PolarHBondContact O-N 3.43Å; K76-N79 PolarHBondContact N-O 3.16Å; K76-N79 PolarHBondContact O-N 3.08Å
77	D	82.7	Confident	90.5	Very high	132 Å²	132	42 Å²	42	71%	0.706	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	-116	-172.9	-49.5	-50.3	0	0	0	111.5	K75	K75-D77 WeakPolarHBondContact CE-O 3.45Å
78	D	77.3	Confident	90.6	Very high	154 Å²	154	41.7 Å²	41.7	82%	0.824	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-5.1	175.6	-72.5	-35	0	0	0	114	K76	K76-D78 PolarHBondContact O-N 3.43Å
79	N	84.5	Confident	90.5	Very high	96 Å²	96	41.8 Å²	41.8	51%	0.513	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120.8	179.3	-165.4	6.6	0	0	0	110.6	K75 K76	K75-N79 WeakPolarHBondContact CA-O 3.39Å; K76-N79 PolarHBondContact N-O 3.16Å; K76-N79 PolarHBondContact O-N 3.08Å
80	I	90.5	Very high	90.2	Very high	32 Å²	32	45.1 Å²	45.1	16%	0.164	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.1	177.2	-54.3	176.6	0	0	0	108	A43 T44 W73 R74 K75	A43-I80 WeakPolarHBondContact CA-O 3.38Å; T44-I80 HydrophobicContact CG2-CB 4.43Å; T44-I80 HydrophobicContact CG2-CG2 3.58Å; T44-I80 PolarHBondContact N-O 3.16Å; W73-I80 HydrophobicContact CD2-CG2 4.25Å; W73-I80 HydrophobicContact CH2-CG2 4.28Å; W73-I80 HydrophobicContact CZ2-CB 4.45Å; W73-I80 HydrophobicContact CZ2-CD1 4.2Å; W73-I80 HydrophobicContact CZ2-CG1 4.33Å; W73-I80 HydrophobicContact CZ2-CG2 3.31Å; R74-I80 WeakPolarHBondContact O-CA 3.42Å; K75-I80 HydrophobicContact CB-CG1 4.45Å; K75-I80 HydrophobicContact CD-CG1 4.27Å; K75-I80 HydrophobicContact CG-CG1 4.22Å
81	T	90.8	Very high	90.1	Very high	25 Å²	25	49.8 Å²	49.8	15%	0.153	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	152.7	-179.4	60.5	0	0	0	0	112.1	R42 R74	R42-T81 CarbonylContact O-C 3.58Å; R42-T81 WeakPolarHBondContact O-CA 3.47Å; R74-T81 PolarHBondContact N-O 3.33Å; R74-T81 PolarHBondContact O-N 2.92Å
82	F	92.3	Very high	89.9	Confident	3 Å²	3	53 Å²	53	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	141	-179.8	-175.3	-95.3	0	0	0	110	R42 T44 V54 I72 W73 T84 M108 I133	R42-F82 PolarHBondContact N-O 2.9Å; R42-F82 PolarHBondContact O-N 3.43Å; T44-F82 HydrophobicContact CG2-CB 3.7Å; V54-F82 HydrophobicContact CB-CE1 4.3Å; V54-F82 HydrophobicContact CB-CZ 4.38Å; V54-F82 HydrophobicContact CG1-CD1 4.28Å; V54-F82 HydrophobicContact CG1-CE1 3.37Å; V54-F82 HydrophobicContact CG1-CZ 3.85Å; V54-F82 HydrophobicContact CG2-CE1 3.95Å; V54-F82 HydrophobicContact CG2-CE2 4.34Å; V54-F82 HydrophobicContact CG2-CZ 3.56Å; I72-F82 VanDerWaalsContact O-CA 3.32Å; I72-F82 WeakPolarHBondContact O-CA 3.44Å; I72-F82 VanDerWaalsContact O-CD2 3.29Å; I72-F82 WeakPolarHBondContact O-CD2 3.36Å; W73-F82 HydrophobicContact CB-CD2 4.14Å; F82-T84 HydrophobicContact CD1-CG2 4.36Å; F82-T84 HydrophobicContact CE1-CG2 3.36Å; F82-T84 HydrophobicContact CZ-CG2 3.6Å; F82-M108 HydrophobicContact CE2-CE 3.82Å; F82-I133 HydrophobicContact CD2-CD1 4.13Å; F82-I133 HydrophobicContact CE2-CD1 3.63Å; F82-I133 HydrophobicContact CE2-CG2 4.17Å; F82-I133 HydrophobicContact CZ-CD1 4.37Å; F82-I133 HydrophobicContact CZ-CG2 4.22Å
83	E	93.3	Very high	89.6	Confident	22 Å²	22	54 Å²	54	10%	0.103	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	158.6	173	68.6	-174.5	174.3	0	0	109.5	L41 I72 R74 Y94	L41-E83 HydrophobicContact CB-CB 4.32Å; L41-E83 HydrophobicContact CD1-CB 4.12Å; L41-E83 HydrophobicContact CD1-CG 4.38Å; I72-E83 HydrophobicContact CB-CG 3.81Å; I72-E83 HydrophobicContact CD1-CG 4Å; I72-E83 VanDerWaalsContact CD1-OE1 3.3Å; I72-E83 WeakPolarHBondContact CD1-OE1 3.45Å; I72-E83 HydrophobicContact CG1-CG 4.46Å; I72-E83 HydrophobicContact CG2-CG 4.41Å; I72-E83 PolarHBondContact N-O 2.88Å; I72-E83 PolarHBondContact O-N 2.86Å; R74-E83 IonicContact CZ-OE1 3.98Å; R74-E83 IonicContact NH1-OE1 2.81Å; R74-E83 PolarHBondContact NH1-OE1 2.82Å; R74-E83 IonicContact NH1-OE2 3.28Å; R74-E83 IonicContact NH2-OE1 2.82Å; R74-E83 PolarHBondContact NH2-OE1 3.33Å; E83-Y94 PolarHBondContact OE1-OH 3.48Å
84	T	93.4	Very high	89.3	Confident	8 Å²	8	60.1 Å²	60.1	5%	0.049	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	144.5	170.9	62.5	0	0	0	0	110.7	R37 F38 C39 V70 S71 F82	R37-T84 WeakPolarHBondContact O-CB 3.21Å; R37-T84 PolarHBondContact O-OG1 2.86Å; F38-T84 WeakPolarHBondContact CA-OG1 3.42Å; C39-T84 PolarHBondContact N-OG1 2.9Å; C39-T84 PolarHBondContact O-N 2.9Å; C39-T84 VanDerWaalsContact O-N 3.11Å; V70-T84 CarbonylContact O-C 3.52Å; V70-T84 WeakPolarHBondContact O-CA 3.3Å; V70-T84 WeakPolarHBondContact O-CB 3.12Å; S71-T84 VanDerWaalsContact OG-CG2 3.3Å; S71-T84 WeakPolarHBondContact OG-CG2 3.32Å; F82-T84 HydrophobicContact CD1-CG2 4.36Å; F82-T84 HydrophobicContact CE1-CG2 3.36Å; F82-T84 HydrophobicContact CZ-CG2 3.6Å
85	V	92.8	Very high	88.7	Confident	43 Å²	43	61.1 Å²	61.1	26%	0.261	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	151.1	-176.7	-59.8	0	0	0	0	110.1	V70 I72 H87 L93	V70-V85 HydrophobicContact CB-CG2 3.92Å; V70-V85 WeakPolarHBondContact CB-O 3.25Å; V70-V85 HydrophobicContact CG1-CG2 4.37Å; V70-V85 PolarHBondContact N-O 3.17Å; V70-V85 PolarHBondContact O-N 2.87Å; I72-V85 HydrophobicContact CD1-CG2 4.32Å; V85-H87 HydrophobicContact CG2-CB 4.36Å; V85-L93 HydrophobicContact CG2-CD2 4.08Å
86	C	93	Very high	88.5	Confident	23 Å²	23	60.3 Å²	60.3	16%	0.155	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	135.4	157.9	-71.6	0	0	0	0	108.3	F38 C62 E67	F38-C86 HydrophobicContact CE1-CB 4.45Å; F38-C86 WeakPolarHBondContact CE1-SG 3.26Å; F38-C86 WeakPolarHBondContact CZ-SG 3.44Å; C62-C86 WeakPolarHBondContact CA-SG 3.4Å; C62-C86 HydrophobicContact CB-CB 3.72Å; C62-C86 WeakPolarHBondContact CB-SG 3.31Å; C62-C86 WeakPolarHBondContact SG-CB 3.47Å; C62-C86 CovalentContact SG-SG 2.03Å; C62-C86 PolarHBondContact SG-SG 3.35Å; E67-C86 HydrophobicContact CB-CB 3.99Å; E67-C86 HydrophobicContact CG-CB 4.29Å; E67-C86 WeakPolarHBondContact OE2-CB 3.25Å
87	H	93.6	Very high	88.5	Confident	26 Å²	26	60.1 Å²	60.1	12%	0.12	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	137.6	178.3	-173	76	0	0	0	110.8	E67 V68 V70 V85 P89 L91 L93 L98	E67-H87 WeakPolarHBondContact CA-O 3.37Å; V68-H87 PolarHBondContact N-O 3.09Å; V68-H87 PolarHBondContact O-N 2.9Å; V70-H87 HydrophobicContact CG2-CB 3.89Å; V85-H87 HydrophobicContact CG2-CB 4.36Å; H87-P89 VanDerWaalsContact O-CD 3.31Å; H87-P89 WeakPolarHBondContact O-CD 3.26Å; H87-L91 PolarHBondContact NE2-O 3.36Å; H87-L93 HydrophobicContact CB-CD2 4.02Å; H87-L98 HydrophobicContact CB-CD1 4.49Å
88	D	92.4	Very high	88.6	Confident	35 Å²	35	54.5 Å²	54.5	19%	0.187	30%	0.304	C	S	.	.			trans	-74.4	115.8	173.6	-174.9	-24.6	0	0	0	109.1	E67 A90 L91	E67-D88 HydrophobicContact CG-CB 4.47Å; D88-A90 PolarHBondContact O-N 2.92Å; D88-A90 WeakPolarHBondContact OD1-CB 3.48Å; D88-A90 PolarHBondContact OD1-N 2.95Å; D88-L91 HydrophobicContact CB-CD1 4.16Å; D88-L91 HydrophobicContact CB-CG 4.22Å; D88-L91 PolarHBondContact O-N 2.81Å
89	P	90.9	Very high	88.6	Confident	12 Å²	12	53.1 Å²	53.1	8%	0.078	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-21.9	178.8	-23.8	34.4	0	0	0	114.8	N66 V68 H87 L91 L98 Y101	N66-P89 WeakPolarHBondContact O-CD 3.38Å; V68-P89 HydrophobicContact CB-CG 4.46Å; V68-P89 HydrophobicContact CG1-CG 3.85Å; V68-P89 HydrophobicContact CG2-CG 3.77Å; H87-P89 VanDerWaalsContact O-CD 3.31Å; H87-P89 WeakPolarHBondContact O-CD 3.26Å; P89-L91 PolarHBondContact O-N 3.41Å; P89-L98 HydrophobicContact CB-CB 4.3Å; P89-Y101 HydrophobicContact CB-CD1 3.38Å; P89-Y101 HydrophobicContact CB-CD2 4.24Å; P89-Y101 HydrophobicContact CB-CE1 3.51Å; P89-Y101 HydrophobicContact CB-CE2 4.35Å; P89-Y101 HydrophobicContact CB-CG 3.76Å; P89-Y101 HydrophobicContact CG-CD1 3.7Å; P89-Y101 HydrophobicContact CG-CD2 3.7Å; P89-Y101 HydrophobicContact CG-CE1 4.07Å; P89-Y101 HydrophobicContact CG-CE2 4.07Å; P89-Y101 HydrophobicContact CG-CG 3.49Å; P89-Y101 VanDerWaalsContact CG-CG 3.49Å
90	A	88.4	Confident	88.2	Confident	70 Å²	70	51 Å²	51	58%	0.579	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.3	176.1	0	0	0	0	0	113.2	D88	D88-A90 PolarHBondContact O-N 2.92Å; D88-A90 WeakPolarHBondContact OD1-CB 3.48Å; D88-A90 PolarHBondContact OD1-N 2.95Å
91	L	90.9	Very high	87.8	Confident	98 Å²	98	53.9 Å²	53.9	51%	0.513	30%	0.295	S	S	.	.	S	Bend	trans	-104.1	149.6	177.9	-61.4	178.9	0	0	0	111.3	H87 D88 P89 L93	H87-L91 PolarHBondContact NE2-O 3.36Å; D88-L91 HydrophobicContact CB-CD1 4.16Å; D88-L91 HydrophobicContact CB-CG 4.22Å; D88-L91 PolarHBondContact O-N 2.81Å; P89-L91 PolarHBondContact O-N 3.41Å; L91-L93 PolarHBondContact O-N 2.92Å
92	P	90.1	Very high	87.4	Confident	68 Å²	68	57.8 Å²	57.8	44%	0.442	32%	0.315	S	S	.	.			trans	-74.2	127.8	176	29	-33.4	0	0	0	111.7	L96	P92-L96 CarbonylContact C-O 3.46Å; P92-L96 WeakPolarHBondContact CA-O 3.22Å
93	L	88.2	Confident	86.9	Confident	20 Å²	20	59.8 Å²	59.8	11%	0.105	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-106.2	117.6	171.7	-174.1	55.3	0	0	0	109.4	V70 I72 V85 H87 L91 G95 L96 I120	V70-L93 HydrophobicContact CB-CD2 4.4Å; V70-L93 HydrophobicContact CG1-CD2 3.78Å; V70-L93 HydrophobicContact CG2-CD2 4.45Å; I72-L93 HydrophobicContact CD1-CD2 4.36Å; V85-L93 HydrophobicContact CG2-CD2 4.08Å; H87-L93 HydrophobicContact CB-CD2 4.02Å; L91-L93 PolarHBondContact O-N 2.92Å; L93-G95 PolarHBondContact O-N 3.24Å; L93-L96 PolarHBondContact N-O 2.83Å; L93-L96 PolarHBondContact O-N 2.92Å; L93-I120 HydrophobicContact CD2-CD1 4.02Å
94	Y	84.8	Confident	86.7	Confident	133 Å²	133	61.4 Å²	61.4	52%	0.522	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	33.6	-170	-56.8	-75.1	0	0	0	114	I72 R74 E83 L96 F118	I72-Y94 HydrophobicContact CD1-CD2 4.35Å; I72-Y94 HydrophobicContact CD1-CE2 3.61Å; R74-Y94 PolarHBondContact NH2-OH 2.83Å; R74-Y94 VanDerWaalsContact NH2-OH 3.16Å; E83-Y94 PolarHBondContact OE1-OH 3.48Å; Y94-L96 VanDerWaalsContact C-N 3.28Å; Y94-L96 PolarHBondContact O-N 3.23Å; Y94-F118 HydrophobicContact CD2-CZ 4.25Å
95	G	80.4	Confident	86.5	Confident	66 Å²	66	66.5 Å²	66.5	68%	0.68	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	12.3	-178.8	0	0	0	0	0	114.5	L93	L93-G95 PolarHBondContact O-N 3.24Å
96	L	82.4	Confident	86.4	Confident	61 Å²	61	64.5 Å²	64.5	32%	0.319	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-118.5	143.3	176.9	-60.6	171.6	0	0	0	110.1	P92 L93 Y94 K111 F118	P92-L96 CarbonylContact C-O 3.46Å; P92-L96 WeakPolarHBondContact CA-O 3.22Å; L93-L96 PolarHBondContact N-O 2.83Å; L93-L96 PolarHBondContact O-N 2.92Å; Y94-L96 VanDerWaalsContact C-N 3.28Å; Y94-L96 PolarHBondContact O-N 3.23Å; L96-K111 HydrophobicContact CD1-CB 4.08Å; L96-K111 HydrophobicContact CD1-CD 3.97Å; L96-K111 HydrophobicContact CD1-CG 3.89Å; L96-F118 HydrophobicContact CD1-CE1 4Å
97	Y	85.1	Confident	86.4	Confident	135 Å²	135	66.3 Å²	66.3	53%	0.529	35%	0.354	S	S	.	.			trans	-85.6	147.3	167	-70.1	-85.6	0	0	0	110.1	D99	Y97-D99 PolarHBondContact O-N 3.4Å
98	L	86.3	Confident	86.2	Confident	14 Å²	14	65.5 Å²	65.5	7%	0.073	35%	0.35	C	S	.	.			trans	-86.7	101.3	176.1	-61.3	175.8	0	0	0	108.2	V68 V70 H87 P89 D100 Y101 I120	V68-L98 HydrophobicContact CG2-CD1 4.31Å; V70-L98 HydrophobicContact CG2-CD1 3.56Å; H87-L98 HydrophobicContact CB-CD1 4.49Å; P89-L98 HydrophobicContact CB-CB 4.3Å; L98-D100 VanDerWaalsContact C-N 3.3Å; L98-D100 PolarHBondContact O-N 3.34Å; L98-Y101 VanDerWaalsContact O-CD1 3.31Å; L98-Y101 WeakPolarHBondContact O-CD1 3.41Å; L98-I120 HydrophobicContact CD2-CD1 3.81Å; L98-I120 HydrophobicContact CD2-CG1 4.28Å
99	D	77.1	Confident	86.1	Confident	126 Å²	126	67.9 Å²	67.9	67%	0.674	36%	0.359	S	S	*	.	S	Bend	trans	-81.2	-9.8	-174.4	-48.9	-46.5	0	0	0	113.4	Y97 K111	Y97-D99 PolarHBondContact O-N 3.4Å; D99-K111 IonicContact OD2-NZ 3.41Å
100	D	76.1	Confident	85.9	Confident	51 Å²	51	73.1 Å²	73.1	27%	0.273	38%	0.382	S	S	.	.			trans	-147.2	60.8	-164.8	-162.9	13	0	0	0	112.5	L98 N103 K109 S122	L98-D100 VanDerWaalsContact C-N 3.3Å; L98-D100 PolarHBondContact O-N 3.34Å; D100-N103 PolarHBondContact O-ND2 2.93Å; D100-N103 PolarHBondContact OD1-ND2 3.31Å; D100-N103 PolarHBondContact OD1-OD1 2.81Å; D100-N103 PolarHBondContact OD2-ND2 3.3Å; D100-K109 VanDerWaalsContact CG-NZ 3.33Å; D100-K109 WeakPolarHBondContact OD2-CE 3.41Å; D100-K109 IonicContact OD2-NZ 3.1Å; D100-K109 PolarHBondContact OD2-NZ 3.45Å; D100-S122 VanDerWaalsContact C-OG 3.28Å; D100-S122 VanDerWaalsContact O-O 3.11Å; D100-S122 PolarHBondContact O-OG 3.23Å
101	Y	81.2	Confident	85.8	Confident	92 Å²	92	72.1 Å²	72.1	36%	0.361	37%	0.365	S	S	.	.			trans	-97	-13.2	-175	58.1	-91.3	0	0	0	114.6	V68 P89 L98 N103 S122 C123 S124	V68-Y101 HydrophobicContact CG1-CD2 4Å; V68-Y101 HydrophobicContact CG1-CG 4.41Å; P89-Y101 HydrophobicContact CB-CD1 3.38Å; P89-Y101 HydrophobicContact CB-CD2 4.24Å; P89-Y101 HydrophobicContact CB-CE1 3.51Å; P89-Y101 HydrophobicContact CB-CE2 4.35Å; P89-Y101 HydrophobicContact CB-CG 3.76Å; P89-Y101 HydrophobicContact CG-CD1 3.7Å; P89-Y101 HydrophobicContact CG-CD2 3.7Å; P89-Y101 HydrophobicContact CG-CE1 4.07Å; P89-Y101 HydrophobicContact CG-CE2 4.07Å; P89-Y101 HydrophobicContact CG-CG 3.49Å; P89-Y101 VanDerWaalsContact CG-CG 3.49Å; L98-Y101 VanDerWaalsContact O-CD1 3.31Å; L98-Y101 WeakPolarHBondContact O-CD1 3.41Å; Y101-N103 PolarHBondContact O-N 3.32Å; Y101-S122 WeakPolarHBondContact CA-OG 3.33Å; Y101-S122 PolarHBondContact N-OG 3.21Å; Y101-C123 CarbonylContact O-C 3.51Å; Y101-S124 WeakPolarHBondContact O-CB 3.34Å; Y101-S124 PolarHBondContact O-N 3.2Å; Y101-S124 PolarHBondContact O-OG 3.22Å
102	N	82.3	Confident	84.8	Confident	108 Å²	108	77.7 Å²	77.7	58%	0.578	39%	0.385	S	S	*	.			trans	-82.3	13.4	178.1	-76.8	-7.9	0	0	0	114	S124 N125	N102-S124 WeakPolarHBondContact CA-OG 3.27Å; N102-N125 PolarHBondContact O-ND2 3.25Å
103	N	83.2	Confident	83.7	Confident	44 Å²	44	76.7 Å²	76.7	24%	0.235	38%	0.382	C	S	.	.			trans	-80.3	141.1	178	-73.6	-43	0	0	0	111.6	D100 Y101 K105 C123 S124	D100-N103 PolarHBondContact O-ND2 2.93Å; D100-N103 PolarHBondContact OD1-ND2 3.31Å; D100-N103 PolarHBondContact OD1-OD1 2.81Å; D100-N103 PolarHBondContact OD2-ND2 3.3Å; Y101-N103 PolarHBondContact O-N 3.32Å; N103-K105 PolarHBondContact O-N 2.81Å; N103-C123 CarbonylContact O-C 3.58Å; N103-C123 WeakPolarHBondContact O-CA 3.47Å; N103-C123 WeakPolarHBondContact O-CB 3.21Å; N103-S124 CarbonylContact C-O 3.54Å; N103-S124 PolarHBondContact O-N 3.08Å
104	T	87.4	Confident	82.4	Confident	56 Å²	56	85.6 Å²	85.6	34%	0.344	42%	0.42	S	S	.	.	S	Bend	trans	-75.8	-12	173.2	66	0	0	0	0	113.9	N125 E126 C129	T104-N125 HydrophobicContact CG2-CB 4.39Å; T104-E126 VanDerWaalsContact CB-CD 3.47Å; T104-E126 VanDerWaalsContact CB-OE1 3.25Å; T104-E126 WeakPolarHBondContact CB-OE1 3.39Å; T104-E126 HydrophobicContact CG2-CG 4.05Å; T104-E126 PolarHBondContact OG1-OE1 3.12Å; T104-C129 VanDerWaalsContact O-CB 3.26Å; T104-C129 WeakPolarHBondContact O-CB 3.39Å
105	K	89.8	Confident	81.4	Confident	116 Å²	116	86.4 Å²	86.4	50%	0.504	43%	0.434	S	S	.	.	S	Bend	trans	-130.6	143.8	-179.8	-63	-174.9	-179.5	-177.4	0	111.7	N103 I107 I134	N103-K105 PolarHBondContact O-N 2.81Å; K105-I107 PolarHBondContact O-N 2.84Å; K105-I107 VanDerWaalsContact O-N 3.09Å; K105-I134 HydrophobicContact CB-CD1 4.29Å; K105-I134 HydrophobicContact CD-CD1 4.22Å
106	C	91.8	Very high	80.9	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	92.1	179	-147.2	0	0	0	0	112.2	C121 C123 C129 N130 I133 I134	C106-C121 VanDerWaalsContact C-SG 3.56Å; C106-C121 HydrophobicContact CB-CB 4.07Å; C106-C121 WeakPolarHBondContact CB-SG 3.48Å; C106-C121 WeakPolarHBondContact SG-CB 3.42Å; C106-C121 CovalentContact SG-SG 2.03Å; C106-C121 PolarHBondContact SG-SG 2.93Å; C106-C123 HydrophobicContact CB-CB 4.42Å; C106-C129 PolarHBondContact N-O 2.99Å; C106-N130 HydrophobicContact CB-CB 4.16Å; C106-I133 HydrophobicContact CB-CG2 4.34Å; C106-I134 PolarHBondContact O-N 3.16Å
107	I	91.7	Very high	80.9	Confident	62 Å²	62	88.4 Å²	88.4	32%	0.318	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	111.5	179	-57.3	171.7	0	0	0	110.2	K105 K109 C121 N136	K105-I107 PolarHBondContact O-N 2.84Å; K105-I107 VanDerWaalsContact O-N 3.09Å; I107-K109 PolarHBondContact O-N 2.88Å; I107-C121 WeakPolarHBondContact O-CB 3.29Å; I107-N136 HydrophobicContact CG2-CB 4.44Å
108	M	90.7	Very high	81	Confident	8 Å²	8	82.7 Å²	82.7	4%	0.039	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	122.9	-176	-75.5	-70	-176.6	0	0	111.9	W73 F82 F119 C121 I133 I134 F135	W73-M108 HydrophobicContact CB-CE 4.08Å; W73-M108 HydrophobicContact CB-SD 4.44Å; F82-M108 HydrophobicContact CE2-CE 3.82Å; M108-F119 HydrophobicContact CB-CB 4.22Å; M108-F119 HydrophobicContact CB-CD1 3.99Å; M108-F119 HydrophobicContact SD-CB 3.83Å; M108-C121 VanDerWaalsContact CE-SG 3.57Å; M108-C121 HydrophobicContact SD-CB 4.14Å; M108-C121 VanDerWaalsContact SD-SG 3.63Å; M108-I133 HydrophobicContact CE-CB 3.85Å; M108-I133 HydrophobicContact CE-CD1 3.89Å; M108-I133 HydrophobicContact CE-CG1 4.46Å; M108-I133 HydrophobicContact CE-CG2 3.65Å; M108-I133 HydrophobicContact CG-CB 4.19Å; M108-I134 WeakPolarHBondContact CB-O 3.36Å; M108-I134 PolarHBondContact N-O 2.95Å; M108-F135 HydrophobicContact CB-CD1 3.71Å; M108-F135 HydrophobicContact CB-CE1 3.85Å; M108-F135 HydrophobicContact CB-CG 4.15Å; M108-F135 HydrophobicContact CB-CZ 4.37Å; M108-F135 HydrophobicContact CG-CD1 4.07Å; M108-F135 HydrophobicContact CG-CD2 4.45Å; M108-F135 HydrophobicContact CG-CE1 3.77Å; M108-F135 HydrophobicContact CG-CE2 4.15Å; M108-F135 HydrophobicContact CG-CG 4.4Å; M108-F135 HydrophobicContact CG-CZ 3.81Å; M108-F135 HydrophobicContact SD-CE1 4.47Å; M108-F135 HydrophobicContact SD-CZ 4.49Å
109	K	88.9	Confident	81.2	Confident	86 Å²	86	83.5 Å²	83.5	37%	0.374	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.8	175.6	-65	-176.1	-176.9	178.6	0	110.8	D100 I107 F119 I120	D100-K109 VanDerWaalsContact CG-NZ 3.33Å; D100-K109 WeakPolarHBondContact OD2-CE 3.41Å; D100-K109 IonicContact OD2-NZ 3.1Å; D100-K109 PolarHBondContact OD2-NZ 3.45Å; I107-K109 PolarHBondContact O-N 2.88Å; K109-F119 WeakPolarHBondContact O-CA 3.41Å; K109-I120 PolarHBondContact N-O 3.48Å; K109-I120 PolarHBondContact O-N 2.86Å; K109-I120 VanDerWaalsContact O-N 3.11Å
110	E	88.1	Confident	81.9	Confident	121 Å²	121	77.9 Å²	77.9	57%	0.565	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	133.6	175.2	-167.8	172.9	-167	0	0	110.3	F119	E110-F119 HydrophobicContact CB-CD1 4.04Å; E110-F119 HydrophobicContact CB-CE1 3.53Å; E110-F119 HydrophobicContact CB-CE2 4.36Å; E110-F119 HydrophobicContact CB-CZ 3.7Å; E110-F119 HydrophobicContact CG-CE1 4.18Å; E110-F119 HydrophobicContact CG-CE2 4.12Å; E110-F119 HydrophobicContact CG-CZ 3.83Å
111	K	85.7	Confident	82.7	Confident	49 Å²	49	75.7 Å²	75.7	21%	0.213	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.9	176.7	-68	-65.9	-172.9	172	0	107.9	L96 D99 A113 F118 I120	L96-K111 HydrophobicContact CD1-CB 4.08Å; L96-K111 HydrophobicContact CD1-CD 3.97Å; L96-K111 HydrophobicContact CD1-CG 3.89Å; D99-K111 IonicContact OD2-NZ 3.41Å; K111-A113 PolarHBondContact O-N 3.29Å; K111-F118 HydrophobicContact CB-CD1 3.47Å; K111-F118 VanDerWaalsContact CB-CD1 3.47Å; K111-F118 HydrophobicContact CB-CE1 3.93Å; K111-F118 HydrophobicContact CG-CD1 4.26Å; K111-F118 HydrophobicContact CG-CE1 4.26Å; K111-F118 PolarHBondContact N-O 2.85Å; K111-I120 HydrophobicContact CD-CG2 4.49Å; K111-I120 HydrophobicContact CG-CG2 3.69Å
112	K	70.2	Confident	83.3	Confident	216 Å²	216	71.7 Å²	71.7	94%	0.939	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	111.7	-173.6	-67.3	-176.7	178.6	-179.7	0	110.5
113	A	67.3	Low	83.7	Confident	46 Å²	46	66.5 Å²	66.5	38%	0.38	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	147.4	164.2	0	0	0	0	0	109.3	K111 D115 F118	K111-A113 PolarHBondContact O-N 3.29Å; A113-D115 PolarHBondContact O-N 3.28Å; A113-F118 HydrophobicContact CB-CB 4.49Å
114	K	60.3	Low	83.9	Confident	208 Å²	208	65 Å²	65	90%	0.904	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.6	-168.7	-84.8	179.4	174	177.2	0	114.6
115	D	63.6	Low	83.5	Confident	150 Å²	150	67.5 Å²	67.5	80%	0.802	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.2	19.5	-174.8	-57.3	-62.4	0	0	0	114.7	A113	A113-D115 PolarHBondContact O-N 3.28Å
116	S	70.6	Confident	83.2	Confident	46 Å²	46	66.4 Å²	66.4	32%	0.322	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	148.6	179	57.1	0	0	0	0	112.5	K75	K75-S116 WeakPolarHBondContact O-CB 3.35Å
117	K	80.8	Confident	83.1	Confident	122 Å²	122	73 Å²	73	53%	0.53	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	122.2	171.8	-73.6	-172.2	177.3	-171.7	0	108.5	W73 R74 K75 F119	W73-K117 HydrophobicContact CZ3-CB 4.34Å; R74-K117 WeakPolarHBondContact CA-O 3.38Å; K75-K117 HydrophobicContact CB-CB 4.35Å; K75-K117 PolarHBondContact N-O 2.99Å; K75-K117 PolarHBondContact O-N 3.3Å; K75-K117 VanDerWaalsContact O-N 3.09Å; K117-F119 HydrophobicContact CB-CE2 4.47Å
118	F	87.6	Confident	83	Confident	16 Å²	16	72.4 Å²	72.4	7%	0.07	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123	-174.8	175.5	-113.6	0	0	0	108.4	I72 R74 Y94 L96 K111 A113 I120	I72-F118 HydrophobicContact CG2-CD2 4.13Å; I72-F118 HydrophobicContact CG2-CE2 3.35Å; I72-F118 HydrophobicContact CG2-CZ 4.08Å; R74-F118 HydrophobicContact CG-CD2 3.88Å; R74-F118 HydrophobicContact CG-CE2 4.32Å; Y94-F118 HydrophobicContact CD2-CZ 4.25Å; L96-F118 HydrophobicContact CD1-CE1 4Å; K111-F118 HydrophobicContact CB-CD1 3.47Å; K111-F118 VanDerWaalsContact CB-CD1 3.47Å; K111-F118 HydrophobicContact CB-CE1 3.93Å; K111-F118 HydrophobicContact CG-CD1 4.26Å; K111-F118 HydrophobicContact CG-CE1 4.26Å; K111-F118 PolarHBondContact N-O 2.85Å; A113-F118 HydrophobicContact CB-CB 4.49Å; F118-I120 HydrophobicContact CE1-CB 4.38Å; F118-I120 HydrophobicContact CE1-CG2 4.44Å; F118-I120 HydrophobicContact CZ-CB 4.26Å; F118-I120 HydrophobicContact CZ-CD1 4.3Å
119	F	91.3	Very high	83.1	Confident	30 Å²	30	72.4 Å²	72.4	13%	0.132	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140.1	176	-73.8	-101.3	0	0	0	109.6	I72 W73 M108 K109 E110 K117 F135	I72-F119 WeakPolarHBondContact CA-O 3.39Å; W73-F119 HydrophobicContact CB-CB 4.31Å; W73-F119 HydrophobicContact CE3-CB 4.47Å; W73-F119 AromaticContact CE3-CD2 3.71Å; W73-F119 HydrophobicContact CE3-CD2 3.71Å; W73-F119 HydrophobicContact CE3-CE2 4.45Å; W73-F119 HydrophobicContact CE3-CG 4.47Å; W73-F119 AromaticContact CZ3-CD2 3.91Å; W73-F119 HydrophobicContact CZ3-CD2 3.91Å; W73-F119 HydrophobicContact CZ3-CE2 4.22Å; W73-F119 PolarHBondContact N-O 2.9Å; W73-F119 PolarHBondContact O-N 2.61Å; M108-F119 HydrophobicContact CB-CB 4.22Å; M108-F119 HydrophobicContact CB-CD1 3.99Å; M108-F119 HydrophobicContact SD-CB 3.83Å; K109-F119 WeakPolarHBondContact O-CA 3.41Å; E110-F119 HydrophobicContact CB-CD1 4.04Å; E110-F119 HydrophobicContact CB-CE1 3.53Å; E110-F119 HydrophobicContact CB-CE2 4.36Å; E110-F119 HydrophobicContact CB-CZ 3.7Å; E110-F119 HydrophobicContact CG-CE1 4.18Å; E110-F119 HydrophobicContact CG-CE2 4.12Å; E110-F119 HydrophobicContact CG-CZ 3.83Å; K117-F119 HydrophobicContact CB-CE2 4.47Å; F119-F135 HydrophobicContact CB-CE1 4.09Å; F119-F135 AromaticContact CD1-CD1 3.97Å; F119-F135 HydrophobicContact CD1-CD1 3.97Å; F119-F135 HydrophobicContact CD1-CE1 4.12Å; F119-F135 HydrophobicContact CD2-CE1 4.28Å; F119-F135 HydrophobicContact CE1-CD1 4.17Å; F119-F135 HydrophobicContact CG-CD1 4.22Å; F119-F135 AromaticContact CG-CE1 3.92Å; F119-F135 HydrophobicContact CG-CE1 3.92Å
120	I	92.1	Very high	83.3	Confident	8 Å²	8	68.3 Å²	68.3	4%	0.041	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	140.3	177.9	-168.4	164.8	0	0	0	109.6	V70 S71 I72 L93 L98 K109 K111 F118	V70-I120 HydrophobicContact CG1-CD1 3.88Å; V70-I120 HydrophobicContact CG1-CG1 3.77Å; S71-I120 WeakPolarHBondContact O-CA 3.26Å; I72-I120 HydrophobicContact CD1-CD1 4.5Å; I72-I120 HydrophobicContact CG1-CD1 4.02Å; I72-I120 HydrophobicContact CG1-CG1 3.94Å; L93-I120 HydrophobicContact CD2-CD1 4.02Å; L98-I120 HydrophobicContact CD2-CD1 3.81Å; L98-I120 HydrophobicContact CD2-CG1 4.28Å; K109-I120 PolarHBondContact N-O 3.48Å; K109-I120 PolarHBondContact O-N 2.86Å; K109-I120 VanDerWaalsContact O-N 3.11Å; K111-I120 HydrophobicContact CD-CG2 4.49Å; K111-I120 HydrophobicContact CG-CG2 3.69Å; F118-I120 HydrophobicContact CE1-CB 4.38Å; F118-I120 HydrophobicContact CE1-CG2 4.44Å; F118-I120 HydrophobicContact CZ-CB 4.26Å; F118-I120 HydrophobicContact CZ-CD1 4.3Å
121	C	92.6	Very high	83.5	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.034	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	150.4	168.1	59.3	0	0	0	0	110.8	V70 S71 C106 I107 M108	V70-C121 WeakPolarHBondContact CA-O 3.33Å; V70-C121 WeakPolarHBondContact CG1-O 3.42Å; S71-C121 PolarHBondContact N-O 3.11Å; S71-C121 PolarHBondContact O-N 2.9Å; C106-C121 VanDerWaalsContact C-SG 3.56Å; C106-C121 HydrophobicContact CB-CB 4.07Å; C106-C121 WeakPolarHBondContact CB-SG 3.48Å; C106-C121 WeakPolarHBondContact SG-CB 3.42Å; C106-C121 CovalentContact SG-SG 2.03Å; C106-C121 PolarHBondContact SG-SG 2.93Å; I107-C121 WeakPolarHBondContact O-CB 3.29Å; M108-C121 VanDerWaalsContact CE-SG 3.57Å; M108-C121 HydrophobicContact SD-CB 4.14Å; M108-C121 VanDerWaalsContact SD-SG 3.63Å
122	S	93.1	Very high	83.8	Confident	8 Å²	8	65.4 Å²	65.4	6%	0.056	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.6	175.7	45.9	0	0	0	0	108.6	C69 D100 Y101	C69-S122 WeakPolarHBondContact O-CA 3.31Å; D100-S122 VanDerWaalsContact C-OG 3.28Å; D100-S122 VanDerWaalsContact O-O 3.11Å; D100-S122 PolarHBondContact O-OG 3.23Å; Y101-S122 WeakPolarHBondContact CA-OG 3.33Å; Y101-S122 PolarHBondContact N-OG 3.21Å
123	C	91.8	Very high	84.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	154.3	178.2	62.8	0	0	0	0	111.8	C69 Y101 N103 C106 C129	C69-C123 PolarHBondContact N-O 2.92Å; C69-C123 PolarHBondContact O-N 3.01Å; Y101-C123 CarbonylContact O-C 3.51Å; N103-C123 CarbonylContact O-C 3.58Å; N103-C123 WeakPolarHBondContact O-CA 3.47Å; N103-C123 WeakPolarHBondContact O-CB 3.21Å; C106-C123 HydrophobicContact CB-CB 4.42Å; C123-C129 HydrophobicContact CB-CB 3.7Å; C123-C129 WeakPolarHBondContact CB-SG 3.38Å; C123-C129 PolarHBondContact O-SG 3.12Å; C123-C129 WeakPolarHBondContact SG-CB 3.27Å; C123-C129 PolarHBondContact SG-O 2.83Å; C123-C129 CovalentContact SG-SG 2.04Å; C123-C129 PolarHBondContact SG-SG 3.06Å
124	S	86.9	Confident	86	Confident	11 Å²	11	55.2 Å²	55.2	8%	0.077	27%	0.271	C	S	.	.			trans	-155.2	165.6	177.3	56.9	0	0	0	0	109.5	Y101 N102 N103	Y101-S124 WeakPolarHBondContact O-CB 3.34Å; Y101-S124 PolarHBondContact O-N 3.2Å; Y101-S124 PolarHBondContact O-OG 3.22Å; N102-S124 WeakPolarHBondContact CA-OG 3.27Å; N103-S124 CarbonylContact C-O 3.54Å; N103-S124 PolarHBondContact O-N 3.08Å
125	N	79.3	Confident	87.4	Confident	110 Å²	110	45.7 Å²	45.7	59%	0.588	23%	0.23	S	C	*	.	S	Bend	trans	83.3	2.9	175.1	-43.6	-55.8	0	0	0	117	N102 T104	N102-N125 PolarHBondContact O-ND2 3.25Å; T104-N125 HydrophobicContact CG2-CB 4.39Å
126	E	83.6	Confident	88	Confident	93 Å²	93	43.8 Å²	43.8	44%	0.435	22%	0.219	S	C	.	.	S	Bend	trans	-138.3	134.4	168	-83.5	-176.1	-155.2	0	0	109.7	Q34 T104 E128 C129	Q34-E126 PolarHBondContact NE2-O 3.4Å; T104-E126 VanDerWaalsContact CB-CD 3.47Å; T104-E126 VanDerWaalsContact CB-OE1 3.25Å; T104-E126 WeakPolarHBondContact CB-OE1 3.39Å; T104-E126 HydrophobicContact CG2-CG 4.05Å; T104-E126 PolarHBondContact OG1-OE1 3.12Å; E126-E128 PolarHBondContact O-N 3.32Å; E126-C129 HydrophobicContact CB-CB 4.32Å; E126-C129 VanDerWaalsContact O-CB 3.29Å; E126-C129 WeakPolarHBondContact O-CB 3.4Å; E126-C129 PolarHBondContact O-N 3.32Å; E126-C129 VanDerWaalsContact O-N 3.15Å
127	E	88.8	Confident	87.4	Confident	137 Å²	137	47.8 Å²	47.8	64%	0.64	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	134.8	177.8	-65.9	-176.7	-179.5	0	0	111.3	L35 C129	L35-E127 HydrophobicContact CB-CB 4.15Å; L35-E127 HydrophobicContact CB-CG 4.24Å; E127-C129 PolarHBondContact O-N 3.5Å
128	E	90.6	Very high	86	Confident	50 Å²	50	47.4 Å²	47.4	23%	0.234	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	36.8	-176.1	-52.3	-169	167.6	0	0	113.2	L35 R37 T59 E126 N130 D131	L35-E128 PolarHBondContact O-N 2.83Å; R37-E128 HydrophobicContact CG-CB 4.27Å; R37-E128 HydrophobicContact CG-CG 4.41Å; R37-E128 IonicContact CZ-OE1 2.68Å; R37-E128 IonicContact CZ-OE2 3.54Å; R37-E128 VanDerWaalsContact CZ-OE2 3.32Å; R37-E128 IonicContact NE-OE1 3.13Å; R37-E128 PolarHBondContact NE-OE1 3.35Å; R37-E128 IonicContact NE-OE2 2.79Å; R37-E128 PolarHBondContact NE-OE2 2.66Å; R37-E128 IonicContact NH2-OE1 2.67Å; R37-E128 PolarHBondContact NH2-OE1 3.29Å; R37-E128 IonicContact NH2-OE2 3.59Å; R37-E128 PolarHBondContact NH2-OE2 3.43Å; T59-E128 WeakPolarHBondContact CB-OE1 3.48Å; T59-E128 HydrophobicContact CG2-CG 3.81Å; T59-E128 WeakPolarHBondContact CG2-OE1 3.46Å; T59-E128 PolarHBondContact OG1-OE1 2.89Å; E126-E128 PolarHBondContact O-N 3.32Å; E128-N130 PolarHBondContact O-N 2.69Å; E128-D131 HydrophobicContact CB-CB 4.18Å; E128-D131 WeakPolarHBondContact O-CB 3.28Å; E128-D131 PolarHBondContact O-N 3.25Å
129	C	91.4	Very high	84	Confident	9 Å²	9	52 Å²	52	6%	0.061	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-17.5	179.8	66.8	0	0	0	0	114.8	T104 C106 C123 E126 E127	T104-C129 VanDerWaalsContact O-CB 3.26Å; T104-C129 WeakPolarHBondContact O-CB 3.39Å; C106-C129 PolarHBondContact N-O 2.99Å; C123-C129 HydrophobicContact CB-CB 3.7Å; C123-C129 WeakPolarHBondContact CB-SG 3.38Å; C123-C129 PolarHBondContact O-SG 3.12Å; C123-C129 WeakPolarHBondContact SG-CB 3.27Å; C123-C129 PolarHBondContact SG-O 2.83Å; C123-C129 CovalentContact SG-SG 2.04Å; C123-C129 PolarHBondContact SG-SG 3.06Å; E126-C129 HydrophobicContact CB-CB 4.32Å; E126-C129 VanDerWaalsContact O-CB 3.29Å; E126-C129 WeakPolarHBondContact O-CB 3.4Å; E126-C129 PolarHBondContact O-N 3.32Å; E126-C129 VanDerWaalsContact O-N 3.15Å; E127-C129 PolarHBondContact O-N 3.5Å
130	N	93.3	Very high	82	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	9	178.4	73	-35.8	0	0	0	114.9	R37 V54 C69 S71 C106 E128 H132	R37-N130 PolarHBondContact N-OD1 3.2Å; R37-N130 PolarHBondContact O-ND2 2.8Å; V54-N130 VanDerWaalsContact CG2-O 3.29Å; V54-N130 WeakPolarHBondContact CG2-O 3.28Å; C69-N130 HydrophobicContact CB-CB 4.24Å; S71-N130 WeakPolarHBondContact OG-CB 3.2Å; S71-N130 PolarHBondContact OG-ND2 3.11Å; C106-N130 HydrophobicContact CB-CB 4.16Å; E128-N130 PolarHBondContact O-N 2.69Å; N130-H132 PolarHBondContact O-N 2.79Å
131	D	92.4	Very high	79.9	Confident	18 Å²	18	61 Å²	61	10%	0.096	32%	0.322	C	S	.	.	S	Bend	trans	-63.3	-31.9	171.8	-175.3	49.4	0	0	0	112	R37 K53 V54 E128	R37-D131 HydrophobicContact CG-CB 4.18Å; R37-D131 IonicContact NE-OD1 2.92Å; K53-D131 WeakPolarHBondContact CA-O 3.32Å; K53-D131 WeakPolarHBondContact CE-OD1 3.39Å; K53-D131 WeakPolarHBondContact CE-OD2 3.27Å; K53-D131 IonicContact NZ-OD2 3.47Å; V54-D131 WeakPolarHBondContact CB-O 3.22Å; V54-D131 PolarHBondContact N-O 3.23Å; E128-D131 HydrophobicContact CB-CB 4.18Å; E128-D131 WeakPolarHBondContact O-CB 3.28Å; E128-D131 PolarHBondContact O-N 3.25Å
132	H	92.3	Very high	78	Confident	91 Å²	91	63 Å²	63	42%	0.421	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.1	174.1	-71.8	-81.7	0	0	0	111	V51 C52 N130	V51-H132 HydrophobicContact CG1-CB 4.31Å; C52-H132 WeakPolarHBondContact O-CA 3.35Å; N130-H132 PolarHBondContact O-N 2.79Å
133	I	92	Very high	76.2	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.6	176.3	59	175.1	0	0	0	110.3	V51 C52 V54 F82 C106 M108 F135	V51-I133 WeakPolarHBondContact CA-O 3.36Å; C52-I133 HydrophobicContact CB-CD1 4.11Å; C52-I133 HydrophobicContact CB-CG1 3.76Å; C52-I133 PolarHBondContact N-O 3.42Å; C52-I133 PolarHBondContact O-N 2.77Å; V54-I133 HydrophobicContact CG2-CB 4.48Å; V54-I133 HydrophobicContact CG2-CD1 4.33Å; V54-I133 HydrophobicContact CG2-CG1 4.17Å; V54-I133 HydrophobicContact CG2-CG2 3.68Å; F82-I133 HydrophobicContact CD2-CD1 4.13Å; F82-I133 HydrophobicContact CE2-CD1 3.63Å; F82-I133 HydrophobicContact CE2-CG2 4.17Å; F82-I133 HydrophobicContact CZ-CD1 4.37Å; F82-I133 HydrophobicContact CZ-CG2 4.22Å; C106-I133 HydrophobicContact CB-CG2 4.34Å; M108-I133 HydrophobicContact CE-CB 3.85Å; M108-I133 HydrophobicContact CE-CD1 3.89Å; M108-I133 HydrophobicContact CE-CG1 4.46Å; M108-I133 HydrophobicContact CE-CG2 3.65Å; M108-I133 HydrophobicContact CG-CB 4.19Å; I133-F135 HydrophobicContact CD1-CE2 3.63Å; I133-F135 HydrophobicContact CD1-CZ 3.97Å; I133-F135 HydrophobicContact CG1-CE2 3.92Å
134	I	91.9	Very high	74.5	Confident	46 Å²	46	70.8 Å²	70.8	24%	0.236	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	109.8	-171.4	-54.5	172.7	0	0	0	109.3	V51 K105 C106 M108 N136	V51-I134 HydrophobicContact CG1-CG1 4.34Å; V51-I134 HydrophobicContact CG2-CG1 4.2Å; V51-I134 HydrophobicContact CG2-CG2 4.28Å; K105-I134 HydrophobicContact CB-CD1 4.29Å; K105-I134 HydrophobicContact CD-CD1 4.22Å; C106-I134 PolarHBondContact O-N 3.16Å; M108-I134 WeakPolarHBondContact CB-O 3.36Å; M108-I134 PolarHBondContact N-O 2.95Å; I134-N136 PolarHBondContact O-N 2.9Å
135	F	88.8	Confident	73.2	Confident	8 Å²	8	74.5 Å²	74.5	4%	0.035	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	96.3	171.7	-63.4	-93.3	0	0	0	108.9	C46 G48 G50 W73 M108 F119 I133 L137	C46-F135 WeakPolarHBondContact SG-CE2 3.38Å; G48-F135 VanDerWaalsContact C-CG 3.49Å; G48-F135 WeakPolarHBondContact O-CD1 3.08Å; G50-F135 PolarHBondContact O-N 3.31Å; W73-F135 HydrophobicContact CB-CE1 4.37Å; W73-F135 HydrophobicContact CB-CZ 4.06Å; W73-F135 AromaticContact CD1-CZ 3.86Å; W73-F135 HydrophobicContact CD2-CE1 4.14Å; W73-F135 HydrophobicContact CD2-CZ 4.08Å; W73-F135 HydrophobicContact CE3-CE1 4.4Å; W73-F135 HydrophobicContact CG-CE1 4.15Å; W73-F135 AromaticContact CG-CZ 3.74Å; W73-F135 HydrophobicContact CG-CZ 3.74Å; M108-F135 HydrophobicContact CB-CD1 3.71Å; M108-F135 HydrophobicContact CB-CE1 3.85Å; M108-F135 HydrophobicContact CB-CG 4.15Å; M108-F135 HydrophobicContact CB-CZ 4.37Å; M108-F135 HydrophobicContact CG-CD1 4.07Å; M108-F135 HydrophobicContact CG-CD2 4.45Å; M108-F135 HydrophobicContact CG-CE1 3.77Å; M108-F135 HydrophobicContact CG-CE2 4.15Å; M108-F135 HydrophobicContact CG-CG 4.4Å; M108-F135 HydrophobicContact CG-CZ 3.81Å; M108-F135 HydrophobicContact SD-CE1 4.47Å; M108-F135 HydrophobicContact SD-CZ 4.49Å; F119-F135 HydrophobicContact CB-CE1 4.09Å; F119-F135 AromaticContact CD1-CD1 3.97Å; F119-F135 HydrophobicContact CD1-CD1 3.97Å; F119-F135 HydrophobicContact CD1-CE1 4.12Å; F119-F135 HydrophobicContact CD2-CE1 4.28Å; F119-F135 HydrophobicContact CE1-CD1 4.17Å; F119-F135 HydrophobicContact CG-CD1 4.22Å; F119-F135 AromaticContact CG-CE1 3.92Å; F119-F135 HydrophobicContact CG-CE1 3.92Å; I133-F135 HydrophobicContact CD1-CE2 3.63Å; I133-F135 HydrophobicContact CD1-CZ 3.97Å; I133-F135 HydrophobicContact CG1-CE2 3.92Å; F135-L137 PolarHBondContact O-N 3.5Å
136	N	75.9	Confident	72.4	Confident	110 Å²	110	73.5 Å²	73.5	59%	0.588	41%	0.407	S	S	*	.			trans	-79.2	102.8	177.1	-156.1	-8.9	0	0	0	109.4	I107 I134 N138	I107-N136 HydrophobicContact CG2-CB 4.44Å; I134-N136 PolarHBondContact O-N 2.9Å; N136-N138 PolarHBondContact O-N 3.43Å
137	L	57.8	Low	71.7	Confident	130 Å²	130	74.1 Å²	74.1	68%	0.681	42%	0.417	S	S	*	.			trans	-74.4	2.3	177.4	-99.5	149.6	0	0	0	113.8	R49 F135	R49-L137 HydrophobicContact CB-CD1 3.57Å; F135-L137 PolarHBondContact O-N 3.5Å
138	N	51.9	Low	70.8	Confident	113 Å²	113	70.6 Å²	70.6	60%	0.604	41%	0.408	S	S	*	.			trans	-124	68.6	-177.5	-83.7	-13	0	0	0	112.2	N136	N136-N138 PolarHBondContact O-N 3.43Å
139	S	46.2	Very low	70	Confident	114 Å²	114	72.6 Å²	72.6	80%	0.797	42%	0.419	S	S	*	.	S	Bend	trans	-95.3	88.2	151.4	-157.9	0	0	0	0	107.9
140	Q	48.3	Very low	69.5	Low	152 Å²	152	75.6 Å²	75.6	71%	0.71	44%	0.438	S	S	*	.	S	Bend	trans	163.4	-5	143.5	-87.7	-169.6	26.4	0	0	115.3	V144	Q140-V144 VanDerWaalsContact O-CG2 3.24Å; Q140-V144 WeakPolarHBondContact O-CG2 3.27Å
141	V	49.7	Very low	68.9	Low	74 Å²	74	78.7 Å²	78.7	45%	0.448	46%	0.458	S	S	.	.	H	α-helix	trans	-82.6	-35.3	-176.5	-156.3	0	0	0	0	112.9	V144 I145	V141-V144 PolarHBondContact O-N 3.49Å; V141-I145 HydrophobicContact CG1-CD1 3.67Å; V141-I145 HydrophobicContact CG1-CG1 4.09Å; V141-I145 WeakPolarHBondContact O-CG1 3.4Å; V141-I145 PolarHBondContact O-N 2.93Å
142	G	52.6	Low	68.6	Low	47 Å²	47	83.1 Å²	83.1	49%	0.485	48%	0.481	S	S	.	.	H	α-helix	trans	-59.1	-51.3	-178.5	0	0	0	0	0	114.5	V144 V146	G142-V144 VanDerWaalsContact C-N 3.33Å; G142-V144 PolarHBondContact O-N 2.97Å; G142-V146 VanDerWaalsContact O-CG2 3.3Å; G142-V146 WeakPolarHBondContact O-CG2 3.23Å; G142-V146 PolarHBondContact O-N 2.97Å
143	P	55.4	Low	68.3	Low	88 Å²	88	83.9 Å²	83.9	57%	0.571	49%	0.487	S	S	*	.	H	α-helix	trans	-66.2	-34.7	178.9	-19.1	30.9	0	0	0	112.7	V146 V147	P143-V146 PolarHBondContact O-N 3.19Å; P143-V147 VanDerWaalsContact O-CB 3.32Å; P143-V147 WeakPolarHBondContact O-CB 3.49Å; P143-V147 WeakPolarHBondContact O-CG2 3.19Å; P143-V147 PolarHBondContact O-N 2.79Å
144	V	55.4	Low	68.2	Low	83 Å²	83	87.9 Å²	87.9	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-71.9	-39.2	-176.9	177.3	0	0	0	0	111.5	Q140 V141 G142 S148	Q140-V144 VanDerWaalsContact O-CG2 3.24Å; Q140-V144 WeakPolarHBondContact O-CG2 3.27Å; V141-V144 PolarHBondContact O-N 3.49Å; G142-V144 VanDerWaalsContact C-N 3.33Å; G142-V144 PolarHBondContact O-N 2.97Å; V144-S148 WeakPolarHBondContact O-CB 3.39Å; V144-S148 PolarHBondContact O-N 2.77Å; V144-S148 PolarHBondContact O-OG 2.82Å
145	I	59.2	Low	68.1	Low	90 Å²	90	90.6 Å²	90.6	46%	0.462	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-44.3	175	-68.5	175.9	0	0	0	110.3	V141 S148 L149	V141-I145 HydrophobicContact CG1-CD1 3.67Å; V141-I145 HydrophobicContact CG1-CG1 4.09Å; V141-I145 WeakPolarHBondContact O-CG1 3.4Å; V141-I145 PolarHBondContact O-N 2.93Å; I145-S148 PolarHBondContact O-N 3.09Å; I145-L149 HydrophobicContact CG2-CD1 3.63Å; I145-L149 HydrophobicContact CG2-CG 4.37Å; I145-L149 VanDerWaalsContact O-CB 3.28Å; I145-L149 WeakPolarHBondContact O-CB 3.27Å; I145-L149 WeakPolarHBondContact O-CG 3.39Å; I145-L149 PolarHBondContact O-N 2.74Å
146	V	63.6	Low	68.2	Low	88 Å²	88	92.3 Å²	92.3	53%	0.533	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-45.9	-179.8	174.5	0	0	0	0	111.2	G142 P143 S148 V150	G142-V146 VanDerWaalsContact O-CG2 3.3Å; G142-V146 WeakPolarHBondContact O-CG2 3.23Å; G142-V146 PolarHBondContact O-N 2.97Å; P143-V146 PolarHBondContact O-N 3.19Å; V146-S148 VanDerWaalsContact C-N 3.32Å; V146-S148 PolarHBondContact O-N 3.44Å; V146-V150 HydrophobicContact CG1-CG2 3.98Å; V146-V150 WeakPolarHBondContact O-CB 3.22Å; V146-V150 WeakPolarHBondContact O-CG2 3.47Å; V146-V150 PolarHBondContact O-N 3.25Å
147	V	67.4	Low	69	Low	106 Å²	106	91.8 Å²	91.8	64%	0.642	54%	0.538	S	S	*	.	H	α-helix	trans	-69.6	-28.2	179.6	174.2	0	0	0	0	112.3	P143 P151	P143-V147 VanDerWaalsContact O-CB 3.32Å; P143-V147 WeakPolarHBondContact O-CB 3.49Å; P143-V147 WeakPolarHBondContact O-CG2 3.19Å; P143-V147 PolarHBondContact O-N 2.79Å; V147-P151 VanDerWaalsContact O-CD 3.23Å; V147-P151 WeakPolarHBondContact O-CD 3.16Å; V147-P151 VanDerWaalsContact O-CG 3.27Å; V147-P151 WeakPolarHBondContact O-CG 3.19Å
148	S	70	Confident	70.6	Confident	64 Å²	64	92.8 Å²	92.8	45%	0.448	54%	0.537	S	S	.	.	H	α-helix	trans	-89	-37.4	-178.8	-52.6	0	0	0	0	113.7	V144 I145 V146 L152	V144-S148 WeakPolarHBondContact O-CB 3.39Å; V144-S148 PolarHBondContact O-N 2.77Å; V144-S148 PolarHBondContact O-OG 2.82Å; I145-S148 PolarHBondContact O-N 3.09Å; V146-S148 VanDerWaalsContact C-N 3.32Å; V146-S148 PolarHBondContact O-N 3.44Å; S148-L152 WeakPolarHBondContact O-CD1 3.31Å
149	L	74.8	Confident	72.5	Confident	91 Å²	91	91.8 Å²	91.8	48%	0.476	53%	0.534	S	S	.	.	H	α-helix	trans	-95.6	-30.6	-172.4	-63.8	-179.9	0	0	0	113.9	I145 L152 L153	I145-L149 HydrophobicContact CG2-CD1 3.63Å; I145-L149 HydrophobicContact CG2-CG 4.37Å; I145-L149 VanDerWaalsContact O-CB 3.28Å; I145-L149 WeakPolarHBondContact O-CB 3.27Å; I145-L149 WeakPolarHBondContact O-CG 3.39Å; I145-L149 PolarHBondContact O-N 2.74Å; L149-L152 PolarHBondContact O-N 3.37Å; L149-L153 PolarHBondContact O-N 3.46Å
150	V	79.6	Confident	74.6	Confident	73 Å²	73	91.9 Å²	91.9	44%	0.442	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-42.9	-179.2	175.8	0	0	0	0	112.1	V146 L152 L153 V154	V146-V150 HydrophobicContact CG1-CG2 3.98Å; V146-V150 WeakPolarHBondContact O-CB 3.22Å; V146-V150 WeakPolarHBondContact O-CG2 3.47Å; V146-V150 PolarHBondContact O-N 3.25Å; V150-L152 VanDerWaalsContact C-N 3.28Å; V150-L152 PolarHBondContact O-N 3.22Å; V150-L153 PolarHBondContact O-N 3.41Å; V150-V154 HydrophobicContact CG1-CG2 4.3Å; V150-V154 WeakPolarHBondContact O-CG2 3.48Å; V150-V154 PolarHBondContact O-N 2.96Å
151	P	82.4	Confident	76.4	Confident	65 Å²	65	87.8 Å²	87.8	42%	0.422	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-37.3	175.2	-23.8	35.2	0	0	0	112.7	V147 V154 I155	V147-P151 VanDerWaalsContact O-CD 3.23Å; V147-P151 WeakPolarHBondContact O-CD 3.16Å; V147-P151 VanDerWaalsContact O-CG 3.27Å; V147-P151 WeakPolarHBondContact O-CG 3.19Å; P151-V154 PolarHBondContact O-N 3.26Å; P151-I155 WeakPolarHBondContact O-CB 3.36Å; P151-I155 WeakPolarHBondContact O-CD1 3.23Å; P151-I155 WeakPolarHBondContact O-CG1 3.26Å; P151-I155 PolarHBondContact O-N 3.1Å
152	L	85.6	Confident	78	Confident	111 Å²	111	87.7 Å²	87.7	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-67.7	-39.6	178.1	-65.9	174.9	0	0	0	112	S148 L149 V150 I155 A156	S148-L152 WeakPolarHBondContact O-CD1 3.31Å; L149-L152 PolarHBondContact O-N 3.37Å; V150-L152 VanDerWaalsContact C-N 3.28Å; V150-L152 PolarHBondContact O-N 3.22Å; L152-I155 PolarHBondContact O-N 3.06Å; L152-A156 WeakPolarHBondContact O-CB 3.27Å; L152-A156 PolarHBondContact O-N 3Å
153	L	86.7	Confident	79.5	Confident	106 Å²	106	91 Å²	91	56%	0.555	51%	0.514	S	S	*	.	H	α-helix	trans	-65.5	-42.3	174	-91.1	162	0	0	0	112.2	L149 V150 A156 I157	L149-L153 PolarHBondContact O-N 3.46Å; V150-L153 PolarHBondContact O-N 3.41Å; L153-A156 PolarHBondContact O-N 3.29Å; L153-I157 VanDerWaalsContact O-CG1 3.27Å; L153-I157 WeakPolarHBondContact O-CG1 3.48Å; L153-I157 PolarHBondContact O-N 3.15Å
154	V	89.7	Confident	80.8	Confident	86 Å²	86	94.4 Å²	94.4	52%	0.521	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-42.5	177	173.2	0	0	0	0	110.9	V150 P151 I157 F158	V150-V154 HydrophobicContact CG1-CG2 4.3Å; V150-V154 WeakPolarHBondContact O-CG2 3.48Å; V150-V154 PolarHBondContact O-N 2.96Å; P151-V154 PolarHBondContact O-N 3.26Å; V154-I157 PolarHBondContact O-N 2.85Å; V154-F158 WeakPolarHBondContact O-CB 3.2Å; V154-F158 PolarHBondContact O-N 3.01Å
155	I	90.1	Very high	81.8	Confident	104 Å²	104	94 Å²	94	53%	0.533	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-43.8	175.3	-68	164.7	0	0	0	110.8	P151 L152 I157 F158 V159	P151-I155 WeakPolarHBondContact O-CB 3.36Å; P151-I155 WeakPolarHBondContact O-CD1 3.23Å; P151-I155 WeakPolarHBondContact O-CG1 3.26Å; P151-I155 PolarHBondContact O-N 3.1Å; L152-I155 PolarHBondContact O-N 3.06Å; I155-I157 PolarHBondContact O-N 2.91Å; I155-F158 PolarHBondContact O-N 3.19Å; I155-V159 HydrophobicContact CG2-CG2 4.37Å; I155-V159 VanDerWaalsContact O-CG2 3.29Å; I155-V159 WeakPolarHBondContact O-CG2 3.49Å; I155-V159 PolarHBondContact O-N 3.23Å
156	A	90.8	Very high	82.7	Confident	44 Å²	44	97 Å²	97	36%	0.364	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-44.8	178	0	0	0	0	0	111.8	L152 L153 F158 V159 I160	L152-A156 WeakPolarHBondContact O-CB 3.27Å; L152-A156 PolarHBondContact O-N 3Å; L153-A156 PolarHBondContact O-N 3.29Å; A156-F158 VanDerWaalsContact C-N 3.33Å; A156-F158 PolarHBondContact O-N 3.16Å; A156-V159 PolarHBondContact O-N 3.27Å; A156-I160 WeakPolarHBondContact O-CB 3.23Å; A156-I160 WeakPolarHBondContact O-CD1 3.43Å; A156-I160 WeakPolarHBondContact O-CG1 3.27Å; A156-I160 PolarHBondContact O-N 2.97Å
157	I	91.8	Very high	83.3	Confident	99 Å²	99	100.2 Å²	100.2	51%	0.508	53%	0.526	S	S	.	.	H	α-helix	trans	-60.5	-45.4	175	-68.7	166.8	0	0	0	110	L153 V154 I155 V159 I160 T161	L153-I157 VanDerWaalsContact O-CG1 3.27Å; L153-I157 WeakPolarHBondContact O-CG1 3.48Å; L153-I157 PolarHBondContact O-N 3.15Å; V154-I157 PolarHBondContact O-N 2.85Å; I155-I157 PolarHBondContact O-N 2.91Å; I157-V159 VanDerWaalsContact C-N 3.34Å; I157-V159 PolarHBondContact O-N 3.21Å; I157-I160 PolarHBondContact O-N 3Å; I157-T161 HydrophobicContact CG2-CG2 4.31Å; I157-T161 WeakPolarHBondContact O-CG2 3.49Å; I157-T161 PolarHBondContact O-N 2.89Å; I157-T161 PolarHBondContact O-OG1 3.48Å
158	F	91.7	Very high	83.5	Confident	151 Å²	151	99.1 Å²	99.1	66%	0.662	52%	0.519	S	S	*	.	H	α-helix	trans	-62.5	-40.3	-179.5	-152.3	-89.3	0	0	0	112.4	V154 I155 A156 T161 S162	V154-F158 WeakPolarHBondContact O-CB 3.2Å; V154-F158 PolarHBondContact O-N 3.01Å; I155-F158 PolarHBondContact O-N 3.19Å; A156-F158 VanDerWaalsContact C-N 3.33Å; A156-F158 PolarHBondContact O-N 3.16Å; F158-T161 VanDerWaalsContact CA-OG1 3.31Å; F158-T161 WeakPolarHBondContact CA-OG1 3.36Å; F158-T161 PolarHBondContact O-OG1 3.35Å; F158-S162 WeakPolarHBondContact O-CB 3.18Å; F158-S162 PolarHBondContact O-N 3.36Å
159	V	91.6	Very high	83.1	Confident	92 Å²	92	101.2 Å²	101.2	56%	0.558	53%	0.533	S	S	*	.	H	α-helix	trans	-67	-43	175.7	172.5	0	0	0	0	111	I155 A156 I157 S162 F163	I155-V159 HydrophobicContact CG2-CG2 4.37Å; I155-V159 VanDerWaalsContact O-CG2 3.29Å; I155-V159 WeakPolarHBondContact O-CG2 3.49Å; I155-V159 PolarHBondContact O-N 3.23Å; A156-V159 PolarHBondContact O-N 3.27Å; I157-V159 VanDerWaalsContact C-N 3.34Å; I157-V159 PolarHBondContact O-N 3.21Å; V159-S162 PolarHBondContact O-N 2.85Å; V159-F163 VanDerWaalsContact O-CB 3.25Å; V159-F163 WeakPolarHBondContact O-CB 3.19Å; V159-F163 PolarHBondContact O-N 2.9Å
160	I	90.4	Very high	82.1	Confident	116 Å²	116	102.6 Å²	102.6	60%	0.595	54%	0.54	S	S	*	.	H	α-helix	trans	-64.2	-45.6	177	-67.9	164.6	0	0	0	110.4	A156 I157 F163 Y164	A156-I160 WeakPolarHBondContact O-CB 3.23Å; A156-I160 WeakPolarHBondContact O-CD1 3.43Å; A156-I160 WeakPolarHBondContact O-CG1 3.27Å; A156-I160 PolarHBondContact O-N 2.97Å; I157-I160 PolarHBondContact O-N 3Å; I160-F163 PolarHBondContact O-N 2.87Å; I160-Y164 VanDerWaalsContact O-CB 3.24Å; I160-Y164 WeakPolarHBondContact O-CB 3.4Å; I160-Y164 PolarHBondContact O-N 2.91Å
161	T	86.6	Confident	80.8	Confident	66 Å²	66	106.6 Å²	106.6	41%	0.405	55%	0.554	S	S	.	*	H	α-helix	trans	-65.7	-39.9	177	48.8	0	0	0	0	111.6	I157 F158 Y164 C165	I157-T161 HydrophobicContact CG2-CG2 4.31Å; I157-T161 WeakPolarHBondContact O-CG2 3.49Å; I157-T161 PolarHBondContact O-N 2.89Å; I157-T161 PolarHBondContact O-OG1 3.48Å; F158-T161 VanDerWaalsContact CA-OG1 3.31Å; F158-T161 WeakPolarHBondContact CA-OG1 3.36Å; F158-T161 PolarHBondContact O-OG1 3.35Å; T161-Y164 PolarHBondContact O-N 3.35Å; T161-C165 VanDerWaalsContact O-CB 3.28Å; T161-C165 WeakPolarHBondContact O-CB 3.4Å; T161-C165 PolarHBondContact O-N 3.41Å; T161-C165 PolarHBondContact O-SG 3.35Å
162	S	82.1	Confident	78.9	Confident	72 Å²	72	112.4 Å²	112.4	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-67	-37.8	176.4	-171.1	0	0	0	0	111.6	F158 V159 Y166	F158-S162 WeakPolarHBondContact O-CB 3.18Å; F158-S162 PolarHBondContact O-N 3.36Å; V159-S162 PolarHBondContact O-N 2.85Å; S162-Y166 WeakPolarHBondContact O-CB 3.39Å; S162-Y166 PolarHBondContact O-N 3.2Å
163	F	85.1	Confident	77.2	Confident	116 Å²	116	112.8 Å²	112.8	51%	0.509	59%	0.585	S	S	.	*	H	α-helix	trans	-69	-39.3	174.9	-177.7	-97.9	0	0	0	111.8	V159 I160 Y166 R167	V159-F163 VanDerWaalsContact O-CB 3.25Å; V159-F163 WeakPolarHBondContact O-CB 3.19Å; V159-F163 PolarHBondContact O-N 2.9Å; I160-F163 PolarHBondContact O-N 2.87Å; F163-Y166 PolarHBondContact O-N 2.6Å; F163-R167 HydrophobicContact CE1-CG 4.16Å; F163-R167 HydrophobicContact CZ-CG 4.25Å; F163-R167 WeakPolarHBondContact O-CB 3.4Å; F163-R167 PolarHBondContact O-N 2.98Å
164	Y	81.9	Confident	74.7	Confident	160 Å²	160	115.6 Å²	115.6	63%	0.627	60%	0.601	S	S	*	*	H	α-helix	trans	-66.3	-49.2	175.9	-168.7	-94.6	0	0	0	111.1	I160 T161 Y166 R167 V168	I160-Y164 VanDerWaalsContact O-CB 3.24Å; I160-Y164 WeakPolarHBondContact O-CB 3.4Å; I160-Y164 PolarHBondContact O-N 2.91Å; T161-Y164 PolarHBondContact O-N 3.35Å; Y164-Y166 VanDerWaalsContact C-N 3.32Å; Y164-Y166 PolarHBondContact O-N 2.92Å; Y164-R167 PolarHBondContact O-N 3.08Å; Y164-V168 HydrophobicContact CD1-CG2 4.02Å; Y164-V168 HydrophobicContact CE1-CG2 3.77Å; Y164-V168 WeakPolarHBondContact O-CB 3.39Å; Y164-V168 VanDerWaalsContact O-CG2 3.27Å; Y164-V168 WeakPolarHBondContact O-CG2 3.42Å; Y164-V168 PolarHBondContact O-N 2.96Å
165	C	77.4	Confident	72.7	Confident	74 Å²	74	116.1 Å²	116.1	50%	0.5	61%	0.606	S	S	.	*	H	α-helix	trans	-60.9	-40.1	173.8	-70.9	0	0	0	0	111.7	T161 V168 C169	T161-C165 VanDerWaalsContact O-CB 3.28Å; T161-C165 WeakPolarHBondContact O-CB 3.4Å; T161-C165 PolarHBondContact O-N 3.41Å; T161-C165 PolarHBondContact O-SG 3.35Å; C165-V168 PolarHBondContact O-N 3.38Å; C165-C169 VanDerWaalsContact O-CB 3.25Å; C165-C169 WeakPolarHBondContact O-CB 3.4Å; C165-C169 PolarHBondContact O-N 3.45Å; C165-C169 PolarHBondContact O-SG 3.34Å
166	Y	77.1	Confident	70	Confident	152 Å²	152	122.3 Å²	122.3	60%	0.596	62%	0.622	S	S	*	*	H	α-helix	trans	-62.4	-44.1	174.3	-178.2	-100	0	0	0	111.8	S162 F163 Y164 N170	S162-Y166 WeakPolarHBondContact O-CB 3.39Å; S162-Y166 PolarHBondContact O-N 3.2Å; F163-Y166 PolarHBondContact O-N 2.6Å; Y164-Y166 VanDerWaalsContact C-N 3.32Å; Y164-Y166 PolarHBondContact O-N 2.92Å; Y166-N170 WeakPolarHBondContact O-CB 3.22Å; Y166-N170 PolarHBondContact O-N 3.12Å
167	R	76.8	Confident	67.3	Low	156 Å²	156	129.5 Å²	129.5	59%	0.589	65%	0.645	S	S	*	*	H	α-helix	trans	-67.4	-36.9	176.5	-84.4	-152.1	167.4	-174.5	-1.2	113.5	F163 Y164	F163-R167 HydrophobicContact CE1-CG 4.16Å; F163-R167 HydrophobicContact CZ-CG 4.25Å; F163-R167 WeakPolarHBondContact O-CB 3.4Å; F163-R167 PolarHBondContact O-N 2.98Å; Y164-R167 PolarHBondContact O-N 3.08Å
168	V	71.5	Confident	65.3	Low	83 Å²	83	129.9 Å²	129.9	50%	0.503	66%	0.655	S	S	.	*	H	α-helix	trans	-73.5	-38.8	178.6	171.6	0	0	0	0	111.1	Y164 C165 N170 Q171	Y164-V168 HydrophobicContact CD1-CG2 4.02Å; Y164-V168 HydrophobicContact CE1-CG2 3.77Å; Y164-V168 WeakPolarHBondContact O-CB 3.39Å; Y164-V168 VanDerWaalsContact O-CG2 3.27Å; Y164-V168 WeakPolarHBondContact O-CG2 3.42Å; Y164-V168 PolarHBondContact O-N 2.96Å; C165-V168 PolarHBondContact O-N 3.38Å; V168-N170 VanDerWaalsContact C-N 3.33Å; V168-N170 PolarHBondContact O-N 2.86Å; V168-Q171 PolarHBondContact O-N 3.36Å
169	C	62.3	Low	62.5	Low	109 Å²	109	130 Å²	130	74%	0.736	66%	0.661	S	S	*	*	H	α-helix	trans	-71.7	-24.8	175.4	-72.3	0	0	0	0	113.4	C165 Q171	C165-C169 VanDerWaalsContact O-CB 3.25Å; C165-C169 WeakPolarHBondContact O-CB 3.4Å; C165-C169 PolarHBondContact O-N 3.45Å; C165-C169 PolarHBondContact O-SG 3.34Å; C169-Q171 VanDerWaalsContact C-N 3.32Å
170	N	53.2	Low	59.5	Low	119 Å²	119	131.5 Å²	131.5	64%	0.636	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	3.5	177.3	-121	11.4	0	0	0	114.3	Y166 V168	Y166-N170 WeakPolarHBondContact O-CB 3.22Å; Y166-N170 PolarHBondContact O-N 3.12Å; V168-N170 VanDerWaalsContact C-N 3.33Å; V168-N170 PolarHBondContact O-N 2.86Å
171	Q	51.7	Low	56.6	Low	158 Å²	158	132.1 Å²	132.1	74%	0.738	67%	0.671	S	S	*	*			trans	-108.1	84.4	171.9	-70.1	-172.7	4.4	0	0	109.7	V168 C169	V168-Q171 PolarHBondContact O-N 3.36Å; C169-Q171 VanDerWaalsContact C-N 3.32Å
172	Q	43.7	Very low	54	Low	186 Å²	186	134.4 Å²	134.4	87%	0.869	69%	0.685	S	S	*	*			trans	-72	143.6	157.7	-99.6	-175.7	-15.8	0	0	110.1
173	P	49.7	Very low	51.7	Low	120 Å²	120	137.4 Å²	137.4	78%	0.779	70%	0.695	S	S	*	*			trans	-85.6	143.9	-169.1	33.6	-32.8	0	0	0	111.8
174	N	32.9	Very low	49.2	Very low	165 Å²	165	141.4 Å²	141.4	88%	0.882	71%	0.712	S	S	*	*			trans	-110.1	138.7	163.4	-122.5	-12.4	0	0	0	109.7
175	P	48	Very low	46.7	Very low	97 Å²	97	142.6 Å²	142.6	63%	0.63	72%	0.723	S	S	*	*			trans	-97.1	162.4	-167	36.9	-33.4	0	0	0	114.3
176	R	34	Very low	45	Very low	233 Å²	233	144 Å²	144	88%	0.879	73%	0.731	S	S	*	*			trans	95.2	143.8	165.5	-55.7	169.5	179.2	175.7	1	114.8
177	K	33.3	Very low	42.9	Very low	195 Å²	195	143.2 Å²	143.2	85%	0.848	74%	0.736	S	S	*	*			cis	-168.2	177.8	-4	-115.3	-165.8	-179.7	-176.4	0	107.2
178	P	50.5	Low	40.8	Very low	108 Å²	108	143.1 Å²	143.1	70%	0.701	75%	0.746	S	S	*	*			trans	-100.5	163.8	-152.2	40.3	-35.7	0	0	0	115.6
179	L	32.2	Very low	39.3	Very low	154 Å²	154	146.3 Å²	146.3	81%	0.806	76%	0.76	S	S	*	*			trans	-176	136	136.9	-137.8	70.1	0	0	0	114.9
180	D	29.9	Very low	38.5	Very low	122 Å²	122	146.9 Å²	146.9	65%	0.652	76%	0.762	S	S	*	*			trans	62.7	121.1	134.5	-91.6	8.6	0	0	0	126.9
181	N	28.8	Very low	37.8	Very low	129 Å²	129	150.2 Å²	150.2	69%	0.69	77%	0.774	S	S	*	*				74.5	135.8	116.7	-75.9	-23.8	0	0	0	123.7
182	T	31.8	Very low	36.8	Very low	115 Å²	115	146.6 Å²	146.6	71%	0.706	78%	0.779	S	S	*	*			trans	111	106.2	133	-11.3	0	0	0	0	118.6
183	D	34.8	Very low	36.4	Very low	134 Å²	134	143 Å²	143	72%	0.717	77%	0.774	S	S	*	*			trans	49.5	128.9	132.7	-51.9	-19.9	0	0	0	122.2
184	K	30.9	Very low	35.5	Very low	201 Å²	201	145.5 Å²	145.5	87%	0.874	78%	0.781	S	S	*	*				170.4	123.8	93.5	-85.1	-179.5	-172.8	175.2	0	111.6
185	H	30.2	Very low	35.4	Very low	184 Å²	184	143.3 Å²	143.3	85%	0.852	78%	0.779	S	S	*	*			trans	-74.3	-172.8	156.5	-82.7	-65.5	0	0	0	110.5
186	P	41.4	Very low	34.6	Very low	103 Å²	103	144.8 Å²	144.8	67%	0.669	79%	0.791	S	S	*	*			cis	-141.4	178.4	8.1	26	4.1	0	0	0	112.9
187	I	32.9	Very low	34.6	Very low	137 Å²	137	138.3 Å²	138.3	70%	0.703	78%	0.782	S	S	*	*				155.7	129.3	84.9	-87.4	-163.5	0	0	0	110.8
188	I	33.7	Very low	34.7	Very low	154 Å²	154	136.1 Å²	136.1	79%	0.79	79%	0.785	S	S	*	*			trans	84.1	111.7	139.4	-64.8	174.3	0	0	0	123.8
189	D	38.3	Very low	33.9	Very low	150 Å²	150	140 Å²	140	80%	0.802	79%	0.793	S	S	*	*			trans	-69.2	168.7	147.6	-77.1	-36.2	0	0	0	112
190	P	46.8	Very low	33.9	Very low	121 Å²	121	137.4 Å²	137.4	79%	0.786	79%	0.794	S	S	*	*			cis	-159.3	-178.5	47.5	40.3	-14.6	0	0	0	119.5
191	E	38.8	Very low	34.2	Very low	189 Å²	189	139 Å²	139	88%	0.883	80%	0.803	S	S	*	*			trans	-48.9	153.6	172.7	-58.5	177.5	141.8	0	0	116.6
192	G	30.8	Very low	34.7	Very low	81 Å²	81	140.1 Å²	140.1	84%	0.835	81%	0.808	S	S	*	*			trans	-135.1	117.6	167.6	0	0	0	0	0	110.9
193	S	34.8	Very low	35.1	Very low	110 Å²	110	141.9 Å²	141.9	77%	0.769	81%	0.813	S	S	*	*			trans	-93.8	145.6	167.2	-55.7	0	0	0	0	108.8
194	D	29.6	Very low	35.2	Very low	174 Å²	174	142.8 Å²	142.8	93%	0.93	82%	0.817	S	S	*	*			trans	-134.2	125	160.8	-91.3	-31.5	0	0	0	110.8
195	S	31.1	Very low	35.6	Very low	119 Å²	119	141.6 Å²	141.6	83%	0.832	82%	0.815	S	S	*	*			trans	-108.9	135.5	166.5	-63.1	0	0	0	0	107.7
196	S	31.6	Very low	36.3	Very low	127 Å²	127	138.4 Å²	138.4	89%	0.888	80%	0.804	S	S	*	*			trans	-154.6	141.7	150.3	-165.7	0	0	0	0	112.1
197	S	35.4	Very low	37.1	Very low	98 Å²	98	140.5 Å²	140.5	69%	0.685	82%	0.815	S	S	*	*			trans	-105.1	154.7	-162.6	51.6	0	0	0	0	112.9
198	T	33.6	Very low	39.1	Very low	149 Å²	149	141.3 Å²	141.3	91%	0.914	82%	0.816	S	S	*	*			trans	-150.1	141	139.7	30.9	0	0	0	0	112.4
199	H	34.3	Very low	41.7	Very low	190 Å²	190	138.1 Å²	138.1	88%	0.88	80%	0.8	S	S	*	*			trans	-61.9	139.1	-171.7	-95	14.8	0	0	0	116.6
200	A	31.5	Very low	44.2	Very low	98 Å²	98	133.8 Å²	133.8	81%	0.81	78%	0.776	S	S	*	*			trans	-138.4	146.6	146.3	0	0	0	0	0	109.2
201	N	37.9	Very low	46.4	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	76%	0.761	S	S	*	*			trans	-61.2	141.1	-165.5	-77.3	-41.2	0	0	0	115.2	L203	N201-L203 PolarHBondContact O-N 3.44Å
202	N	38.9	Very low	49.1	Very low	152 Å²	152	123.5 Å²	123.5	81%	0.813	72%	0.724	S	S	*	*			trans	-54.9	111.8	179.4	-70.6	-77.2	0	0	0	114.8
203	L	40.1	Very low	52.1	Low	152 Å²	152	124.1 Å²	124.1	80%	0.796	71%	0.706	S	S	*	*	S	Bend		-111.8	139	124.6	-85.1	118.7	0	0	0	106.4	N201 H205	N201-L203 PolarHBondContact O-N 3.44Å; L203-H205 PolarHBondContact O-N 2.87Å
204	N	36.3	Very low	55.1	Low	152 Å²	152	122.1 Å²	122.1	81%	0.813	69%	0.686	S	S	*	*			trans	-46.3	100.7	-178.4	-68.4	-28.9	0	0	0	111.7	N206	N204-N206 VanDerWaalsContact C-N 3.26Å; N204-N206 PolarHBondContact O-N 3.36Å
205	H	40	Very low	58.2	Low	177 Å²	177	117.4 Å²	117.4	82%	0.819	66%	0.661	S	S	*	*			trans	-75.5	88.6	165.9	-77.1	-60.7	0	0	0	107.6	L203 T207	L203-H205 PolarHBondContact O-N 2.87Å; H205-T207 PolarHBondContact O-N 3.41Å
206	N	45.4	Very low	61.3	Low	117 Å²	117	115.4 Å²	115.4	63%	0.626	64%	0.643	S	S	*	*			trans	-56.8	116.6	143.7	-70.7	-8.8	0	0	0	105.2	N204 E208	N204-N206 VanDerWaalsContact C-N 3.26Å; N204-N206 PolarHBondContact O-N 3.36Å; N206-E208 HydrophobicContact CB-CB 4.22Å; N206-E208 HydrophobicContact CB-CG 4.47Å; N206-E208 PolarHBondContact O-N 3.43Å
207	T	56.4	Low	64.5	Low	147 Å²	147	113.2 Å²	113.2	90%	0.902	62%	0.621	S	S	*	*			trans	-64.2	10.9	167.1	17.7	0	0	0	0	112.5	H205	H205-T207 PolarHBondContact O-N 3.41Å
208	E	76.6	Confident	67.2	Low	153 Å²	153	111.4 Å²	111.4	72%	0.715	61%	0.606	S	S	*	*	S	Bend	trans	-87.1	126.1	178.3	-63	-174.9	160.5	0	0	109	N206	N206-E208 HydrophobicContact CB-CB 4.22Å; N206-E208 HydrophobicContact CB-CG 4.47Å; N206-E208 PolarHBondContact O-N 3.43Å
209	L	88.2	Confident	69.9	Low	87 Å²	87	105.6 Å²	105.6	46%	0.455	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-59.1	146.5	172.4	-60.6	171.5	0	0	0	109.8	E283 R285	L209-E283 HydrophobicContact CD2-CB 4.1Å; L209-E283 HydrophobicContact CD2-CG 4.22Å; L209-R285 HydrophobicContact CD1-CG 4.09Å; L209-R285 HydrophobicContact CD2-CG 4.31Å
210	L	90.7	Very high	72.6	Confident	60 Å²	60	104.2 Å²	104.2	31%	0.314	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-59.7	140.4	176.2	-69	177.5	0	0	0	110.5	I212 L231 T281 E283 R285	L210-I212 HydrophobicContact CB-CD1 3.8Å; L210-I212 HydrophobicContact CB-CG1 3.82Å; L210-I212 HydrophobicContact CD1-CD1 4.29Å; L210-I212 PolarHBondContact O-N 2.96Å; L210-L231 HydrophobicContact CB-CD1 3.76Å; L210-L231 HydrophobicContact CD1-CD1 4.15Å; L210-L231 HydrophobicContact CD2-CD1 4.28Å; L210-L231 HydrophobicContact CG-CD1 4.29Å; L210-T281 HydrophobicContact CD1-CG2 3.61Å; L210-E283 WeakPolarHBondContact CB-OE1 3.48Å; L210-E283 VanDerWaalsContact CG-OE1 3.28Å; L210-E283 WeakPolarHBondContact CG-OE1 3.25Å; L210-E283 PolarHBondContact N-OE1 3.47Å; L210-R285 PolarHBondContact O-NH2 3.12Å
211	P	92.6	Very high	74.9	Confident	72 Å²	72	101.5 Å²	101.5	47%	0.468	55%	0.549	S	S	.	.			trans	-75.9	72.3	-179.4	33.5	-37.4	0	0	0	110.5	K232	P211-K232 HydrophobicContact CB-CB 4.16Å; P211-K232 HydrophobicContact CG-CB 3.98Å; P211-K232 WeakPolarHBondContact CG-O 3.38Å; P211-K232 PolarHBondContact O-N 3.46Å; P211-K232 VanDerWaalsContact O-N 3.1Å
212	I	94.8	Very high	77	Confident	21 Å²	21	103.2 Å²	103.2	11%	0.108	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129.8	-176.2	-63.6	172.1	0	0	0	110.2	L210 L214 A229 K230 L231 V248 W292 I294	L210-I212 HydrophobicContact CB-CD1 3.8Å; L210-I212 HydrophobicContact CB-CG1 3.82Å; L210-I212 HydrophobicContact CD1-CD1 4.29Å; L210-I212 PolarHBondContact O-N 2.96Å; I212-L214 HydrophobicContact CG2-CD2 4.41Å; I212-A229 HydrophobicContact CG2-CB 3.63Å; I212-K230 WeakPolarHBondContact CA-O 3.16Å; I212-L231 HydrophobicContact CD1-CD1 4.49Å; I212-L231 HydrophobicContact CG1-CD1 3.75Å; I212-V248 HydrophobicContact CG2-CG2 3.89Å; I212-W292 HydrophobicContact CB-CZ3 4.13Å; I212-W292 HydrophobicContact CD1-CZ3 4.45Å; I212-W292 HydrophobicContact CG2-CZ3 3.9Å; I212-I294 HydrophobicContact CD1-CD1 4.39Å; I212-I294 HydrophobicContact CD1-CG1 3.75Å; I212-I294 HydrophobicContact CD1-CG2 4.23Å
213	E	95.1	Very high	79.2	Confident	95 Å²	95	97.4 Å²	97.4	44%	0.444	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	112.8	173.7	-169.9	175.8	145.6	0	0	108.9	A229 K230 K232	E213-A229 CarbonylContact O-C 3.31Å; E213-A229 VanDerWaalsContact O-CA 3.29Å; E213-A229 WeakPolarHBondContact O-CA 3.39Å; E213-A229 WeakPolarHBondContact O-CB 3.46Å; E213-K230 HydrophobicContact CB-CB 4.49Å; E213-K230 PolarHBondContact N-O 2.95Å; E213-K230 PolarHBondContact O-N 2.9Å; E213-K232 VanDerWaalsContact OE2-CE 3.26Å; E213-K232 WeakPolarHBondContact OE2-CE 3.23Å; E213-K232 IonicContact OE2-NZ 2.83Å; E213-K232 PolarHBondContact OE2-NZ 3.04Å
214	L	96.4	Very high	81.7	Confident	68 Å²	68	90.4 Å²	90.4	36%	0.356	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	137.2	176.9	-58.6	179.5	0	0	0	109.7	I212 Y227 A229 V248 I250 W292	I212-L214 HydrophobicContact CG2-CD2 4.41Å; L214-Y227 HydrophobicContact CB-CD1 4.45Å; L214-Y227 HydrophobicContact CD2-CG 4.34Å; L214-A229 HydrophobicContact CD2-CB 4Å; L214-V248 HydrophobicContact CD2-CB 4.02Å; L214-V248 HydrophobicContact CD2-CG1 4.14Å; L214-V248 HydrophobicContact CD2-CG2 4.11Å; L214-I250 HydrophobicContact CD1-CD1 3.72Å; L214-I250 HydrophobicContact CD2-CD1 4.27Å; L214-W292 HydrophobicContact CD1-CH2 3.95Å; L214-W292 HydrophobicContact CD1-CZ2 4.06Å; L214-W292 HydrophobicContact CD2-CH2 3.74Å; L214-W292 HydrophobicContact CD2-CZ2 4.41Å; L214-W292 HydrophobicContact CD2-CZ3 4.06Å; L214-W292 HydrophobicContact CG-CH2 3.88Å; L214-W292 HydrophobicContact CG-CZ2 4.48Å
215	D	95.4	Very high	84.6	Confident	75 Å²	75	85.6 Å²	85.6	40%	0.401	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	-74.8	-176.2	-168.9	16.2	0	0	0	110.4	K228	D215-K228 WeakPolarHBondContact CA-O 3.34Å; D215-K228 VanDerWaalsContact CB-O 3.28Å; D215-K228 WeakPolarHBondContact CB-O 3.36Å; D215-K228 PolarHBondContact N-O 2.84Å
216	V	97	Very high	87.3	Confident	76 Å²	76	79 Å²	79	46%	0.461	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	136.5	-172.5	175.8	0	0	0	0	110.1	V218 Y227 K228	V216-V218 HydrophobicContact CG1-CG1 4.49Å; V216-V218 PolarHBondContact O-N 3.43Å; V216-Y227 CarbonylContact O-C 3.55Å; V216-Y227 VanDerWaalsContact O-CA 3.31Å; V216-Y227 WeakPolarHBondContact O-CA 3.14Å; V216-K228 PolarHBondContact N-O 2.82Å; V216-K228 PolarHBondContact O-N 3.47Å
217	L	96.9	Very high	89.8	Confident	81 Å²	81	75.9 Å²	75.9	42%	0.424	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	116.3	167.4	179.5	71.6	0	0	0	108.7	G219 E225 Y227	L217-G219 WeakPolarHBondContact CD1-O 3.47Å; L217-E225 HydrophobicContact CD1-CB 3.75Å; L217-E225 HydrophobicContact CD1-CG 4.21Å; L217-Y227 HydrophobicContact CB-CD1 4.16Å; L217-Y227 HydrophobicContact CB-CE1 3.84Å; L217-Y227 HydrophobicContact CD1-CD1 4.47Å; L217-Y227 HydrophobicContact CD1-CD2 4.17Å; L217-Y227 HydrophobicContact CD1-CE1 4.08Å; L217-Y227 HydrophobicContact CD1-CE2 3.74Å
218	V	93.9	Very high	91.7	Very high	60 Å²	60	71.9 Å²	71.9	36%	0.364	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-13.2	-177.7	-65.3	0	0	0	0	113.3	V216 V226 K228 Y297	V216-V218 HydrophobicContact CG1-CG1 4.49Å; V216-V218 PolarHBondContact O-N 3.43Å; V218-V226 HydrophobicContact CG2-CB 4.18Å; V218-V226 HydrophobicContact CG2-CG1 3.79Å; V218-V226 VanDerWaalsContact CG2-O 3.26Å; V218-V226 WeakPolarHBondContact CG2-O 3.31Å; V218-V226 PolarHBondContact N-O 2.92Å; V218-K228 HydrophobicContact CG1-CB 3.77Å; V218-Y297 HydrophobicContact CG1-CE2 4.3Å
219	G	90.3	Very high	92.7	Very high	28 Å²	28	64.6 Å²	64.6	29%	0.289	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	152.1	176.7	0	0	0	0	0	112.4	L217 V226	L217-G219 WeakPolarHBondContact CD1-O 3.47Å; G219-V226 PolarHBondContact N-O 3.43Å; G219-V226 PolarHBondContact O-N 3.49Å
220	K	89.6	Confident	93.1	Very high	160 Å²	160	63.4 Å²	63.4	70%	0.696	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	107	172.7	-175.7	170.4	-178.3	170	0	108.5	E225	K220-E225 HydrophobicContact CG-CG 4.22Å; K220-E225 IonicContact NZ-OE1 2.96Å
221	G	81.1	Confident	93.2	Very high	42 Å²	42	61.3 Å²	61.3	43%	0.433	32%	0.317	S	S	.	.			trans	-87.4	-174.7	175.9	0	0	0	0	0	111.8	F223 A224	G221-F223 VanDerWaalsContact C-N 3.31Å; G221-F223 PolarHBondContact O-N 2.75Å; G221-A224 PolarHBondContact N-O 2.98Å
222	R	81.1	Confident	93	Very high	192 Å²	192	62.9 Å²	62.9	73%	0.725	32%	0.316	S	S	*	.	S	Bend	trans	-62	-39	176.2	-179.8	178.1	172.6	-166.6	-0.3	112.7
223	F	84.9	Confident	92.1	Very high	30 Å²	30	66.1 Å²	66.1	13%	0.132	33%	0.331	C	S	.	.	S	Bend	trans	-111.4	-16.7	-169	-49.8	-64.2	0	0	0	113.8	G221 F251 E255 S258 L370	G221-F223 VanDerWaalsContact C-N 3.31Å; G221-F223 PolarHBondContact O-N 2.75Å; F223-F251 HydrophobicContact CB-CD1 4.16Å; F223-F251 HydrophobicContact CB-CE1 4.07Å; F223-E255 HydrophobicContact CB-CG 4.43Å; F223-E255 WeakPolarHBondContact CD1-OE2 3.34Å; F223-E255 WeakPolarHBondContact O-CG 3.31Å; F223-S258 WeakPolarHBondContact CD1-OG 3.47Å; F223-L370 HydrophobicContact CE2-CD2 4.31Å; F223-L370 HydrophobicContact CE2-CG 4.36Å; F223-L370 HydrophobicContact CZ-CD2 4.08Å
224	A	93	Very high	90.5	Very high	6 Å²	6	64.2 Å²	64.2	5%	0.05	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	158.1	-167.8	0	0	0	0	0	112.9	G221 K249 I250 F251	G221-A224 PolarHBondContact N-O 2.98Å; A224-K249 HydrophobicContact CB-CD 4.15Å; A224-K249 HydrophobicContact CB-CG 3.44Å; A224-K249 VanDerWaalsContact CB-CG 3.44Å; A224-I250 VanDerWaalsContact CA-O 3.28Å; A224-I250 WeakPolarHBondContact CA-O 3.15Å; A224-I250 VanDerWaalsContact CB-O 3.28Å; A224-I250 WeakPolarHBondContact CB-O 3.47Å; A224-F251 HydrophobicContact CB-CD1 3.71Å; A224-F251 HydrophobicContact CB-CD2 4.09Å; A224-F251 HydrophobicContact CB-CE1 3.75Å; A224-F251 HydrophobicContact CB-CE2 4.13Å; A224-F251 HydrophobicContact CB-CG 3.89Å; A224-F251 HydrophobicContact CB-CZ 3.98Å
225	E	96.4	Very high	88.3	Confident	51 Å²	51	67.7 Å²	67.7	24%	0.238	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	137.8	169	-68.9	-178.7	173.6	0	0	109.6	L217 K220 Y227 K249 I250	L217-E225 HydrophobicContact CD1-CB 3.75Å; L217-E225 HydrophobicContact CD1-CG 4.21Å; K220-E225 HydrophobicContact CG-CG 4.22Å; K220-E225 IonicContact NZ-OE1 2.96Å; E225-Y227 HydrophobicContact CB-CD2 4.3Å; E225-Y227 HydrophobicContact CB-CE2 3.6Å; E225-Y227 PolarHBondContact OE2-OH 3Å; E225-K249 CarbonylContact O-C 3.53Å; E225-K249 WeakPolarHBondContact O-CA 3.44Å; E225-I250 PolarHBondContact N-O 3.34Å; E225-I250 VanDerWaalsContact N-O 3.09Å; E225-I250 PolarHBondContact O-N 3.23Å
226	V	97.1	Very high	86.2	Confident	39 Å²	39	69.4 Å²	69.4	24%	0.236	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.3	179.9	-173.8	0	0	0	0	108.9	V218 G219 A247 V248 K249	V218-V226 HydrophobicContact CG2-CB 4.18Å; V218-V226 HydrophobicContact CG2-CG1 3.79Å; V218-V226 VanDerWaalsContact CG2-O 3.26Å; V218-V226 WeakPolarHBondContact CG2-O 3.31Å; V218-V226 PolarHBondContact N-O 2.92Å; G219-V226 PolarHBondContact N-O 3.43Å; G219-V226 PolarHBondContact O-N 3.49Å; V226-A247 HydrophobicContact CG1-CB 4.35Å; V226-V248 WeakPolarHBondContact CA-O 3.16Å; V226-K249 HydrophobicContact CG2-CB 4.22Å; V226-K249 HydrophobicContact CG2-CD 4.36Å; V226-K249 HydrophobicContact CG2-CG 3.95Å
227	Y	98.1	Very high	84	Confident	50 Å²	50	70.3 Å²	70.3	20%	0.196	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.9	177.9	-70	-99.7	0	0	0	110.3	L214 V216 L217 E225 A247 V248 I250	L214-Y227 HydrophobicContact CB-CD1 4.45Å; L214-Y227 HydrophobicContact CD2-CG 4.34Å; V216-Y227 CarbonylContact O-C 3.55Å; V216-Y227 VanDerWaalsContact O-CA 3.31Å; V216-Y227 WeakPolarHBondContact O-CA 3.14Å; L217-Y227 HydrophobicContact CB-CD1 4.16Å; L217-Y227 HydrophobicContact CB-CE1 3.84Å; L217-Y227 HydrophobicContact CD1-CD1 4.47Å; L217-Y227 HydrophobicContact CD1-CD2 4.17Å; L217-Y227 HydrophobicContact CD1-CE1 4.08Å; L217-Y227 HydrophobicContact CD1-CE2 3.74Å; E225-Y227 HydrophobicContact CB-CD2 4.3Å; E225-Y227 HydrophobicContact CB-CE2 3.6Å; E225-Y227 PolarHBondContact OE2-OH 3Å; Y227-A247 CarbonylContact O-C 3.54Å; Y227-A247 WeakPolarHBondContact O-CA 3.46Å; Y227-V248 PolarHBondContact N-O 2.99Å; Y227-V248 PolarHBondContact O-N 2.82Å; Y227-I250 HydrophobicContact CD2-CD1 3.72Å; Y227-I250 HydrophobicContact CD2-CG1 4.22Å; Y227-I250 HydrophobicContact CE2-CD1 3.92Å
228	K	97.6	Very high	81.8	Confident	63 Å²	63	78 Å²	78	27%	0.274	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	135.5	155.3	-178.5	-173.1	179	-169.1	0	107.5	D215 V216 V218 T245 Y297	D215-K228 WeakPolarHBondContact CA-O 3.34Å; D215-K228 VanDerWaalsContact CB-O 3.28Å; D215-K228 WeakPolarHBondContact CB-O 3.36Å; D215-K228 PolarHBondContact N-O 2.84Å; V216-K228 PolarHBondContact N-O 2.82Å; V216-K228 PolarHBondContact O-N 3.47Å; V218-K228 HydrophobicContact CG1-CB 3.77Å; K228-T245 HydrophobicContact CD-CG2 4.38Å; K228-T245 HydrophobicContact CG-CG2 3.88Å; K228-Y297 HydrophobicContact CB-CD2 4.32Å; K228-Y297 HydrophobicContact CB-CE2 3.91Å; K228-Y297 HydrophobicContact CD-CE1 4.06Å; K228-Y297 HydrophobicContact CD-CE2 4.31Å; K228-Y297 HydrophobicContact CG-CD2 4.2Å; K228-Y297 HydrophobicContact CG-CE1 4.23Å; K228-Y297 HydrophobicContact CG-CE2 3.94Å; K228-Y297 HydrophobicContact CG-CG 4.48Å
229	A	97	Very high	79.6	Confident	0 Å²	0	83.5 Å²	83.5	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	164.6	-178.3	0	0	0	0	0	111.9	I212 E213 L214 T245 V246 V248	I212-A229 HydrophobicContact CG2-CB 3.63Å; E213-A229 CarbonylContact O-C 3.31Å; E213-A229 VanDerWaalsContact O-CA 3.29Å; E213-A229 WeakPolarHBondContact O-CA 3.39Å; E213-A229 WeakPolarHBondContact O-CB 3.46Å; L214-A229 HydrophobicContact CD2-CB 4Å; A229-T245 WeakPolarHBondContact O-CA 3.37Å; A229-V246 HydrophobicContact CB-CG2 4.06Å; A229-V246 PolarHBondContact N-O 3.39Å; A229-V246 PolarHBondContact O-N 2.8Å; A229-V248 HydrophobicContact CB-CG2 3.57Å
230	K	95.7	Very high	77.8	Confident	62 Å²	62	91.2 Å²	91.2	27%	0.27	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	119	177.6	-58.9	178.5	-175.1	159.7	0	109.1	I212 E213 F243	I212-K230 WeakPolarHBondContact CA-O 3.16Å; E213-K230 HydrophobicContact CB-CB 4.49Å; E213-K230 PolarHBondContact N-O 2.95Å; E213-K230 PolarHBondContact O-N 2.9Å; K230-F243 HydrophobicContact CB-CB 4.15Å; K230-F243 HydrophobicContact CB-CD2 3.65Å; K230-F243 HydrophobicContact CB-CE2 4.29Å; K230-F243 HydrophobicContact CB-CG 3.99Å; K230-F243 HydrophobicContact CD-CD1 4.34Å; K230-F243 HydrophobicContact CD-CD2 3.88Å; K230-F243 HydrophobicContact CD-CE1 4.25Å; K230-F243 HydrophobicContact CD-CE2 3.78Å; K230-F243 HydrophobicContact CD-CG 4.17Å; K230-F243 HydrophobicContact CD-CZ 3.97Å; K230-F243 HydrophobicContact CG-CD2 3.52Å; K230-F243 HydrophobicContact CG-CE2 3.63Å; K230-F243 HydrophobicContact CG-CG 4.16Å; K230-F243 HydrophobicContact CG-CZ 4.34Å
231	L	93.8	Very high	76.2	Confident	17 Å²	17	90.1 Å²	90.1	9%	0.089	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	112.8	172.1	174.8	61	0	0	0	109	L210 I212 Q233 F243 E244 V246 L280	L210-L231 HydrophobicContact CB-CD1 3.76Å; L210-L231 HydrophobicContact CD1-CD1 4.15Å; L210-L231 HydrophobicContact CD2-CD1 4.28Å; L210-L231 HydrophobicContact CG-CD1 4.29Å; I212-L231 HydrophobicContact CD1-CD1 4.49Å; I212-L231 HydrophobicContact CG1-CD1 3.75Å; L231-Q233 PolarHBondContact O-N 3.26Å; L231-F243 CarbonylContact O-C 3.45Å; L231-F243 VanDerWaalsContact O-CA 3.3Å; L231-F243 WeakPolarHBondContact O-CA 3.38Å; L231-E244 HydrophobicContact CB-CB 4.39Å; L231-E244 PolarHBondContact N-O 3.15Å; L231-E244 PolarHBondContact O-N 2.96Å; L231-V246 HydrophobicContact CB-CG1 3.98Å; L231-V246 HydrophobicContact CB-CG2 4.14Å; L231-V246 HydrophobicContact CD2-CG1 4.2Å; L231-L280 HydrophobicContact CD2-CD2 4.27Å
232	K	88.3	Confident	75.6	Confident	105 Å²	105	91.3 Å²	91.3	46%	0.457	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	119.7	179.1	-65.1	175.9	-177.8	168.7	0	109.5	P211 E213	P211-K232 HydrophobicContact CB-CB 4.16Å; P211-K232 HydrophobicContact CG-CB 3.98Å; P211-K232 WeakPolarHBondContact CG-O 3.38Å; P211-K232 PolarHBondContact O-N 3.46Å; P211-K232 VanDerWaalsContact O-N 3.1Å; E213-K232 VanDerWaalsContact OE2-CE 3.26Å; E213-K232 WeakPolarHBondContact OE2-CE 3.23Å; E213-K232 IonicContact OE2-NZ 2.83Å; E213-K232 PolarHBondContact OE2-NZ 3.04Å
233	Q	76	Confident	75.5	Confident	89 Å²	89	85.7 Å²	85.7	42%	0.416	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-80.1	139	176.2	-69.6	-168.3	-4.7	0	0	110.3	L231 E244	L231-Q233 PolarHBondContact O-N 3.26Å; Q233-E244 PolarHBondContact NE2-OE2 2.99Å; Q233-E244 VanDerWaalsContact NE2-OE2 3.17Å
234	G	60.3	Low	75.7	Confident	55 Å²	55	87.9 Å²	87.9	57%	0.567	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-63.2	153.9	170.6	0	0	0	0	0	111.2	S236	G234-S236 PolarHBondContact O-N 3.35Å
235	S	50.9	Low	75.8	Confident	141 Å²	141	90 Å²	90	99%	0.986	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	21.1	-164.1	-33.7	0	0	0	0	119.4
236	S	52.1	Low	75.9	Confident	111 Å²	111	87.6 Å²	87.6	78%	0.776	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	5.3	-169.3	56.1	0	0	0	0	116.7	G234	G234-S236 PolarHBondContact O-N 3.35Å
237	V	49.3	Very low	75.9	Confident	95 Å²	95	86.2 Å²	86.2	58%	0.576	46%	0.459	S	S	*	.			trans	-116.6	118.4	174	-172	0	0	0	0	110.1	E239	V237-E239 PolarHBondContact O-N 3.27Å
238	R	52	Low	75.9	Confident	243 Å²	243	83.9 Å²	83.9	92%	0.917	45%	0.449	S	S	*	.			trans	-72.7	103.8	171.6	-67.5	176.3	173.4	-158.6	-2.4	107.5
239	E	46.7	Very low	75.9	Confident	175 Å²	175	82.1 Å²	82.1	82%	0.818	44%	0.442	S	S	*	.	S	Bend	trans	-171.3	154.7	155.1	-105.7	160.7	-139.3	0	0	110.7	V237 H241	V237-E239 PolarHBondContact O-N 3.27Å; E239-H241 PolarHBondContact O-N 3.2Å
240	E	53.8	Low	75.9	Confident	190 Å²	190	82.4 Å²	82.4	89%	0.888	44%	0.443	S	S	*	.	S	Bend	trans	-64.4	6	-160.8	-64.9	-179.7	144.4	0	0	117
241	H	54.5	Low	75.9	Confident	136 Å²	136	79.5 Å²	79.5	63%	0.63	43%	0.43	S	S	*	.			trans	-128	104.6	-177.6	-61.4	77.9	0	0	0	109.3	E239 F243	E239-H241 PolarHBondContact O-N 3.2Å; H241-F243 PolarHBondContact O-N 2.85Å
242	G	68.7	Low	76	Confident	67 Å²	67	82.7 Å²	82.7	69%	0.691	45%	0.445	S	S	*	.	S	Bend	trans	-68.3	14.2	-176.1	0	0	0	0	0	116.2
243	F	78.8	Confident	76.2	Confident	75 Å²	75	82.1 Å²	82.1	33%	0.329	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	152.1	178.6	66.8	-88	0	0	0	111.7	K230 L231 H241	K230-F243 HydrophobicContact CB-CB 4.15Å; K230-F243 HydrophobicContact CB-CD2 3.65Å; K230-F243 HydrophobicContact CB-CE2 4.29Å; K230-F243 HydrophobicContact CB-CG 3.99Å; K230-F243 HydrophobicContact CD-CD1 4.34Å; K230-F243 HydrophobicContact CD-CD2 3.88Å; K230-F243 HydrophobicContact CD-CE1 4.25Å; K230-F243 HydrophobicContact CD-CE2 3.78Å; K230-F243 HydrophobicContact CD-CG 4.17Å; K230-F243 HydrophobicContact CD-CZ 3.97Å; K230-F243 HydrophobicContact CG-CD2 3.52Å; K230-F243 HydrophobicContact CG-CE2 3.63Å; K230-F243 HydrophobicContact CG-CG 4.16Å; K230-F243 HydrophobicContact CG-CZ 4.34Å; L231-F243 CarbonylContact O-C 3.45Å; L231-F243 VanDerWaalsContact O-CA 3.3Å; L231-F243 WeakPolarHBondContact O-CA 3.38Å; H241-F243 PolarHBondContact O-N 2.85Å
244	E	90.4	Very high	77	Confident	75 Å²	75	84.2 Å²	84.2	35%	0.35	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	138.2	169.5	-176.3	176.1	173.3	0	0	109.7	L231 Q233 V246	L231-E244 HydrophobicContact CB-CB 4.39Å; L231-E244 PolarHBondContact N-O 3.15Å; L231-E244 PolarHBondContact O-N 2.96Å; Q233-E244 PolarHBondContact NE2-OE2 2.99Å; Q233-E244 VanDerWaalsContact NE2-OE2 3.17Å; E244-V246 HydrophobicContact CG-CG1 4.31Å
245	T	95	Very high	78.5	Confident	52 Å²	52	84.4 Å²	84.4	32%	0.319	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	123.2	176.2	-55.8	0	0	0	0	109.7	K228 A229 Y297	K228-T245 HydrophobicContact CD-CG2 4.38Å; K228-T245 HydrophobicContact CG-CG2 3.88Å; A229-T245 WeakPolarHBondContact O-CA 3.37Å; T245-Y297 HydrophobicContact CG2-CD1 3.51Å; T245-Y297 HydrophobicContact CG2-CE1 4.21Å; T245-Y297 HydrophobicContact CG2-CG 3.84Å
246	V	97.1	Very high	80.5	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	161	-178	-60.9	0	0	0	0	110.9	A229 L231 E244 V248 L280 I294	A229-V246 HydrophobicContact CB-CG2 4.06Å; A229-V246 PolarHBondContact N-O 3.39Å; A229-V246 PolarHBondContact O-N 2.8Å; L231-V246 HydrophobicContact CB-CG1 3.98Å; L231-V246 HydrophobicContact CB-CG2 4.14Å; L231-V246 HydrophobicContact CD2-CG1 4.2Å; E244-V246 HydrophobicContact CG-CG1 4.31Å; V246-V248 HydrophobicContact CG2-CG2 4.2Å; V246-L280 HydrophobicContact CG1-CD2 3.94Å; V246-I294 HydrophobicContact CB-CG2 4.07Å; V246-I294 HydrophobicContact CG1-CG2 4.45Å; V246-I294 HydrophobicContact CG2-CG2 4.08Å
247	A	97.9	Very high	82.3	Confident	10 Å²	10	80.8 Å²	80.8	8%	0.083	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	136.5	168.2	0	0	0	0	0	109.1	V226 Y227 I294 T295 Y297	V226-A247 HydrophobicContact CG1-CB 4.35Å; Y227-A247 CarbonylContact O-C 3.54Å; Y227-A247 WeakPolarHBondContact O-CA 3.46Å; A247-I294 WeakPolarHBondContact O-CA 3.4Å; A247-T295 PolarHBondContact N-O 3.43Å; A247-T295 PolarHBondContact O-N 2.83Å; A247-Y297 HydrophobicContact CB-CD2 4.23Å
248	V	97.9	Very high	84.3	Confident	0 Å²	0	77 Å²	77	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	109.4	-179.8	-176.7	0	0	0	0	108.2	I212 L214 V226 Y227 A229 V246 I250 W292 I294	I212-V248 HydrophobicContact CG2-CG2 3.89Å; L214-V248 HydrophobicContact CD2-CB 4.02Å; L214-V248 HydrophobicContact CD2-CG1 4.14Å; L214-V248 HydrophobicContact CD2-CG2 4.11Å; V226-V248 WeakPolarHBondContact CA-O 3.16Å; Y227-V248 PolarHBondContact N-O 2.99Å; Y227-V248 PolarHBondContact O-N 2.82Å; A229-V248 HydrophobicContact CB-CG2 3.57Å; V246-V248 HydrophobicContact CG2-CG2 4.2Å; V248-I250 HydrophobicContact CG1-CD1 4.28Å; V248-I250 HydrophobicContact CG1-CG1 3.77Å; V248-W292 HydrophobicContact CG1-CB 4.3Å; V248-W292 HydrophobicContact CG1-CD2 3.6Å; V248-W292 HydrophobicContact CG1-CE3 3.33Å; V248-W292 HydrophobicContact CG1-CG 4.06Å; V248-W292 HydrophobicContact CG1-CH2 4.46Å; V248-W292 HydrophobicContact CG1-CZ3 3.79Å; V248-I294 HydrophobicContact CG2-CG1 4.37Å
249	K	97.6	Very high	86.3	Confident	26 Å²	26	65.8 Å²	65.8	11%	0.113	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	115.6	172.9	-170.1	174.2	-176.7	-173.1	0	108.7	A224 E225 V226 F251 E262 W292 L293 D367	A224-K249 HydrophobicContact CB-CD 4.15Å; A224-K249 HydrophobicContact CB-CG 3.44Å; A224-K249 VanDerWaalsContact CB-CG 3.44Å; E225-K249 CarbonylContact O-C 3.53Å; E225-K249 WeakPolarHBondContact O-CA 3.44Å; V226-K249 HydrophobicContact CG2-CB 4.22Å; V226-K249 HydrophobicContact CG2-CD 4.36Å; V226-K249 HydrophobicContact CG2-CG 3.95Å; K249-F251 HydrophobicContact CB-CE2 4.11Å; K249-F251 HydrophobicContact CD-CE2 3.8Å; K249-F251 HydrophobicContact CD-CZ 3.58Å; K249-F251 VanDerWaalsContact CE-CZ 3.47Å; K249-F251 HydrophobicContact CG-CD2 4.32Å; K249-F251 HydrophobicContact CG-CE2 3.56Å; K249-F251 HydrophobicContact CG-CZ 3.8Å; K249-E262 IonicContact NZ-OE1 3.71Å; K249-E262 PolarHBondContact NZ-OE1 2.86Å; K249-E262 IonicContact NZ-OE2 3.47Å; K249-E262 PolarHBondContact NZ-OE2 3.32Å; K249-W292 CarbonylContact O-C 3.54Å; K249-W292 WeakPolarHBondContact O-CA 3.39Å; K249-L293 HydrophobicContact CB-CB 4.32Å; K249-L293 PolarHBondContact N-O 3.2Å; K249-L293 PolarHBondContact O-N 3.39Å; K249-D367 IonicContact NZ-OD1 3.67Å; K249-D367 PolarHBondContact NZ-OD1 3.36Å
250	I	97.3	Very high	88.6	Confident	7 Å²	7	61.9 Å²	61.9	4%	0.036	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.5	-174.5	-55.9	-178.7	0	0	0	109	L214 A224 E225 Y227 V248 Q290 W292	L214-I250 HydrophobicContact CD1-CD1 3.72Å; L214-I250 HydrophobicContact CD2-CD1 4.27Å; A224-I250 VanDerWaalsContact CA-O 3.28Å; A224-I250 WeakPolarHBondContact CA-O 3.15Å; A224-I250 VanDerWaalsContact CB-O 3.28Å; A224-I250 WeakPolarHBondContact CB-O 3.47Å; E225-I250 PolarHBondContact N-O 3.34Å; E225-I250 VanDerWaalsContact N-O 3.09Å; E225-I250 PolarHBondContact O-N 3.23Å; Y227-I250 HydrophobicContact CD2-CD1 3.72Å; Y227-I250 HydrophobicContact CD2-CG1 4.22Å; Y227-I250 HydrophobicContact CE2-CD1 3.92Å; V248-I250 HydrophobicContact CG1-CD1 4.28Å; V248-I250 HydrophobicContact CG1-CG1 3.77Å; I250-Q290 HydrophobicContact CG2-CB 4.12Å; I250-Q290 HydrophobicContact CG2-CG 3.95Å; I250-W292 HydrophobicContact CD1-CZ2 3.8Å; I250-W292 HydrophobicContact CG1-CD2 4.29Å; I250-W292 HydrophobicContact CG1-CG 4.3Å; I250-W292 HydrophobicContact CG1-CZ2 4.44Å
251	F	96.6	Very high	90.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	137.5	175.6	-59.9	-104.1	0	0	0	109.4	F223 A224 K249 E255 W259 Q290 Y291 L293	F223-F251 HydrophobicContact CB-CD1 4.16Å; F223-F251 HydrophobicContact CB-CE1 4.07Å; A224-F251 HydrophobicContact CB-CD1 3.71Å; A224-F251 HydrophobicContact CB-CD2 4.09Å; A224-F251 HydrophobicContact CB-CE1 3.75Å; A224-F251 HydrophobicContact CB-CE2 4.13Å; A224-F251 HydrophobicContact CB-CG 3.89Å; A224-F251 HydrophobicContact CB-CZ 3.98Å; K249-F251 HydrophobicContact CB-CE2 4.11Å; K249-F251 HydrophobicContact CD-CE2 3.8Å; K249-F251 HydrophobicContact CD-CZ 3.58Å; K249-F251 VanDerWaalsContact CE-CZ 3.47Å; K249-F251 HydrophobicContact CG-CD2 4.32Å; K249-F251 HydrophobicContact CG-CE2 3.56Å; K249-F251 HydrophobicContact CG-CZ 3.8Å; F251-E255 HydrophobicContact CB-CB 4.23Å; F251-E255 HydrophobicContact CD1-CB 4.22Å; F251-W259 HydrophobicContact CB-CB 4.04Å; F251-W259 HydrophobicContact CD1-CB 3.96Å; F251-W259 HydrophobicContact CD2-CB 3.83Å; F251-W259 AromaticContact CD2-CD1 3.55Å; F251-W259 HydrophobicContact CD2-CG 4.07Å; F251-W259 HydrophobicContact CE1-CB 4.33Å; F251-W259 HydrophobicContact CE2-CB 4.21Å; F251-W259 AromaticContact CE2-CD1 3.8Å; F251-W259 HydrophobicContact CE2-CG 4.43Å; F251-W259 HydrophobicContact CG-CB 3.69Å; F251-W259 HydrophobicContact CG-CG 4.37Å; F251-W259 HydrophobicContact CZ-CB 4.44Å; F251-Q290 WeakPolarHBondContact O-CA 3.36Å; F251-Y291 PolarHBondContact N-O 3.02Å; F251-Y291 PolarHBondContact O-N 2.67Å; F251-L293 HydrophobicContact CE2-CB 4.09Å
252	Q	94.6	Very high	92.3	Very high	84 Å²	84	49 Å²	49	39%	0.393	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	165.4	170.5	-59.4	-57.8	-29.7	0	0	110.5	E254 E255	Q252-E254 PolarHBondContact O-N 2.98Å; Q252-E255 PolarHBondContact O-N 3.14Å
253	F	92.3	Very high	93.6	Very high	94 Å²	94	49.1 Å²	49.1	41%	0.412	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-55.7	-37.9	-177.1	176.6	-96.7	0	0	0	112.9	E255 Y256 R289 Y291	F253-E255 PolarHBondContact O-N 3.45Å; F253-Y256 PolarHBondContact O-N 3.35Å; F253-R289 HydrophobicContact CB-CB 4.25Å; F253-R289 PolarHBondContact N-O 3.2Å; F253-Y291 HydrophobicContact CD2-CE2 4.21Å; F253-Y291 WeakPolarHBondContact CD2-OH 3.42Å; F253-Y291 WeakPolarHBondContact CE2-OH 3.49Å
254	E	92.8	Very high	94.4	Very high	132 Å²	132	48.5 Å²	48.5	62%	0.617	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-66.6	-25.2	-178.6	-62.7	68.2	-146.2	0	0	112	Q252 Y256 R289	Q252-E254 PolarHBondContact O-N 2.98Å; E254-Y256 VanDerWaalsContact C-N 3.31Å; E254-Y256 PolarHBondContact O-N 2.93Å; E254-R289 IonicContact OE1-NH2 3.47Å
255	E	93.1	Very high	94.6	Very high	60 Å²	60	45 Å²	45	28%	0.28	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-95	21.4	-177.7	-64.2	-61.7	158.2	0	0	112.9	F223 F251 Q252 F253 A257 S258 W259	F223-E255 HydrophobicContact CB-CG 4.43Å; F223-E255 WeakPolarHBondContact CD1-OE2 3.34Å; F223-E255 WeakPolarHBondContact O-CG 3.31Å; F251-E255 HydrophobicContact CB-CB 4.23Å; F251-E255 HydrophobicContact CD1-CB 4.22Å; Q252-E255 PolarHBondContact O-N 3.14Å; F253-E255 PolarHBondContact O-N 3.45Å; E255-A257 VanDerWaalsContact C-N 3.27Å; E255-A257 PolarHBondContact O-N 2.98Å; E255-S258 PolarHBondContact O-N 3.48Å; E255-S258 PolarHBondContact OE2-OG 3.38Å; E255-S258 VanDerWaalsContact OE2-OG 3.07Å; E255-W259 PolarHBondContact O-N 3.35Å; E255-W259 VanDerWaalsContact O-N 3.08Å
256	Y	92.4	Very high	94.6	Very high	102 Å²	102	43.3 Å²	43.3	40%	0.4	21%	0.214	S	C	.	.	H	α-helix	trans	-54.2	-40.7	178.3	175.2	-105.4	0	0	0	113.1	F253 E254 S258 W259 K260 Y291	F253-Y256 PolarHBondContact O-N 3.35Å; E254-Y256 VanDerWaalsContact C-N 3.31Å; E254-Y256 PolarHBondContact O-N 2.93Å; Y256-S258 VanDerWaalsContact C-N 3.35Å; Y256-S258 PolarHBondContact O-N 3.27Å; Y256-W259 AromaticContact CD2-CE3 3.9Å; Y256-W259 HydrophobicContact CD2-CE3 3.9Å; Y256-W259 HydrophobicContact CD2-CZ3 4.14Å; Y256-W259 AromaticContact CE2-CE3 3.85Å; Y256-W259 HydrophobicContact CE2-CE3 3.85Å; Y256-W259 AromaticContact CE2-CZ3 3.66Å; Y256-W259 HydrophobicContact CE2-CZ3 3.66Å; Y256-W259 PolarHBondContact O-N 3.45Å; Y256-K260 HydrophobicContact CE1-CB 4.39Å; Y256-K260 HydrophobicContact CE1-CD 3.93Å; Y256-K260 WeakPolarHBondContact O-CB 3.47Å; Y256-K260 PolarHBondContact O-N 2.85Å; Y256-Y291 HydrophobicContact CD2-CD1 4.14Å; Y256-Y291 HydrophobicContact CD2-CD2 4.18Å; Y256-Y291 AromaticContact CD2-CE1 3.62Å; Y256-Y291 HydrophobicContact CD2-CE1 3.62Å; Y256-Y291 AromaticContact CD2-CE2 3.64Å; Y256-Y291 HydrophobicContact CD2-CE2 3.64Å; Y256-Y291 HydrophobicContact CD2-CG 4.41Å; Y256-Y291 AromaticContact CD2-CZ 3.36Å; Y256-Y291 HydrophobicContact CE2-CE1 4Å; Y256-Y291 HydrophobicContact CG-CE2 4.14Å
257	A	90.2	Very high	94.4	Very high	74 Å²	74	46.6 Å²	46.6	61%	0.612	24%	0.237	S	C	*	.	H	α-helix	trans	-61.5	-44.3	-179.2	0	0	0	0	0	111.5	E255 K260 N261	E255-A257 VanDerWaalsContact C-N 3.27Å; E255-A257 PolarHBondContact O-N 2.98Å; A257-K260 PolarHBondContact O-N 3.41Å; A257-N261 WeakPolarHBondContact O-CB 3.29Å; A257-N261 PolarHBondContact O-N 3.46Å
258	S	90.5	Very high	94.1	Very high	14 Å²	14	47.6 Å²	47.6	10%	0.098	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-47.4	177.3	-50.5	0	0	0	0	111.4	F223 E255 Y256 N261 E262	F223-S258 WeakPolarHBondContact CD1-OG 3.47Å; E255-S258 PolarHBondContact O-N 3.48Å; E255-S258 PolarHBondContact OE2-OG 3.38Å; E255-S258 VanDerWaalsContact OE2-OG 3.07Å; Y256-S258 VanDerWaalsContact C-N 3.35Å; Y256-S258 PolarHBondContact O-N 3.27Å; S258-N261 PolarHBondContact O-N 3.25Å; S258-E262 PolarHBondContact O-N 3.43Å; S258-E262 VanDerWaalsContact O-N 3.12Å
259	W	95.2	Very high	93.7	Very high	9 Å²	9	50.7 Å²	50.7	3%	0.034	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-44.9	175.2	172.4	80.8	0	0	0	112.6	F251 E255 Y256 E262 K263 A282 Y291 W292	F251-W259 HydrophobicContact CB-CB 4.04Å; F251-W259 HydrophobicContact CD1-CB 3.96Å; F251-W259 HydrophobicContact CD2-CB 3.83Å; F251-W259 AromaticContact CD2-CD1 3.55Å; F251-W259 HydrophobicContact CD2-CG 4.07Å; F251-W259 HydrophobicContact CE1-CB 4.33Å; F251-W259 HydrophobicContact CE2-CB 4.21Å; F251-W259 AromaticContact CE2-CD1 3.8Å; F251-W259 HydrophobicContact CE2-CG 4.43Å; F251-W259 HydrophobicContact CG-CB 3.69Å; F251-W259 HydrophobicContact CG-CG 4.37Å; F251-W259 HydrophobicContact CZ-CB 4.44Å; E255-W259 PolarHBondContact O-N 3.35Å; E255-W259 VanDerWaalsContact O-N 3.08Å; Y256-W259 AromaticContact CD2-CE3 3.9Å; Y256-W259 HydrophobicContact CD2-CE3 3.9Å; Y256-W259 HydrophobicContact CD2-CZ3 4.14Å; Y256-W259 AromaticContact CE2-CE3 3.85Å; Y256-W259 HydrophobicContact CE2-CE3 3.85Å; Y256-W259 AromaticContact CE2-CZ3 3.66Å; Y256-W259 HydrophobicContact CE2-CZ3 3.66Å; Y256-W259 PolarHBondContact O-N 3.45Å; W259-E262 PolarHBondContact O-N 3.33Å; W259-K263 HydrophobicContact CH2-CD 3.67Å; W259-K263 HydrophobicContact CZ2-CD 3.75Å; W259-K263 HydrophobicContact CZ3-CD 4.09Å; W259-K263 VanDerWaalsContact O-CB 3.26Å; W259-K263 WeakPolarHBondContact O-CB 3.45Å; W259-K263 PolarHBondContact O-N 3.45Å; W259-A282 HydrophobicContact CZ2-CB 3.82Å; W259-Y291 VanDerWaalsContact CD2-CB 3.47Å; W259-Y291 HydrophobicContact CD2-CD1 4.23Å; W259-Y291 AromaticContact CD2-CG 3.99Å; W259-Y291 HydrophobicContact CD2-CG 3.99Å; W259-Y291 AromaticContact CE3-CD1 4Å; W259-Y291 HydrophobicContact CE3-CD1 4Å; W259-Y291 HydrophobicContact CE3-CG 4.08Å; W259-Y291 VanDerWaalsContact CG-CB 3.44Å; W259-Y291 HydrophobicContact CG-CG 4.24Å; W259-Y291 HydrophobicContact CH2-CD1 4.17Å; W259-Y291 HydrophobicContact CZ2-CD1 4.41Å; W259-Y291 AromaticContact CZ3-CD1 3.99Å; W259-Y291 HydrophobicContact CZ3-CD1 3.99Å; W259-W292 PolarHBondContact NE1-O 3.01Å
260	K	94	Very high	93.4	Very high	93 Å²	93	51.3 Å²	51.3	40%	0.404	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-44.2	-179.1	-174.4	-174.5	176.9	-165.7	0	110.5	Y256 A257 K263 D264	Y256-K260 HydrophobicContact CE1-CB 4.39Å; Y256-K260 HydrophobicContact CE1-CD 3.93Å; Y256-K260 WeakPolarHBondContact O-CB 3.47Å; Y256-K260 PolarHBondContact O-N 2.85Å; A257-K260 PolarHBondContact O-N 3.41Å; K260-K263 PolarHBondContact O-N 2.85Å; K260-D264 WeakPolarHBondContact CE-OD2 3.46Å; K260-D264 VanDerWaalsContact O-CB 3.31Å; K260-D264 WeakPolarHBondContact O-CB 3.46Å; K260-D264 PolarHBondContact O-N 3.13Å
261	N	91.9	Very high	93.1	Very high	53 Å²	53	51.1 Å²	51.1	28%	0.283	27%	0.27	S	S	.	.	H	α-helix	trans	-60.1	-50.4	177.3	-168.1	44.8	0	0	0	111.3	A257 S258 K263 D264 I265 F368 G369 A371	A257-N261 WeakPolarHBondContact O-CB 3.29Å; A257-N261 PolarHBondContact O-N 3.46Å; S258-N261 PolarHBondContact O-N 3.25Å; N261-K263 PolarHBondContact O-N 2.76Å; N261-D264 PolarHBondContact O-N 2.94Å; N261-I265 VanDerWaalsContact O-CG1 3.27Å; N261-I265 WeakPolarHBondContact O-CG1 3.35Å; N261-I265 PolarHBondContact O-N 2.85Å; N261-F368 PolarHBondContact ND2-O 2.7Å; N261-G369 PolarHBondContact ND2-O 3.15Å; N261-A371 PolarHBondContact ND2-O 3.04Å
262	E	94.5	Very high	92.9	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.009	31%	0.306	C	S	.	.	H	α-helix	trans	-58.2	-47.2	176.3	-92.4	174.4	-124.1	0	0	112.3	K249 S258 W259 D264 I265 F266 L293 F368 G369	K249-E262 IonicContact NZ-OE1 3.71Å; K249-E262 PolarHBondContact NZ-OE1 2.86Å; K249-E262 IonicContact NZ-OE2 3.47Å; K249-E262 PolarHBondContact NZ-OE2 3.32Å; S258-E262 PolarHBondContact O-N 3.43Å; S258-E262 VanDerWaalsContact O-N 3.12Å; W259-E262 PolarHBondContact O-N 3.33Å; E262-D264 VanDerWaalsContact C-N 3.33Å; E262-D264 PolarHBondContact O-N 2.93Å; E262-I265 PolarHBondContact O-N 3.29Å; E262-F266 HydrophobicContact CB-CD2 4.31Å; E262-F266 HydrophobicContact CB-CE2 4.48Å; E262-F266 HydrophobicContact CG-CE2 4.45Å; E262-F266 WeakPolarHBondContact O-CB 3.42Å; E262-F266 WeakPolarHBondContact O-CD2 3.22Å; E262-F266 PolarHBondContact O-N 2.96Å; E262-L293 HydrophobicContact CB-CD1 3.57Å; E262-L293 HydrophobicContact CG-CD1 4.5Å; E262-F368 VanDerWaalsContact CG-C 3.41Å; E262-F368 HydrophobicContact CG-CB 4.08Å; E262-G369 WeakPolarHBondContact OE1-CA 3.44Å; E262-G369 PolarHBondContact OE1-N 2.89Å
263	K	95.8	Very high	92.9	Very high	69 Å²	69	59.2 Å²	59.2	30%	0.3	30%	0.299	S	S	.	.	H	α-helix	trans	-57.7	-47	177.5	174.5	-174.3	169.9	-179.1	0	111.2	W259 K260 N261 I265 F266 S267 A282	W259-K263 HydrophobicContact CH2-CD 3.67Å; W259-K263 HydrophobicContact CZ2-CD 3.75Å; W259-K263 HydrophobicContact CZ3-CD 4.09Å; W259-K263 VanDerWaalsContact O-CB 3.26Å; W259-K263 WeakPolarHBondContact O-CB 3.45Å; W259-K263 PolarHBondContact O-N 3.45Å; K260-K263 PolarHBondContact O-N 2.85Å; N261-K263 PolarHBondContact O-N 2.76Å; K263-I265 VanDerWaalsContact C-N 3.34Å; K263-I265 PolarHBondContact O-N 3.18Å; K263-F266 PolarHBondContact O-N 3.43Å; K263-S267 VanDerWaalsContact O-CB 3.22Å; K263-S267 WeakPolarHBondContact O-CB 3.43Å; K263-S267 PolarHBondContact O-N 3.33Å; K263-S267 PolarHBondContact O-OG 3.02Å; K263-A282 HydrophobicContact CB-CB 4.32Å; K263-A282 HydrophobicContact CD-CB 3.82Å; K263-A282 HydrophobicContact CG-CB 3.84Å
264	D	94.7	Very high	93.1	Very high	63 Å²	63	60.1 Å²	60.1	34%	0.337	30%	0.304	S	S	.	.	H	α-helix	trans	-66.5	-37.7	-176.3	-72.3	-12.4	0	0	0	111	K260 N261 E262 R373	K260-D264 WeakPolarHBondContact CE-OD2 3.46Å; K260-D264 VanDerWaalsContact O-CB 3.31Å; K260-D264 WeakPolarHBondContact O-CB 3.46Å; K260-D264 PolarHBondContact O-N 3.13Å; N261-D264 PolarHBondContact O-N 2.94Å; E262-D264 VanDerWaalsContact C-N 3.33Å; E262-D264 PolarHBondContact O-N 2.93Å; D264-R373 PolarHBondContact O-NH1 3.01Å; D264-R373 PolarHBondContact O-NH2 3Å
265	I	94.6	Very high	93.3	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-52.7	173.2	-65	-70.2	0	0	0	110.7	N261 E262 K263 S267 D268 L271 I345 F368 A371 R373	N261-I265 VanDerWaalsContact O-CG1 3.27Å; N261-I265 WeakPolarHBondContact O-CG1 3.35Å; N261-I265 PolarHBondContact O-N 2.85Å; E262-I265 PolarHBondContact O-N 3.29Å; K263-I265 VanDerWaalsContact C-N 3.34Å; K263-I265 PolarHBondContact O-N 3.18Å; I265-S267 VanDerWaalsContact C-N 3.27Å; I265-S267 PolarHBondContact O-N 3.3Å; I265-D268 WeakPolarHBondContact O-CB 3.46Å; I265-D268 PolarHBondContact O-N 3.39Å; I265-D268 VanDerWaalsContact O-N 3.12Å; I265-L271 HydrophobicContact CG2-CD2 3.58Å; I265-L271 WeakPolarHBondContact O-CD2 3.32Å; I265-I345 HydrophobicContact CD1-CD1 4.45Å; I265-I345 HydrophobicContact CG2-CD1 4.42Å; I265-F368 HydrophobicContact CB-CB 4.2Å; I265-F368 HydrophobicContact CG2-CB 3.83Å; I265-F368 HydrophobicContact CG2-CD1 3.68Å; I265-F368 HydrophobicContact CG2-CE1 4.42Å; I265-F368 HydrophobicContact CG2-CG 3.8Å; I265-A371 HydrophobicContact CD1-CB 4.47Å; I265-A371 HydrophobicContact CG1-CB 4.38Å; I265-R373 HydrophobicContact CD1-CG 3.66Å
266	F	94.9	Very high	93.6	Very high	16 Å²	16	51.5 Å²	51.5	7%	0.07	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-27.3	-178.8	-82.2	-59.3	0	0	0	114.3	E262 K263 D268 L271 V276 L277 F279 L293 F368	E262-F266 HydrophobicContact CB-CD2 4.31Å; E262-F266 HydrophobicContact CB-CE2 4.48Å; E262-F266 HydrophobicContact CG-CE2 4.45Å; E262-F266 WeakPolarHBondContact O-CB 3.42Å; E262-F266 WeakPolarHBondContact O-CD2 3.22Å; E262-F266 PolarHBondContact O-N 2.96Å; K263-F266 PolarHBondContact O-N 3.43Å; F266-D268 PolarHBondContact O-N 2.87Å; F266-L271 HydrophobicContact CD1-CD2 4.34Å; F266-V276 HydrophobicContact CE1-CG1 4.24Å; F266-L277 HydrophobicContact CE1-CB 4.36Å; F266-L277 HydrophobicContact CZ-CB 4.46Å; F266-F279 HydrophobicContact CB-CB 3.86Å; F266-F279 HydrophobicContact CB-CD1 3.78Å; F266-F279 HydrophobicContact CB-CD2 3.87Å; F266-F279 HydrophobicContact CB-CE1 4.22Å; F266-F279 HydrophobicContact CB-CE2 4.31Å; F266-F279 HydrophobicContact CB-CG 3.57Å; F266-F279 HydrophobicContact CB-CZ 4.46Å; F266-F279 HydrophobicContact CD1-CB 3.75Å; F266-F279 HydrophobicContact CD1-CG 4.37Å; F266-F279 HydrophobicContact CD2-CD2 4.38Å; F266-F279 HydrophobicContact CE1-CB 4.45Å; F266-F279 HydrophobicContact CG-CB 3.92Å; F266-F279 HydrophobicContact CG-CD2 4.14Å; F266-F279 HydrophobicContact CG-CG 4.03Å; F266-L293 HydrophobicContact CD2-CD1 4.01Å; F266-L293 HydrophobicContact CD2-CD2 4.16Å; F266-L293 HydrophobicContact CE2-CD1 4.3Å; F266-L293 HydrophobicContact CE2-CD2 4.12Å; F266-F368 HydrophobicContact CD1-CD2 4.38Å; F266-F368 HydrophobicContact CD1-CE2 4.44Å; F266-F368 HydrophobicContact CD2-CD2 4.49Å; F266-F368 AromaticContact CE1-CD2 3.65Å; F266-F368 HydrophobicContact CE1-CD2 3.65Å; F266-F368 AromaticContact CE1-CE2 3.57Å; F266-F368 HydrophobicContact CE1-CE2 3.57Å; F266-F368 AromaticContact CE2-CD2 3.79Å; F266-F368 HydrophobicContact CE2-CD2 3.79Å; F266-F368 AromaticContact CZ-CD2 3.33Å; F266-F368 HydrophobicContact CZ-CD2 3.33Å; F266-F368 AromaticContact CZ-CE2 3.62Å; F266-F368 HydrophobicContact CZ-CE2 3.62Å
267	S	93.8	Very high	93.8	Very high	69 Å²	69	47.3 Å²	47.3	48%	0.483	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-8.5	177.5	-59.7	0	0	0	0	113	K263 I265 A269	K263-S267 VanDerWaalsContact O-CB 3.22Å; K263-S267 WeakPolarHBondContact O-CB 3.43Å; K263-S267 PolarHBondContact O-N 3.33Å; K263-S267 PolarHBondContact O-OG 3.02Å; I265-S267 VanDerWaalsContact C-N 3.27Å; I265-S267 PolarHBondContact O-N 3.3Å; S267-A269 PolarHBondContact O-N 3.24Å
268	D	91.8	Very high	94.1	Very high	32 Å²	32	49.4 Å²	49.4	17%	0.171	25%	0.246	C	C	.	.			trans	-68.3	119.4	175.5	-156.9	-40.2	0	0	0	111.3	I265 F266 D270 L271 R373	I265-D268 WeakPolarHBondContact O-CB 3.46Å; I265-D268 PolarHBondContact O-N 3.39Å; I265-D268 VanDerWaalsContact O-N 3.12Å; F266-D268 PolarHBondContact O-N 2.87Å; D268-D270 PolarHBondContact O-N 3.19Å; D268-D270 PolarHBondContact OD1-N 3.42Å; D268-L271 HydrophobicContact CB-CB 3.88Å; D268-L271 WeakPolarHBondContact O-CB 3.19Å; D268-L271 PolarHBondContact O-N 3.36Å; D268-R373 IonicContact OD2-CZ 3.72Å; D268-R373 IonicContact OD2-NE 2.6Å; D268-R373 IonicContact OD2-NH2 2.91Å; D268-R373 PolarHBondContact OD2-NH2 3.44Å
269	A	88.9	Confident	94.3	Very high	65 Å²	65	50.7 Å²	50.7	54%	0.537	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-65	-29.7	179.3	0	0	0	0	0	112.2	S267 L271	S267-A269 PolarHBondContact O-N 3.24Å; A269-L271 VanDerWaalsContact C-N 3.32Å
270	D	91.4	Very high	94.2	Very high	39 Å²	39	52.7 Å²	52.7	21%	0.209	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-83.5	-9.9	-177.9	-66.8	-39.7	0	0	0	112.4	D268 R272 H330 T336 R340 K342	D268-D270 PolarHBondContact O-N 3.19Å; D268-D270 PolarHBondContact OD1-N 3.42Å; D270-R272 VanDerWaalsContact C-N 3.34Å; D270-H330 PolarHBondContact O-CE1 2.92Å; D270-H330 PolarHBondContact O-NE2 2.86Å; D270-T336 HydrophobicContact CB-CG2 3.75Å; D270-T336 WeakPolarHBondContact OD1-CG2 3.44Å; D270-R340 IonicContact OD1-CZ 3.88Å; D270-R340 IonicContact OD1-NE 3.73Å; D270-R340 IonicContact OD1-NH2 2.99Å; D270-R340 PolarHBondContact OD1-NH2 3.08Å; D270-K342 HydrophobicContact CB-CB 4.3Å; D270-K342 HydrophobicContact CB-CD 4.18Å; D270-K342 HydrophobicContact CB-CG 4.17Å; D270-K342 WeakPolarHBondContact O-CD 3.16Å
271	L	91.6	Very high	94.3	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-74.5	-23.4	172.3	-179.4	65.8	0	0	0	112.8	I265 F266 D268 A269 H273 V276 H330 L331 I345	I265-L271 HydrophobicContact CG2-CD2 3.58Å; I265-L271 WeakPolarHBondContact O-CD2 3.32Å; F266-L271 HydrophobicContact CD1-CD2 4.34Å; D268-L271 HydrophobicContact CB-CB 3.88Å; D268-L271 WeakPolarHBondContact O-CB 3.19Å; D268-L271 PolarHBondContact O-N 3.36Å; A269-L271 VanDerWaalsContact C-N 3.32Å; L271-H273 PolarHBondContact O-N 2.89Å; L271-V276 HydrophobicContact CD1-CG2 4.35Å; L271-V276 HydrophobicContact CD2-CG1 4.35Å; L271-V276 HydrophobicContact CG-CG1 4.17Å; L271-H330 PolarHBondContact O-NE2 2.85Å; L271-L331 HydrophobicContact CD1-CD2 3.26Å; L271-I345 HydrophobicContact CD1-CD1 3.87Å
272	R	91.1	Very high	94.5	Very high	204 Å²	204	49 Å²	49	77%	0.77	25%	0.25	S	S	*	.			trans	-55.7	124.2	-174.5	-67.9	-178	175.7	-159	-2.1	111.8	D270	D270-R272 VanDerWaalsContact C-N 3.34Å
273	H	95.3	Very high	94.5	Very high	50 Å²	50	49.6 Å²	49.6	23%	0.231	25%	0.253	C	S	.	.			trans	-156.2	153.8	-179.7	-173.9	-97.5	0	0	0	109.8	L271 N275 V276 H330	L271-H273 PolarHBondContact O-N 2.89Å; H273-N275 PolarHBondContact CE1-OD1 3.04Å; H273-N275 PolarHBondContact ND1-N 2.8Å; H273-N275 VanDerWaalsContact ND1-N 3.12Å; H273-N275 PolarHBondContact O-N 2.68Å; H273-V276 HydrophobicContact CB-CB 4.29Å; H273-V276 HydrophobicContact CB-CG2 3.92Å; H273-V276 PolarHBondContact O-N 2.88Å; H273-V276 VanDerWaalsContact O-N 3.12Å; H273-H330 AromaticContact CD2-CG 3.74Å; H273-H330 AromaticContact CD2-ND1 3.84Å; H273-H330 AromaticContact CG-CD2 3.9Å; H273-H330 AromaticContact CG-CG 3.87Å
274	E	96	Very high	94.5	Very high	114 Å²	114	50.6 Å²	50.6	53%	0.533	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26	-178.1	54.9	162.7	-173.4	0	0	114.1	R326	E274-R326 IonicContact OE1-NH1 3.75Å; E274-R326 PolarHBondContact OE1-NH1 3.49Å
275	N	98.1	Very high	94.3	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	13	179.8	-53.9	121.5	0	0	0	112.7	H273 S323 V327 C363 C364 L365	H273-N275 PolarHBondContact CE1-OD1 3.04Å; H273-N275 PolarHBondContact ND1-N 2.8Å; H273-N275 VanDerWaalsContact ND1-N 3.12Å; H273-N275 PolarHBondContact O-N 2.68Å; N275-S323 WeakPolarHBondContact ND2-CB 3.37Å; N275-V327 HydrophobicContact CB-CB 3.73Å; N275-V327 HydrophobicContact CB-CG1 4.37Å; N275-V327 HydrophobicContact CB-CG2 4.46Å; N275-V327 WeakPolarHBondContact O-CB 3.3Å; N275-V327 VanDerWaalsContact O-CG2 3.23Å; N275-V327 WeakPolarHBondContact O-CG2 3.48Å; N275-C363 WeakPolarHBondContact CB-O 3.44Å; N275-C363 PolarHBondContact ND2-O 2.63Å; N275-C364 CarbonylContact O-C 3.54Å; N275-C364 WeakPolarHBondContact O-CA 3.3Å; N275-C364 WeakPolarHBondContact O-CB 3.44Å; N275-L365 PolarHBondContact O-N 2.81Å
276	V	97.8	Very high	93.7	Very high	11 Å²	11	56.2 Å²	56.2	7%	0.067	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-100.7	136.6	163.1	173	0	0	0	0	107.9	F266 L271 H273 H278 V327 L331 F368	F266-V276 HydrophobicContact CE1-CG1 4.24Å; L271-V276 HydrophobicContact CD1-CG2 4.35Å; L271-V276 HydrophobicContact CD2-CG1 4.35Å; L271-V276 HydrophobicContact CG-CG1 4.17Å; H273-V276 HydrophobicContact CB-CB 4.29Å; H273-V276 HydrophobicContact CB-CG2 3.92Å; H273-V276 PolarHBondContact O-N 2.88Å; H273-V276 VanDerWaalsContact O-N 3.12Å; V276-H278 PolarHBondContact O-N 3.17Å; V276-V327 HydrophobicContact CG2-CG2 3.57Å; V276-L331 HydrophobicContact CG2-CD2 4.43Å; V276-F368 HydrophobicContact CG1-CE2 4.11Å; V276-F368 HydrophobicContact CG1-CZ 3.98Å
277	L	97.6	Very high	93.3	Very high	14 Å²	14	59.7 Å²	59.7	7%	0.073	32%	0.319	C	S	.	.			trans	-52.7	127.1	179.4	177.5	58.8	0	0	0	111.3	F266 F279 T295 L356 L365 C366	F266-L277 HydrophobicContact CE1-CB 4.36Å; F266-L277 HydrophobicContact CZ-CB 4.46Å; L277-F279 PolarHBondContact O-N 3.19Å; L277-F279 VanDerWaalsContact O-N 3.08Å; L277-T295 HydrophobicContact CD2-CG2 3.85Å; L277-T295 HydrophobicContact CG-CG2 4.12Å; L277-L356 HydrophobicContact CD1-CD1 3.92Å; L277-L356 HydrophobicContact CD2-CD1 4.12Å; L277-L365 WeakPolarHBondContact CB-O 3.37Å; L277-L365 PolarHBondContact N-O 2.65Å; L277-C366 HydrophobicContact CB-CB 3.98Å; L277-C366 HydrophobicContact CD2-CB 3.5Å; L277-C366 VanDerWaalsContact CD2-CB 3.5Å; L277-C366 HydrophobicContact CG-CB 4.36Å
278	H	95.6	Very high	92.9	Very high	118 Å²	118	61.6 Å²	61.6	55%	0.546	32%	0.321	S	S	.	.			trans	-67.9	110.1	-178.2	-175.1	65.9	0	0	0	111	V276 T295 A296	V276-H278 PolarHBondContact O-N 3.17Å; H278-T295 CarbonylContact O-C 3.52Å; H278-T295 VanDerWaalsContact O-CA 3.25Å; H278-T295 WeakPolarHBondContact O-CA 3.44Å; H278-T295 VanDerWaalsContact O-CB 3.32Å; H278-T295 WeakPolarHBondContact O-CB 3.39Å; H278-A296 HydrophobicContact CB-CB 3.86Å; H278-A296 PolarHBondContact O-N 3.16Å
279	F	95.6	Very high	93	Very high	40 Å²	40	66.8 Å²	66.8	18%	0.175	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	126.5	175.7	172.6	-113	0	0	0	110.9	F266 L277 T281 A282 L293 T295	F266-F279 HydrophobicContact CB-CB 3.86Å; F266-F279 HydrophobicContact CB-CD1 3.78Å; F266-F279 HydrophobicContact CB-CD2 3.87Å; F266-F279 HydrophobicContact CB-CE1 4.22Å; F266-F279 HydrophobicContact CB-CE2 4.31Å; F266-F279 HydrophobicContact CB-CG 3.57Å; F266-F279 HydrophobicContact CB-CZ 4.46Å; F266-F279 HydrophobicContact CD1-CB 3.75Å; F266-F279 HydrophobicContact CD1-CG 4.37Å; F266-F279 HydrophobicContact CD2-CD2 4.38Å; F266-F279 HydrophobicContact CE1-CB 4.45Å; F266-F279 HydrophobicContact CG-CB 3.92Å; F266-F279 HydrophobicContact CG-CD2 4.14Å; F266-F279 HydrophobicContact CG-CG 4.03Å; L277-F279 PolarHBondContact O-N 3.19Å; L277-F279 VanDerWaalsContact O-N 3.08Å; F279-T281 WeakPolarHBondContact CE2-O 3.28Å; F279-A282 HydrophobicContact CE2-CB 4.12Å; F279-A282 HydrophobicContact CZ-CB 3.95Å; F279-L293 HydrophobicContact CD2-CD2 3.77Å; F279-L293 HydrophobicContact CD2-CG 4.22Å; F279-L293 HydrophobicContact CE2-CD2 3.97Å; F279-L293 HydrophobicContact CE2-CG 3.9Å; F279-T295 HydrophobicContact CD2-CG2 4.5Å
280	L	93.9	Very high	93.3	Very high	51 Å²	51	65.7 Å²	65.7	27%	0.267	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-59.5	176.6	-75.5	73	0	0	0	109.9	L231 V246 I294 A296	L231-L280 HydrophobicContact CD2-CD2 4.27Å; V246-L280 HydrophobicContact CG1-CD2 3.94Å; L280-I294 HydrophobicContact CB-CG2 4.32Å; L280-I294 WeakPolarHBondContact CB-O 3.29Å; L280-I294 HydrophobicContact CD2-CG2 4.32Å; L280-I294 PolarHBondContact N-O 3.16Å; L280-A296 VanDerWaalsContact CD1-N 3.32Å
281	T	95.2	Very high	93.5	Very high	49 Å²	49	64.6 Å²	64.6	30%	0.301	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	170.2	-178.6	-166.3	0	0	0	0	111.8	L210 F279 E283 I294	L210-T281 HydrophobicContact CD1-CG2 3.61Å; F279-T281 WeakPolarHBondContact CE2-O 3.28Å; T281-E283 HydrophobicContact CG2-CG 4.38Å; T281-I294 HydrophobicContact CG2-CB 4.35Å; T281-I294 HydrophobicContact CG2-CD1 3.89Å; T281-I294 PolarHBondContact N-O 3.16Å; T281-I294 PolarHBondContact O-N 3.41Å
282	A	96.4	Very high	93.8	Very high	19 Å²	19	64.9 Å²	64.9	16%	0.157	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.5	170.5	0	0	0	0	0	109.6	W259 K263 F279 W292	W259-A282 HydrophobicContact CZ2-CB 3.82Å; K263-A282 HydrophobicContact CB-CB 4.32Å; K263-A282 HydrophobicContact CD-CB 3.82Å; K263-A282 HydrophobicContact CG-CB 3.84Å; F279-A282 HydrophobicContact CE2-CB 4.12Å; F279-A282 HydrophobicContact CZ-CB 3.95Å; A282-W292 CarbonylContact C-O 3.6Å; A282-W292 VanDerWaalsContact CA-O 3.26Å; A282-W292 WeakPolarHBondContact CA-O 3.19Å
283	E	95	Very high	94.1	Very high	16 Å²	16	55.2 Å²	55.2	8%	0.075	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.1	-177.7	-66.2	-177.6	171.2	0	0	111.2	L209 L210 T281 R285 W292 I294	L209-E283 HydrophobicContact CD2-CB 4.1Å; L209-E283 HydrophobicContact CD2-CG 4.22Å; L210-E283 WeakPolarHBondContact CB-OE1 3.48Å; L210-E283 VanDerWaalsContact CG-OE1 3.28Å; L210-E283 WeakPolarHBondContact CG-OE1 3.25Å; L210-E283 PolarHBondContact N-OE1 3.47Å; T281-E283 HydrophobicContact CG2-CG 4.38Å; E283-R285 IonicContact OE2-CZ 3.38Å; E283-R285 IonicContact OE2-NE 3.11Å; E283-R285 PolarHBondContact OE2-NE 2.69Å; E283-R285 VanDerWaalsContact OE2-NE 3.11Å; E283-R285 IonicContact OE2-NH2 2.77Å; E283-R285 PolarHBondContact OE2-NH2 3.19Å; E283-W292 HydrophobicContact CB-CB 4.26Å; E283-W292 PolarHBondContact N-O 2.6Å; E283-W292 PolarHBondContact O-N 3.3Å; E283-I294 HydrophobicContact CB-CD1 4.3Å; E283-I294 HydrophobicContact CG-CD1 3.88Å
284	E	94.3	Very high	94.2	Very high	90 Å²	90	52.9 Å²	52.9	42%	0.421	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	112.2	168.4	-175.8	-175.9	179	0	0	109.1	K286 Y291	E284-K286 HydrophobicContact CG-CG 3.79Å; E284-K286 PolarHBondContact O-N 3.3Å; E284-K286 WeakPolarHBondContact OE1-CE 3.45Å; E284-K286 WeakPolarHBondContact OE1-CG 3.42Å; E284-K286 WeakPolarHBondContact OE2-CE 3.13Å; E284-K286 IonicContact OE2-NZ 3.53Å; E284-Y291 HydrophobicContact CB-CD1 4.33Å; E284-Y291 HydrophobicContact CG-CD1 3.86Å; E284-Y291 HydrophobicContact CG-CE1 3.72Å
285	R	91.7	Very high	94.3	Very high	30 Å²	30	47.9 Å²	47.9	11%	0.113	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	73	178.9	-61.9	-162.8	173.9	-150.9	-5.8	109.7	L209 L210 E283 G287 Q288 R289 Q290 W292	L209-R285 HydrophobicContact CD1-CG 4.09Å; L209-R285 HydrophobicContact CD2-CG 4.31Å; L210-R285 PolarHBondContact O-NH2 3.12Å; E283-R285 IonicContact OE2-CZ 3.38Å; E283-R285 IonicContact OE2-NE 3.11Å; E283-R285 PolarHBondContact OE2-NE 2.69Å; E283-R285 VanDerWaalsContact OE2-NE 3.11Å; E283-R285 IonicContact OE2-NH2 2.77Å; E283-R285 PolarHBondContact OE2-NH2 3.19Å; R285-G287 VanDerWaalsContact C-N 3.28Å; R285-G287 PolarHBondContact O-N 3.1Å; R285-G287 VanDerWaalsContact O-N 3.16Å; R285-Q288 HydrophobicContact CB-CB 4.38Å; R285-Q288 CarbonylContact O-C 3.57Å; R285-Q288 WeakPolarHBondContact O-CA 3.45Å; R285-Q288 PolarHBondContact O-N 3.35Å; R285-R289 PolarHBondContact O-N 3.01Å; R285-R289 VanDerWaalsContact O-N 3.08Å; R285-Q290 PolarHBondContact N-O 3.15Å; R285-Q290 PolarHBondContact O-N 2.9Å; R285-W292 HydrophobicContact CG-CD2 4.48Å; R285-W292 HydrophobicContact CG-CG 4.44Å; R285-W292 VanDerWaalsContact CZ-CE3 3.42Å; R285-W292 VanDerWaalsContact CZ-CH2 3.48Å; R285-W292 VanDerWaalsContact NH2-CZ3 3.35Å
286	K	82.2	Confident	94.2	Very high	152 Å²	152	48.9 Å²	48.9	66%	0.661	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-49.8	-42.5	-173.8	-67.7	-174.9	177.1	178.4	0	113.9	E284 Q288 R289	E284-K286 HydrophobicContact CG-CG 3.79Å; E284-K286 PolarHBondContact O-N 3.3Å; E284-K286 WeakPolarHBondContact OE1-CE 3.45Å; E284-K286 WeakPolarHBondContact OE1-CG 3.42Å; E284-K286 WeakPolarHBondContact OE2-CE 3.13Å; E284-K286 IonicContact OE2-NZ 3.53Å; K286-Q288 PolarHBondContact O-N 3.07Å; K286-R289 PolarHBondContact O-N 2.69Å; K286-R289 VanDerWaalsContact O-N 3.16Å
287	G	85.2	Confident	94.2	Very high	88 Å²	88	51.3 Å²	51.3	91%	0.907	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-63.5	-25.7	178.7	0	0	0	0	0	114.1	R285	R285-G287 VanDerWaalsContact C-N 3.28Å; R285-G287 PolarHBondContact O-N 3.1Å; R285-G287 VanDerWaalsContact O-N 3.16Å
288	Q	86.9	Confident	94.1	Very high	110 Å²	110	52.4 Å²	52.4	51%	0.514	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-101.6	-3.1	178.6	-65.5	175.7	-45.4	0	0	112.5	R285 K286 Q290	R285-Q288 HydrophobicContact CB-CB 4.38Å; R285-Q288 CarbonylContact O-C 3.57Å; R285-Q288 WeakPolarHBondContact O-CA 3.45Å; R285-Q288 PolarHBondContact O-N 3.35Å; K286-Q288 PolarHBondContact O-N 3.07Å; Q288-Q290 HydrophobicContact CB-CB 4.38Å; Q288-Q290 HydrophobicContact CB-CG 4.31Å; Q288-Q290 PolarHBondContact O-N 3.27Å
289	R	92.5	Very high	94.1	Very high	141 Å²	141	49.8 Å²	49.8	53%	0.532	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	39	-172.3	-61	-178.1	64.3	-150.6	-7.5	112.8	F253 E254 R285 K286	F253-R289 HydrophobicContact CB-CB 4.25Å; F253-R289 PolarHBondContact N-O 3.2Å; E254-R289 IonicContact OE1-NH2 3.47Å; R285-R289 PolarHBondContact O-N 3.01Å; R285-R289 VanDerWaalsContact O-N 3.08Å; K286-R289 PolarHBondContact O-N 2.69Å; K286-R289 VanDerWaalsContact O-N 3.16Å
290	Q	95.6	Very high	94.2	Very high	41 Å²	41	51 Å²	51	19%	0.192	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.4	-179	-73.7	175.1	-1	0	0	111.2	I250 F251 R285 Q288 W292	I250-Q290 HydrophobicContact CG2-CB 4.12Å; I250-Q290 HydrophobicContact CG2-CG 3.95Å; F251-Q290 WeakPolarHBondContact O-CA 3.36Å; R285-Q290 PolarHBondContact N-O 3.15Å; R285-Q290 PolarHBondContact O-N 2.9Å; Q288-Q290 HydrophobicContact CB-CB 4.38Å; Q288-Q290 HydrophobicContact CB-CG 4.31Å; Q288-Q290 PolarHBondContact O-N 3.27Å; Q290-W292 VanDerWaalsContact OE1-NE1 3.09Å
291	Y	97	Very high	94.4	Very high	17 Å²	17	49.5 Å²	49.5	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.7	171.5	-50.7	-79	0	0	0	109.2	F251 F253 Y256 W259 E284	F251-Y291 PolarHBondContact N-O 3.02Å; F251-Y291 PolarHBondContact O-N 2.67Å; F253-Y291 HydrophobicContact CD2-CE2 4.21Å; F253-Y291 WeakPolarHBondContact CD2-OH 3.42Å; F253-Y291 WeakPolarHBondContact CE2-OH 3.49Å; Y256-Y291 HydrophobicContact CD2-CD1 4.14Å; Y256-Y291 HydrophobicContact CD2-CD2 4.18Å; Y256-Y291 AromaticContact CD2-CE1 3.62Å; Y256-Y291 HydrophobicContact CD2-CE1 3.62Å; Y256-Y291 AromaticContact CD2-CE2 3.64Å; Y256-Y291 HydrophobicContact CD2-CE2 3.64Å; Y256-Y291 HydrophobicContact CD2-CG 4.41Å; Y256-Y291 AromaticContact CD2-CZ 3.36Å; Y256-Y291 HydrophobicContact CE2-CE1 4Å; Y256-Y291 HydrophobicContact CG-CE2 4.14Å; W259-Y291 VanDerWaalsContact CD2-CB 3.47Å; W259-Y291 HydrophobicContact CD2-CD1 4.23Å; W259-Y291 AromaticContact CD2-CG 3.99Å; W259-Y291 HydrophobicContact CD2-CG 3.99Å; W259-Y291 AromaticContact CE3-CD1 4Å; W259-Y291 HydrophobicContact CE3-CD1 4Å; W259-Y291 HydrophobicContact CE3-CG 4.08Å; W259-Y291 VanDerWaalsContact CG-CB 3.44Å; W259-Y291 HydrophobicContact CG-CG 4.24Å; W259-Y291 HydrophobicContact CH2-CD1 4.17Å; W259-Y291 HydrophobicContact CZ2-CD1 4.41Å; W259-Y291 AromaticContact CZ3-CD1 3.99Å; W259-Y291 HydrophobicContact CZ3-CD1 3.99Å; E284-Y291 HydrophobicContact CB-CD1 4.33Å; E284-Y291 HydrophobicContact CG-CD1 3.86Å; E284-Y291 HydrophobicContact CG-CE1 3.72Å
292	W	97.6	Very high	94.5	Very high	7 Å²	7	48.3 Å²	48.3	3%	0.027	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	141.4	-175.1	-72.3	24.3	0	0	0	109.8	I212 L214 V248 K249 I250 W259 A282 E283 R285 Q290 I294	I212-W292 HydrophobicContact CB-CZ3 4.13Å; I212-W292 HydrophobicContact CD1-CZ3 4.45Å; I212-W292 HydrophobicContact CG2-CZ3 3.9Å; L214-W292 HydrophobicContact CD1-CH2 3.95Å; L214-W292 HydrophobicContact CD1-CZ2 4.06Å; L214-W292 HydrophobicContact CD2-CH2 3.74Å; L214-W292 HydrophobicContact CD2-CZ2 4.41Å; L214-W292 HydrophobicContact CD2-CZ3 4.06Å; L214-W292 HydrophobicContact CG-CH2 3.88Å; L214-W292 HydrophobicContact CG-CZ2 4.48Å; V248-W292 HydrophobicContact CG1-CB 4.3Å; V248-W292 HydrophobicContact CG1-CD2 3.6Å; V248-W292 HydrophobicContact CG1-CE3 3.33Å; V248-W292 HydrophobicContact CG1-CG 4.06Å; V248-W292 HydrophobicContact CG1-CH2 4.46Å; V248-W292 HydrophobicContact CG1-CZ3 3.79Å; K249-W292 CarbonylContact O-C 3.54Å; K249-W292 WeakPolarHBondContact O-CA 3.39Å; I250-W292 HydrophobicContact CD1-CZ2 3.8Å; I250-W292 HydrophobicContact CG1-CD2 4.29Å; I250-W292 HydrophobicContact CG1-CG 4.3Å; I250-W292 HydrophobicContact CG1-CZ2 4.44Å; W259-W292 PolarHBondContact NE1-O 3.01Å; A282-W292 CarbonylContact C-O 3.6Å; A282-W292 VanDerWaalsContact CA-O 3.26Å; A282-W292 WeakPolarHBondContact CA-O 3.19Å; E283-W292 HydrophobicContact CB-CB 4.26Å; E283-W292 PolarHBondContact N-O 2.6Å; E283-W292 PolarHBondContact O-N 3.3Å; R285-W292 HydrophobicContact CG-CD2 4.48Å; R285-W292 HydrophobicContact CG-CG 4.44Å; R285-W292 VanDerWaalsContact CZ-CE3 3.42Å; R285-W292 VanDerWaalsContact CZ-CH2 3.48Å; R285-W292 VanDerWaalsContact NH2-CZ3 3.35Å; Q290-W292 VanDerWaalsContact OE1-NE1 3.09Å; W292-I294 HydrophobicContact CB-CD1 4Å
293	L	97.3	Very high	94.6	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.9	171.2	-161.7	155.5	0	0	0	107.4	K249 F251 E262 F266 F279 T295	K249-L293 HydrophobicContact CB-CB 4.32Å; K249-L293 PolarHBondContact N-O 3.2Å; K249-L293 PolarHBondContact O-N 3.39Å; F251-L293 HydrophobicContact CE2-CB 4.09Å; E262-L293 HydrophobicContact CB-CD1 3.57Å; E262-L293 HydrophobicContact CG-CD1 4.5Å; F266-L293 HydrophobicContact CD2-CD1 4.01Å; F266-L293 HydrophobicContact CD2-CD2 4.16Å; F266-L293 HydrophobicContact CE2-CD1 4.3Å; F266-L293 HydrophobicContact CE2-CD2 4.12Å; F279-L293 HydrophobicContact CD2-CD2 3.77Å; F279-L293 HydrophobicContact CD2-CG 4.22Å; F279-L293 HydrophobicContact CE2-CD2 3.97Å; F279-L293 HydrophobicContact CE2-CG 3.9Å; L293-T295 HydrophobicContact CD2-CG2 3.36Å
294	I	97.6	Very high	94.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	123.1	-171.7	-57.2	95.3	0	0	0	109.1	I212 V246 A247 V248 L280 T281 E283 W292	I212-I294 HydrophobicContact CD1-CD1 4.39Å; I212-I294 HydrophobicContact CD1-CG1 3.75Å; I212-I294 HydrophobicContact CD1-CG2 4.23Å; V246-I294 HydrophobicContact CB-CG2 4.07Å; V246-I294 HydrophobicContact CG1-CG2 4.45Å; V246-I294 HydrophobicContact CG2-CG2 4.08Å; A247-I294 WeakPolarHBondContact O-CA 3.4Å; V248-I294 HydrophobicContact CG2-CG1 4.37Å; L280-I294 HydrophobicContact CB-CG2 4.32Å; L280-I294 WeakPolarHBondContact CB-O 3.29Å; L280-I294 HydrophobicContact CD2-CG2 4.32Å; L280-I294 PolarHBondContact N-O 3.16Å; T281-I294 HydrophobicContact CG2-CB 4.35Å; T281-I294 HydrophobicContact CG2-CD1 3.89Å; T281-I294 PolarHBondContact N-O 3.16Å; T281-I294 PolarHBondContact O-N 3.41Å; E283-I294 HydrophobicContact CB-CD1 4.3Å; E283-I294 HydrophobicContact CG-CD1 3.88Å; W292-I294 HydrophobicContact CB-CD1 4Å
295	T	97.1	Very high	94.9	Very high	9 Å²	9	50.3 Å²	50.3	6%	0.055	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	168.8	-176.3	63.6	0	0	0	0	111.8	A247 L277 H278 F279 L293	A247-T295 PolarHBondContact N-O 3.43Å; A247-T295 PolarHBondContact O-N 2.83Å; L277-T295 HydrophobicContact CD2-CG2 3.85Å; L277-T295 HydrophobicContact CG-CG2 4.12Å; H278-T295 CarbonylContact O-C 3.52Å; H278-T295 VanDerWaalsContact O-CA 3.25Å; H278-T295 WeakPolarHBondContact O-CA 3.44Å; H278-T295 VanDerWaalsContact O-CB 3.32Å; H278-T295 WeakPolarHBondContact O-CB 3.39Å; F279-T295 HydrophobicContact CD2-CG2 4.5Å; L293-T295 HydrophobicContact CD2-CG2 3.36Å
296	A	96.2	Very high	95.2	Very high	21 Å²	21	49.5 Å²	49.5	17%	0.174	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	141.9	170.4	0	0	0	0	0	110.8	H278 L280	H278-A296 HydrophobicContact CB-CB 3.86Å; H278-A296 PolarHBondContact O-N 3.16Å; L280-A296 VanDerWaalsContact CD1-N 3.32Å
297	Y	97.2	Very high	96	Very high	63 Å²	63	42.3 Å²	42.3	25%	0.247	23%	0.23	C	C	.	.			trans	-91.9	127.4	175.1	-179.4	-106.3	0	0	0	111.3	V218 K228 T245 A247 P299	V218-Y297 HydrophobicContact CG1-CE2 4.3Å; K228-Y297 HydrophobicContact CB-CD2 4.32Å; K228-Y297 HydrophobicContact CB-CE2 3.91Å; K228-Y297 HydrophobicContact CD-CE1 4.06Å; K228-Y297 HydrophobicContact CD-CE2 4.31Å; K228-Y297 HydrophobicContact CG-CD2 4.2Å; K228-Y297 HydrophobicContact CG-CE1 4.23Å; K228-Y297 HydrophobicContact CG-CE2 3.94Å; K228-Y297 HydrophobicContact CG-CG 4.48Å; T245-Y297 HydrophobicContact CG2-CD1 3.51Å; T245-Y297 HydrophobicContact CG2-CE1 4.21Å; T245-Y297 HydrophobicContact CG2-CG 3.84Å; A247-Y297 HydrophobicContact CB-CD2 4.23Å; Y297-P299 HydrophobicContact CD1-CB 4.5Å; Y297-P299 HydrophobicContact CE1-CB 3.9Å
298	H	96.9	Very high	96.6	Very high	36 Å²	36	41.3 Å²	41.3	17%	0.167	21%	0.206	C	C	.	.			trans	-107	112.4	173.6	-68.8	-60.9	0	0	0	110.2	L300 G301 L356 C364	H298-L300 VanDerWaalsContact C-N 3.29Å; H298-L300 PolarHBondContact O-N 2.96Å; H298-G301 PolarHBondContact O-N 3.19Å; H298-L356 HydrophobicContact CB-CB 4.26Å; H298-C364 VanDerWaalsContact CD2-SG 3.58Å; H298-C364 PolarHBondContact NE2-SG 3.15Å
299	P	95.8	Very high	97.2	Very high	63 Å²	63	41.8 Å²	41.8	41%	0.409	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.6	-170	28.3	-35.7	0	0	0	114.6	Y297 G301 K359	Y297-P299 HydrophobicContact CD1-CB 4.5Å; Y297-P299 HydrophobicContact CE1-CB 3.9Å; P299-G301 PolarHBondContact O-N 3.34Å; P299-K359 HydrophobicContact CG-CG 4.22Å
300	L	97.3	Very high	97.4	Very high	65 Å²	65	39.3 Å²	39.3	34%	0.34	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-2.8	175.5	-61.3	178.1	0	0	0	112.6	H298 F306 V357 K358 M361	H298-L300 VanDerWaalsContact C-N 3.29Å; H298-L300 PolarHBondContact O-N 2.96Å; L300-F306 HydrophobicContact CB-CD2 4.21Å; L300-F306 HydrophobicContact CB-CE2 4.48Å; L300-F306 HydrophobicContact CD1-CE2 4.29Å; L300-F306 HydrophobicContact CD2-CE2 4.42Å; L300-V357 HydrophobicContact CB-CB 3.93Å; L300-V357 HydrophobicContact CB-CG1 4.17Å; L300-V357 HydrophobicContact CD1-CB 4.47Å; L300-V357 HydrophobicContact CD1-CG1 3.81Å; L300-K358 WeakPolarHBondContact CD1-O 3.26Å; L300-M361 HydrophobicContact CD1-SD 4.42Å
301	G	97	Very high	97.6	Very high	21 Å²	21	42 Å²	42	22%	0.216	22%	0.221	C	C	.	.			trans	71.6	-157.3	174	0	0	0	0	0	113.4	H298 P299 L356 V357	H298-G301 PolarHBondContact O-N 3.19Å; P299-G301 PolarHBondContact O-N 3.34Å; G301-L356 WeakPolarHBondContact O-CA 3.2Å; G301-V357 PolarHBondContact O-N 3.31Å
302	N	98	Very high	97.6	Very high	23 Å²	23	41.4 Å²	41.4	12%	0.123	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-81.7	155.6	177.7	67.1	73.6	0	0	0	111.9	Q304 E305 F306 S353 I355 L356	N302-Q304 VanDerWaalsContact C-N 3.3Å; N302-Q304 PolarHBondContact O-N 3.32Å; N302-Q304 WeakPolarHBondContact OD1-CB 3.21Å; N302-Q304 PolarHBondContact OD1-N 3.42Å; N302-E305 PolarHBondContact ND2-OE1 3.33Å; N302-E305 PolarHBondContact O-N 3.23Å; N302-E305 PolarHBondContact OD1-N 2.85Å; N302-F306 WeakPolarHBondContact O-CB 3.43Å; N302-F306 PolarHBondContact O-N 3.07Å; N302-S353 WeakPolarHBondContact CB-O 3.46Å; N302-I355 CarbonylContact C-O 3.37Å; N302-I355 VanDerWaalsContact CA-O 3.22Å; N302-I355 WeakPolarHBondContact CA-O 3.36Å; N302-L356 HydrophobicContact CB-CD2 4.24Å
303	L	98.7	Very high	97.6	Very high	1 Å²	1	43 Å²	43	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-35.7	-175.4	179.7	65.9	0	0	0	111.8	F306 L307 L320 S352 I355 V357 V423 I427	L303-F306 PolarHBondContact O-N 3.4Å; L303-L307 HydrophobicContact CD1-CD1 3.91Å; L303-L307 HydrophobicContact CD1-CD2 4.17Å; L303-L307 HydrophobicContact CD1-CG 3.77Å; L303-L307 HydrophobicContact CD2-CD1 4.38Å; L303-L307 HydrophobicContact CG-CD1 3.78Å; L303-L307 HydrophobicContact CG-CG 4.06Å; L303-L307 VanDerWaalsContact O-CB 3.29Å; L303-L307 WeakPolarHBondContact O-CB 3.49Å; L303-L307 WeakPolarHBondContact O-CG 3.33Å; L303-L307 PolarHBondContact O-N 3.04Å; L303-L320 HydrophobicContact CD1-CD1 4.07Å; L303-L320 HydrophobicContact CD1-CD2 4.17Å; L303-S352 WeakPolarHBondContact CB-O 3.25Å; L303-S352 PolarHBondContact N-O 3.45Å; L303-I355 HydrophobicContact CB-CB 4.08Å; L303-I355 HydrophobicContact CB-CG2 4.09Å; L303-I355 HydrophobicContact CD2-CB 4.35Å; L303-I355 HydrophobicContact CD2-CD1 4.35Å; L303-I355 HydrophobicContact CD2-CG2 4.07Å; L303-I355 PolarHBondContact N-O 2.85Å; L303-V357 HydrophobicContact CB-CG2 4.18Å; L303-V357 HydrophobicContact CD1-CG2 3.86Å; L303-V423 HydrophobicContact CD2-CG1 3.64Å; L303-I427 HydrophobicContact CD1-CG1 4.48Å; L303-I427 HydrophobicContact CD2-CD1 3.99Å; L303-I427 HydrophobicContact CD2-CG1 3.95Å
304	Q	98	Very high	97.5	Very high	63 Å²	63	44.5 Å²	44.5	29%	0.294	24%	0.237	S	C	.	.	H	α-helix	trans	-60.2	-52.3	177.4	175.9	169.2	11.5	0	0	112	N302 F306 L307 T308 S352 Y440	N302-Q304 VanDerWaalsContact C-N 3.3Å; N302-Q304 PolarHBondContact O-N 3.32Å; N302-Q304 WeakPolarHBondContact OD1-CB 3.21Å; N302-Q304 PolarHBondContact OD1-N 3.42Å; Q304-F306 VanDerWaalsContact C-N 3.31Å; Q304-F306 PolarHBondContact O-N 2.96Å; Q304-L307 PolarHBondContact O-N 3.17Å; Q304-T308 WeakPolarHBondContact O-CB 3.49Å; Q304-T308 PolarHBondContact O-N 3.29Å; Q304-T308 PolarHBondContact O-OG1 2.92Å; Q304-S352 PolarHBondContact N-O 2.9Å; Q304-Y440 HydrophobicContact CG-CE1 3.92Å; Q304-Y440 WeakPolarHBondContact CG-OH 3.34Å
305	E	97.6	Very high	97.4	Very high	103 Å²	103	49.1 Å²	49.1	48%	0.481	26%	0.259	S	S	.	.	H	α-helix	trans	-64.1	-38.6	176.8	-75.5	171	-149.6	0	0	111.5	N302 T308 N309	N302-E305 PolarHBondContact ND2-OE1 3.33Å; N302-E305 PolarHBondContact O-N 3.23Å; N302-E305 PolarHBondContact OD1-N 2.85Å; E305-T308 PolarHBondContact O-N 3.34Å; E305-N309 PolarHBondContact O-N 3.49Å; E305-N309 PolarHBondContact O-ND2 3.07Å
306	F	98.6	Very high	97.4	Very high	14 Å²	14	50.5 Å²	50.5	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-51.7	176.5	-175.2	-93.9	0	0	0	111.4	L300 N302 L303 Q304 T308 N309 H310 I312 V357 M361	L300-F306 HydrophobicContact CB-CD2 4.21Å; L300-F306 HydrophobicContact CB-CE2 4.48Å; L300-F306 HydrophobicContact CD1-CE2 4.29Å; L300-F306 HydrophobicContact CD2-CE2 4.42Å; N302-F306 WeakPolarHBondContact O-CB 3.43Å; N302-F306 PolarHBondContact O-N 3.07Å; L303-F306 PolarHBondContact O-N 3.4Å; Q304-F306 VanDerWaalsContact C-N 3.31Å; Q304-F306 PolarHBondContact O-N 2.96Å; F306-T308 VanDerWaalsContact C-N 3.29Å; F306-T308 PolarHBondContact O-N 3.12Å; F306-N309 PolarHBondContact O-N 3.38Å; F306-N309 VanDerWaalsContact O-N 3.15Å; F306-H310 AromaticContact CD2-ND1 3.73Å; F306-H310 HydrophobicContact CE1-CB 4.21Å; F306-H310 AromaticContact CE2-CE1 3.99Å; F306-H310 AromaticContact CE2-ND1 3.81Å; F306-H310 HydrophobicContact CZ-CB 4.28Å; F306-H310 WeakPolarHBondContact O-CB 3.31Å; F306-H310 PolarHBondContact O-N 3.09Å; F306-H310 PolarHBondContact O-ND1 3.06Å; F306-I312 HydrophobicContact CE1-CG2 3.81Å; F306-V357 HydrophobicContact CB-CG2 3.88Å; F306-V357 HydrophobicContact CD1-CG2 4.17Å; F306-V357 HydrophobicContact CD2-CB 4.46Å; F306-V357 HydrophobicContact CD2-CG1 4.34Å; F306-V357 HydrophobicContact CD2-CG2 4.4Å; F306-V357 HydrophobicContact CE2-CG1 4.37Å; F306-V357 HydrophobicContact CG-CB 4.43Å; F306-V357 HydrophobicContact CG-CG1 4.46Å; F306-V357 HydrophobicContact CG-CG2 3.89Å; F306-M361 HydrophobicContact CE1-CE 3.78Å; F306-M361 HydrophobicContact CZ-CE 3.59Å; F306-M361 HydrophobicContact CZ-SD 3.93Å
307	L	98.6	Very high	97.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-28.6	179.3	-70.1	-179.2	0	0	0	113.2	L303 Q304 N309 H310 I312 E426 I427 R430 Y440	L303-L307 HydrophobicContact CD1-CD1 3.91Å; L303-L307 HydrophobicContact CD1-CD2 4.17Å; L303-L307 HydrophobicContact CD1-CG 3.77Å; L303-L307 HydrophobicContact CD2-CD1 4.38Å; L303-L307 HydrophobicContact CG-CD1 3.78Å; L303-L307 HydrophobicContact CG-CG 4.06Å; L303-L307 VanDerWaalsContact O-CB 3.29Å; L303-L307 WeakPolarHBondContact O-CB 3.49Å; L303-L307 WeakPolarHBondContact O-CG 3.33Å; L303-L307 PolarHBondContact O-N 3.04Å; Q304-L307 PolarHBondContact O-N 3.17Å; L307-N309 VanDerWaalsContact C-N 3.32Å; L307-H310 VanDerWaalsContact O-O 3.05Å; L307-I312 HydrophobicContact CD2-CD1 4.22Å; L307-I312 HydrophobicContact CD2-CG2 4.18Å; L307-E426 HydrophobicContact CD1-CB 4.02Å; L307-I427 HydrophobicContact CD1-CG1 4.19Å; L307-R430 HydrophobicContact CB-CG 4.11Å; L307-R430 HydrophobicContact CD2-CB 4.01Å; L307-R430 HydrophobicContact CD2-CG 4.32Å; L307-R430 PolarHBondContact O-NE 3.22Å; L307-Y440 HydrophobicContact CB-CD2 3.88Å; L307-Y440 HydrophobicContact CB-CE2 4.11Å; L307-Y440 HydrophobicContact CD1-CE2 4.45Å
308	T	98.1	Very high	97.4	Very high	68 Å²	68	47.6 Å²	47.6	42%	0.417	25%	0.25	S	S	.	.	H	α-helix	trans	-63	-41.7	172.3	-59.3	0	0	0	0	111.2	Q304 E305 F306 Y440	Q304-T308 WeakPolarHBondContact O-CB 3.49Å; Q304-T308 PolarHBondContact O-N 3.29Å; Q304-T308 PolarHBondContact O-OG1 2.92Å; E305-T308 PolarHBondContact O-N 3.34Å; F306-T308 VanDerWaalsContact C-N 3.29Å; F306-T308 PolarHBondContact O-N 3.12Å; T308-Y440 WeakPolarHBondContact OG1-CD1 3.4Å
309	N	97.8	Very high	97.4	Very high	119 Å²	119	47.6 Å²	47.6	64%	0.636	25%	0.251	S	S	*	.	H	α-helix	trans	-95.2	-11.9	-172.6	-66.2	-56.7	0	0	0	114.2	E305 F306 L307	E305-N309 PolarHBondContact O-N 3.49Å; E305-N309 PolarHBondContact O-ND2 3.07Å; F306-N309 PolarHBondContact O-N 3.38Å; F306-N309 VanDerWaalsContact O-N 3.15Å; L307-N309 VanDerWaalsContact C-N 3.32Å
310	H	98.1	Very high	97.6	Very high	89 Å²	89	44.6 Å²	44.6	41%	0.412	23%	0.231	S	C	.	.			trans	-129.1	147.4	-173.8	-57.2	83.9	0	0	0	112.1	F306 L307 R430	F306-H310 AromaticContact CD2-ND1 3.73Å; F306-H310 HydrophobicContact CE1-CB 4.21Å; F306-H310 AromaticContact CE2-CE1 3.99Å; F306-H310 AromaticContact CE2-ND1 3.81Å; F306-H310 HydrophobicContact CZ-CB 4.28Å; F306-H310 WeakPolarHBondContact O-CB 3.31Å; F306-H310 PolarHBondContact O-N 3.09Å; F306-H310 PolarHBondContact O-ND1 3.06Å; L307-H310 VanDerWaalsContact O-O 3.05Å; H310-R430 PolarHBondContact O-NE 2.03Å; H310-R430 PolarHBondContact O-NH2 3.01Å
311	I	98.4	Very high	97.6	Very high	99 Å²	99	41.5 Å²	41.5	51%	0.508	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-101	130	159.9	-63.3	174.8	0	0	0	105.3	R430 V437	I311-R430 CarbonylContact C-O 3.56Å; I311-R430 WeakPolarHBondContact CA-O 3.49Å; I311-R430 VanDerWaalsContact CG1-NH2 3.28Å; I311-R430 WeakPolarHBondContact CG2-O 3.49Å; I311-V437 HydrophobicContact CD1-CB 4.22Å; I311-V437 HydrophobicContact CD1-CG1 4.46Å; I311-V437 HydrophobicContact CG1-CG1 4.26Å; I311-V437 HydrophobicContact CG2-CB 4.44Å; I311-V437 HydrophobicContact CG2-CG1 4.38Å; I311-V437 HydrophobicContact CG2-CG2 4.01Å
312	I	98.2	Very high	97.6	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.015	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-101	156.4	-173.2	67.2	173.1	0	0	0	111.3	F306 L307 D316 L317 L320 I427 R430 C431 S432	F306-I312 HydrophobicContact CE1-CG2 3.81Å; L307-I312 HydrophobicContact CD2-CD1 4.22Å; L307-I312 HydrophobicContact CD2-CG2 4.18Å; I312-D316 HydrophobicContact CB-CB 3.85Å; I312-L317 HydrophobicContact CD1-CB 3.96Å; I312-L320 HydrophobicContact CD1-CD1 4.08Å; I312-I427 HydrophobicContact CD1-CG2 3.56Å; I312-R430 WeakPolarHBondContact CG1-O 3.34Å; I312-R430 PolarHBondContact N-O 3.24Å; I312-C431 HydrophobicContact CG1-CB 4.16Å; I312-C431 WeakPolarHBondContact O-CA 3.49Å; I312-S432 PolarHBondContact O-N 3.23Å; I312-S432 PolarHBondContact O-OG 2.92Å
313	S	97.3	Very high	97.7	Very high	42 Å²	42	39.4 Å²	39.4	29%	0.294	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-79.9	169.7	171.5	69.5	0	0	0	0	111.6	Q315 D316 L317	S313-Q315 VanDerWaalsContact C-N 3.27Å; S313-Q315 PolarHBondContact O-N 3.48Å; S313-Q315 PolarHBondContact OG-N 2.89Å; S313-D316 WeakPolarHBondContact CB-OD2 3.42Å; S313-D316 PolarHBondContact N-OD2 2.97Å; S313-D316 PolarHBondContact O-N 3.37Å; S313-D316 PolarHBondContact OG-N 3.44Å; S313-D316 VanDerWaalsContact OG-N 3.14Å; S313-D316 PolarHBondContact OG-OD2 2.92Å; S313-L317 PolarHBondContact O-N 2.71Å
314	W	94.9	Very high	97.7	Very high	32 Å²	32	39.4 Å²	39.4	12%	0.121	20%	0.199	C	C	.	.	H	α-helix	trans	-56.5	-43.1	168.9	170.2	-114.4	0	0	0	112	D316 L317 W318 A433 H476 G478 I479 V482 V510 D514	W314-D316 VanDerWaalsContact C-N 3.34Å; W314-D316 PolarHBondContact O-N 3.23Å; W314-L317 HydrophobicContact CE3-CD1 4.27Å; W314-L317 HydrophobicContact CE3-CD2 4.05Å; W314-L317 HydrophobicContact CH2-CD2 4.24Å; W314-L317 HydrophobicContact CZ3-CD1 4.24Å; W314-L317 HydrophobicContact CZ3-CD2 3.62Å; W314-L317 WeakPolarHBondContact O-CB 3.44Å; W314-L317 PolarHBondContact O-N 2.85Å; W314-W318 PolarHBondContact O-N 3.22Å; W314-A433 HydrophobicContact CB-CB 4.18Å; W314-H476 AromaticContact CD2-CE1 3.51Å; W314-H476 AromaticContact CE2-CE1 3.53Å; W314-H476 AromaticContact CE3-CE1 3.86Å; W314-H476 AromaticContact CE3-ND1 3.99Å; W314-H476 AromaticContact CG-CE1 3.94Å; W314-H476 AromaticContact CZ2-CE1 3.92Å; W314-H476 AromaticContact NE1-CE1 3.87Å; W314-G478 WeakPolarHBondContact CH2-O 3.4Å; W314-I479 HydrophobicContact CE3-CG1 3.79Å; W314-I479 HydrophobicContact CZ3-CB 4.43Å; W314-I479 HydrophobicContact CZ3-CG1 3.57Å; W314-V482 HydrophobicContact CH2-CG2 4.38Å; W314-V510 HydrophobicContact CH2-CG1 4.42Å; W314-V510 HydrophobicContact CZ2-CG1 3.7Å; W314-D514 PolarHBondContact NE1-OD2 2.04Å
315	Q	95.2	Very high	97.7	Very high	97 Å²	97	36.4 Å²	36.4	45%	0.453	19%	0.185	S	C	.	.	H	α-helix	trans	-61.4	-42.7	178.3	-175.6	60.7	35.3	0	0	112	S313 W318 L319	S313-Q315 VanDerWaalsContact C-N 3.27Å; S313-Q315 PolarHBondContact O-N 3.48Å; S313-Q315 PolarHBondContact OG-N 2.89Å; Q315-W318 PolarHBondContact O-N 2.9Å; Q315-L319 HydrophobicContact CG-CD1 4.28Å; Q315-L319 WeakPolarHBondContact O-CG 3.47Å; Q315-L319 PolarHBondContact O-N 3.49Å
316	D	97.6	Very high	97.7	Very high	38 Å²	38	34.1 Å²	34.1	20%	0.203	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-40.9	177.9	-61.6	-42.5	0	0	0	111.4	I312 S313 W314 W318 L319 L320 M361	I312-D316 HydrophobicContact CB-CB 3.85Å; S313-D316 WeakPolarHBondContact CB-OD2 3.42Å; S313-D316 PolarHBondContact N-OD2 2.97Å; S313-D316 PolarHBondContact O-N 3.37Å; S313-D316 PolarHBondContact OG-N 3.44Å; S313-D316 VanDerWaalsContact OG-N 3.14Å; S313-D316 PolarHBondContact OG-OD2 2.92Å; W314-D316 VanDerWaalsContact C-N 3.34Å; W314-D316 PolarHBondContact O-N 3.23Å; D316-W318 VanDerWaalsContact C-N 3.3Å; D316-W318 PolarHBondContact O-N 2.91Å; D316-L319 PolarHBondContact O-N 3.49Å; D316-L320 WeakPolarHBondContact O-CB 3.37Å; D316-L320 VanDerWaalsContact O-CG 3.23Å; D316-L320 WeakPolarHBondContact O-CG 3.33Å; D316-L320 PolarHBondContact O-N 3.5Å; D316-M361 HydrophobicContact CB-CE 3.73Å
317	L	97.6	Very high	97.7	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-57.6	-46	173.3	172.7	162.9	0	0	0	110.6	I312 S313 W314 G321 I427 I428 C431 V482 F507	I312-L317 HydrophobicContact CD1-CB 3.96Å; S313-L317 PolarHBondContact O-N 2.71Å; W314-L317 HydrophobicContact CE3-CD1 4.27Å; W314-L317 HydrophobicContact CE3-CD2 4.05Å; W314-L317 HydrophobicContact CH2-CD2 4.24Å; W314-L317 HydrophobicContact CZ3-CD1 4.24Å; W314-L317 HydrophobicContact CZ3-CD2 3.62Å; W314-L317 WeakPolarHBondContact O-CB 3.44Å; W314-L317 PolarHBondContact O-N 2.85Å; L317-G321 WeakPolarHBondContact O-CA 3.29Å; L317-G321 PolarHBondContact O-N 3.12Å; L317-I427 HydrophobicContact CB-CG2 4.07Å; L317-I427 HydrophobicContact CG-CG2 3.84Å; L317-I428 HydrophobicContact CD1-CB 4.36Å; L317-I428 HydrophobicContact CD1-CG1 3.88Å; L317-C431 HydrophobicContact CB-CB 4.48Å; L317-C431 HydrophobicContact CD1-CB 3.61Å; L317-V482 HydrophobicContact CD2-CG2 4.47Å; L317-F507 HydrophobicContact CD2-CE1 4.45Å
318	W	95.6	Very high	97.7	Very high	22 Å²	22	33.5 Å²	33.5	8%	0.083	17%	0.169	C	C	.	.	H	α-helix	trans	-62.8	-45.6	178.5	-180	88.5	0	0	0	111.5	W314 Q315 D316 S322 F507 E511	W314-W318 PolarHBondContact O-N 3.22Å; Q315-W318 PolarHBondContact O-N 2.9Å; D316-W318 VanDerWaalsContact C-N 3.3Å; D316-W318 PolarHBondContact O-N 2.91Å; W318-S322 WeakPolarHBondContact O-CB 3.37Å; W318-S322 PolarHBondContact O-N 3.46Å; W318-S322 PolarHBondContact O-OG 2.97Å; W318-F507 AromaticContact CD1-CD1 3.89Å; W318-F507 PolarHBondContact NE1-O 3.02Å; W318-E511 HydrophobicContact CH2-CB 4.43Å; W318-E511 HydrophobicContact CH2-CG 4Å; W318-E511 WeakPolarHBondContact CH2-OE2 3.33Å; W318-E511 HydrophobicContact CZ2-CB 3.62Å; W318-E511 HydrophobicContact CZ2-CG 3.69Å; W318-E511 VanDerWaalsContact CZ2-OE2 3.27Å; W318-E511 WeakPolarHBondContact CZ2-OE2 3.47Å
319	L	97.6	Very high	97.7	Very high	35 Å²	35	31 Å²	31	18%	0.183	16%	0.155	C	C	.	.	H	α-helix	trans	-62.2	-46.2	178.1	-73	169.1	0	0	0	112.1	Q315 D316 S322 S323 M361 T362	Q315-L319 HydrophobicContact CG-CD1 4.28Å; Q315-L319 WeakPolarHBondContact O-CG 3.47Å; Q315-L319 PolarHBondContact O-N 3.49Å; D316-L319 PolarHBondContact O-N 3.49Å; L319-S322 PolarHBondContact O-OG 3.44Å; L319-S323 VanDerWaalsContact O-CB 3.27Å; L319-S323 WeakPolarHBondContact O-CB 3.4Å; L319-S323 PolarHBondContact O-N 3.34Å; L319-S323 PolarHBondContact O-OG 2.85Å; L319-M361 HydrophobicContact CB-CB 4.44Å; L319-M361 WeakPolarHBondContact CB-O 3.42Å; L319-M361 HydrophobicContact CD1-CB 3.83Å; L319-T362 HydrophobicContact CD2-CG2 4.18Å
320	L	98.6	Very high	97.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67.2	-47.4	178.5	-69.2	169.5	0	0	0	111.6	L303 I312 D316 S323 L324 V357 M361 C363 I427	L303-L320 HydrophobicContact CD1-CD1 4.07Å; L303-L320 HydrophobicContact CD1-CD2 4.17Å; I312-L320 HydrophobicContact CD1-CD1 4.08Å; D316-L320 WeakPolarHBondContact O-CB 3.37Å; D316-L320 VanDerWaalsContact O-CG 3.23Å; D316-L320 WeakPolarHBondContact O-CG 3.33Å; D316-L320 PolarHBondContact O-N 3.5Å; L320-S323 PolarHBondContact O-OG 2.81Å; L320-L324 VanDerWaalsContact O-CB 3.31Å; L320-L324 WeakPolarHBondContact O-CB 3.24Å; L320-L324 PolarHBondContact O-N 3.15Å; L320-V357 HydrophobicContact CD2-CG1 4.15Å; L320-V357 HydrophobicContact CD2-CG2 4.31Å; L320-M361 HydrophobicContact CD1-CE 4.44Å; L320-M361 VanDerWaalsContact CD2-O 3.27Å; L320-M361 WeakPolarHBondContact CD2-O 3.4Å; L320-M361 WeakPolarHBondContact CG-O 3.45Å; L320-C363 HydrophobicContact CD2-CB 4.14Å; L320-I427 HydrophobicContact CB-CD1 4.04Å; L320-I427 HydrophobicContact CB-CG2 4.33Å; L320-I427 HydrophobicContact CD1-CG2 4.44Å
321	G	98.3	Very high	97.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66.9	-46.7	-177.7	0	0	0	0	0	113	L317 L324 A325	L317-G321 WeakPolarHBondContact O-CA 3.29Å; L317-G321 PolarHBondContact O-N 3.12Å; G321-L324 PolarHBondContact O-N 3.46Å; G321-A325 PolarHBondContact O-N 3.46Å
322	S	97.8	Very high	97.7	Very high	1 Å²	1	18 Å²	18	1%	0.007	9%	0.089	C	C	.	.	H	α-helix	trans	-66.2	-42.5	179.5	64.6	0	0	0	0	112.1	W318 L319 L324 A325 R326	W318-S322 WeakPolarHBondContact O-CB 3.37Å; W318-S322 PolarHBondContact O-N 3.46Å; W318-S322 PolarHBondContact O-OG 2.97Å; L319-S322 PolarHBondContact O-OG 3.44Å; S322-L324 VanDerWaalsContact C-N 3.35Å; S322-L324 PolarHBondContact O-N 3.5Å; S322-A325 PolarHBondContact O-N 3.08Å; S322-R326 WeakPolarHBondContact O-CB 3.31Å; S322-R326 WeakPolarHBondContact O-CG 3.25Å; S322-R326 PolarHBondContact O-N 3.09Å; S322-R326 PolarHBondContact OG-NH2 3.23Å
323	S	98.6	Very high	97.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-67.4	-33.9	177	56.7	0	0	0	0	113.1	N275 L319 L320 V327 C363	N275-S323 WeakPolarHBondContact ND2-CB 3.37Å; L319-S323 VanDerWaalsContact O-CB 3.27Å; L319-S323 WeakPolarHBondContact O-CB 3.4Å; L319-S323 PolarHBondContact O-N 3.34Å; L319-S323 PolarHBondContact O-OG 2.85Å; L320-S323 PolarHBondContact O-OG 2.81Å; S323-V327 PolarHBondContact O-N 2.91Å; S323-C363 PolarHBondContact OG-N 3.49Å; S323-C363 PolarHBondContact OG-SG 2.93Å
324	L	98.8	Very high	97.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.8	-49.6	171	178.4	58.2	0	0	0	111.2	L320 G321 S322 R326 V327 V328 I355 C363 M420 V423 L424	L320-L324 VanDerWaalsContact O-CB 3.31Å; L320-L324 WeakPolarHBondContact O-CB 3.24Å; L320-L324 PolarHBondContact O-N 3.15Å; G321-L324 PolarHBondContact O-N 3.46Å; S322-L324 VanDerWaalsContact C-N 3.35Å; S322-L324 PolarHBondContact O-N 3.5Å; L324-R326 VanDerWaalsContact C-N 3.32Å; L324-R326 PolarHBondContact O-N 2.91Å; L324-V327 HydrophobicContact CD1-CG1 4.3Å; L324-V327 WeakPolarHBondContact O-CG1 3.16Å; L324-V327 PolarHBondContact O-N 3.32Å; L324-V328 HydrophobicContact CD1-CG2 4.2Å; L324-V328 WeakPolarHBondContact O-CG2 3.4Å; L324-V328 PolarHBondContact O-N 3.42Å; L324-V328 VanDerWaalsContact O-N 3.12Å; L324-I355 HydrophobicContact CD1-CD1 3.62Å; L324-I355 HydrophobicContact CD1-CG1 4.24Å; L324-I355 HydrophobicContact CD2-CD1 4.12Å; L324-C363 PolarHBondContact N-SG 3.42Å; L324-M420 HydrophobicContact CD2-CG 3.89Å; L324-M420 HydrophobicContact CG-CG 3.93Å; L324-M420 HydrophobicContact CG-SD 4.14Å; L324-V423 HydrophobicContact CD2-CB 4Å; L324-V423 HydrophobicContact CD2-CG1 3.61Å; L324-L424 HydrophobicContact CD2-CD2 4.26Å; L324-L424 HydrophobicContact CD2-CG 4.47Å
325	A	98.6	Very high	97.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-43	178.5	0	0	0	0	0	111.8	G321 S322 V328 A329 I503 A504 F507	G321-A325 PolarHBondContact O-N 3.46Å; S322-A325 PolarHBondContact O-N 3.08Å; A325-V328 PolarHBondContact O-N 2.99Å; A325-A329 VanDerWaalsContact O-CB 3.29Å; A325-A329 WeakPolarHBondContact O-CB 3.43Å; A325-A329 PolarHBondContact O-N 2.87Å; A325-I503 HydrophobicContact CB-CB 4.33Å; A325-I503 HydrophobicContact CB-CG2 3.87Å; A325-A504 HydrophobicContact CB-CB 4.03Å; A325-F507 HydrophobicContact CB-CD2 4.22Å
326	R	98.4	Very high	97.1	Very high	56 Å²	56	23.1 Å²	23.1	21%	0.211	11%	0.113	C	C	.	.	H	α-helix	trans	-60.8	-45.2	176.7	-80	-175.6	-99.5	128.3	-4.9	113	E274 S322 L324 A329 H330 A504	E274-R326 IonicContact OE1-NH1 3.75Å; E274-R326 PolarHBondContact OE1-NH1 3.49Å; S322-R326 WeakPolarHBondContact O-CB 3.31Å; S322-R326 WeakPolarHBondContact O-CG 3.25Å; S322-R326 PolarHBondContact O-N 3.09Å; S322-R326 PolarHBondContact OG-NH2 3.23Å; L324-R326 VanDerWaalsContact C-N 3.32Å; L324-R326 PolarHBondContact O-N 2.91Å; R326-A329 PolarHBondContact O-N 2.96Å; R326-H330 WeakPolarHBondContact O-CB 3.36Å; R326-H330 PolarHBondContact O-N 3.18Å; R326-A504 HydrophobicContact CG-CB 4.22Å
327	V	98.4	Very high	96.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.1	-43.3	177.5	61.5	0	0	0	0	111.8	N275 V276 S323 L324 A329 H330 L331 L365	N275-V327 HydrophobicContact CB-CB 3.73Å; N275-V327 HydrophobicContact CB-CG1 4.37Å; N275-V327 HydrophobicContact CB-CG2 4.46Å; N275-V327 WeakPolarHBondContact O-CB 3.3Å; N275-V327 VanDerWaalsContact O-CG2 3.23Å; N275-V327 WeakPolarHBondContact O-CG2 3.48Å; V276-V327 HydrophobicContact CG2-CG2 3.57Å; S323-V327 PolarHBondContact O-N 2.91Å; L324-V327 HydrophobicContact CD1-CG1 4.3Å; L324-V327 WeakPolarHBondContact O-CG1 3.16Å; L324-V327 PolarHBondContact O-N 3.32Å; V327-A329 VanDerWaalsContact C-N 3.35Å; V327-A329 PolarHBondContact O-N 2.75Å; V327-H330 WeakPolarHBondContact O-CB 3.37Å; V327-H330 PolarHBondContact O-N 2.98Å; V327-L331 HydrophobicContact CG2-CG 4.37Å; V327-L331 WeakPolarHBondContact O-CG 3.45Å; V327-L331 PolarHBondContact O-N 3.45Å; V327-L365 HydrophobicContact CG1-CB 4.08Å; V327-L365 HydrophobicContact CG2-CB 3.92Å
328	V	98.7	Very high	96	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.9	-41.3	-179.7	-178	0	0	0	0	110.4	L324 A325 H330 L331 H332 I350 M420 A500	L324-V328 HydrophobicContact CD1-CG2 4.2Å; L324-V328 WeakPolarHBondContact O-CG2 3.4Å; L324-V328 PolarHBondContact O-N 3.42Å; L324-V328 VanDerWaalsContact O-N 3.12Å; A325-V328 PolarHBondContact O-N 2.99Å; V328-H330 VanDerWaalsContact C-N 3.34Å; V328-H330 PolarHBondContact O-N 2.85Å; V328-L331 PolarHBondContact O-N 3.18Å; V328-H332 VanDerWaalsContact CG1-CE1 3.42Å; V328-H332 WeakPolarHBondContact CG1-CE1 3.12Å; V328-H332 WeakPolarHBondContact O-CB 3.44Å; V328-H332 PolarHBondContact O-CD2 3.3Å; V328-H332 VanDerWaalsContact O-CG 3.27Å; V328-H332 PolarHBondContact O-N 2.86Å; V328-I350 HydrophobicContact CG1-CD1 4.23Å; V328-I350 HydrophobicContact CG2-CD1 3.8Å; V328-M420 HydrophobicContact CB-SD 3.8Å; V328-M420 HydrophobicContact CG1-SD 4.21Å; V328-M420 HydrophobicContact CG2-SD 3.64Å; V328-A500 HydrophobicContact CB-CB 3.86Å; V328-A500 HydrophobicContact CG1-CB 3.57Å
329	A	98.3	Very high	95.7	Very high	15 Å²	15	32.4 Å²	32.4	12%	0.124	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-43.7	173	0	0	0	0	0	112.1	A325 R326 V327 L331 H332 S333 A500 H501	A325-A329 VanDerWaalsContact O-CB 3.29Å; A325-A329 WeakPolarHBondContact O-CB 3.43Å; A325-A329 PolarHBondContact O-N 2.87Å; R326-A329 PolarHBondContact O-N 2.96Å; V327-A329 VanDerWaalsContact C-N 3.35Å; V327-A329 PolarHBondContact O-N 2.75Å; A329-L331 PolarHBondContact O-N 3.39Å; A329-H332 PolarHBondContact O-N 2.65Å; A329-S333 WeakPolarHBondContact O-CB 3.34Å; A329-S333 PolarHBondContact O-N 2.78Å; A329-A500 HydrophobicContact CB-CB 4.08Å; A329-H501 HydrophobicContact CB-CB 4.3Å
330	H	97.7	Very high	95.4	Very high	18 Å²	18	37.5 Å²	37.5	8%	0.083	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-43.8	175.4	173.5	74.2	0	0	0	111.9	D270 L271 H273 R326 V327 V328 S333 K342	D270-H330 PolarHBondContact O-CE1 2.92Å; D270-H330 PolarHBondContact O-NE2 2.86Å; L271-H330 PolarHBondContact O-NE2 2.85Å; H273-H330 AromaticContact CD2-CG 3.74Å; H273-H330 AromaticContact CD2-ND1 3.84Å; H273-H330 AromaticContact CG-CD2 3.9Å; H273-H330 AromaticContact CG-CG 3.87Å; R326-H330 WeakPolarHBondContact O-CB 3.36Å; R326-H330 PolarHBondContact O-N 3.18Å; V327-H330 WeakPolarHBondContact O-CB 3.37Å; V327-H330 PolarHBondContact O-N 2.98Å; V328-H330 VanDerWaalsContact C-N 3.34Å; V328-H330 PolarHBondContact O-N 2.85Å; H330-S333 PolarHBondContact O-N 2.74Å; H330-K342 PolarHBondContact O-NZ 3.33Å
331	L	97.8	Very high	95	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.1	-45.7	176.3	-67.4	-176	0	0	0	111.9	L271 V276 V327 V328 A329 S333 K342 I345 H347 L365 F368	L271-L331 HydrophobicContact CD1-CD2 3.26Å; V276-L331 HydrophobicContact CG2-CD2 4.43Å; V327-L331 HydrophobicContact CG2-CG 4.37Å; V327-L331 WeakPolarHBondContact O-CG 3.45Å; V327-L331 PolarHBondContact O-N 3.45Å; V328-L331 PolarHBondContact O-N 3.18Å; A329-L331 PolarHBondContact O-N 3.39Å; L331-S333 VanDerWaalsContact C-N 3.31Å; L331-S333 PolarHBondContact O-N 3.4Å; L331-K342 PolarHBondContact O-NZ 3.05Å; L331-I345 CarbonylContact C-O 3.54Å; L331-I345 PolarHBondContact O-N 3.44Å; L331-H347 HydrophobicContact CD1-CB 4.28Å; L331-L365 HydrophobicContact CD1-CD2 3.61Å; L331-F368 HydrophobicContact CD1-CE1 3.96Å; L331-F368 HydrophobicContact CD2-CE1 3.92Å; L331-F368 HydrophobicContact CD2-CZ 4.42Å
332	H	97.3	Very high	94.8	Very high	18 Å²	18	42.8 Å²	42.8	8%	0.083	24%	0.24	C	C	.	.	H	α-helix	trans	-74.6	-18.4	-176.2	-68.4	-176.3	0	0	0	114	V328 A329 I345 K413 D416	V328-H332 VanDerWaalsContact CG1-CE1 3.42Å; V328-H332 WeakPolarHBondContact CG1-CE1 3.12Å; V328-H332 WeakPolarHBondContact O-CB 3.44Å; V328-H332 PolarHBondContact O-CD2 3.3Å; V328-H332 VanDerWaalsContact O-CG 3.27Å; V328-H332 PolarHBondContact O-N 2.86Å; A329-H332 PolarHBondContact O-N 2.65Å; H332-I345 PolarHBondContact CD2-O 3.27Å; H332-K413 HydrophobicContact CB-CD 3.94Å; H332-K413 HydrophobicContact CB-CG 4.21Å; H332-K413 PolarHBondContact CE1-O 3.17Å; H332-K413 WeakPolarHBondContact O-CE 3.32Å; H332-K413 PolarHBondContact O-NZ 3.2Å; H332-D416 IonicContact CD2-OD2 2.69Å; H332-D416 IonicContact CE1-OD2 2.69Å; H332-D416 WeakPolarHBondContact NE2-CB 3.13Å; H332-D416 IonicContact NE2-OD2 3.98Å; H332-D416 PolarHBondContact NE2-OD2 3.18Å
333	S	95.9	Very high	94.6	Very high	42 Å²	42	45.2 Å²	45.2	29%	0.294	26%	0.255	S	S	.	.			trans	-68.8	139.2	179.4	-168.1	0	0	0	0	112.5	A329 H330 L331 R335 K342	A329-S333 WeakPolarHBondContact O-CB 3.34Å; A329-S333 PolarHBondContact O-N 2.78Å; H330-S333 PolarHBondContact O-N 2.74Å; L331-S333 VanDerWaalsContact C-N 3.31Å; L331-S333 PolarHBondContact O-N 3.4Å; S333-R335 WeakPolarHBondContact CB-O 3.18Å; S333-R335 PolarHBondContact OG-N 3.43Å; S333-R335 VanDerWaalsContact OG-N 3.15Å; S333-R335 PolarHBondContact OG-O 3.36Å; S333-K342 PolarHBondContact O-NZ 2.87Å
334	D	94.4	Very high	94.4	Very high	94 Å²	94	46.1 Å²	46.1	50%	0.503	26%	0.261	S	S	.	.	S	Bend	trans	-85.4	5.2	170.1	70.2	-19.5	0	0	0	112.4	C341 K342 P344	D334-C341 CarbonylContact O-C 3.38Å; D334-C341 WeakPolarHBondContact O-CA 3.05Å; D334-K342 CarbonylContact C-O 3.49Å; D334-K342 VanDerWaalsContact C-O 3.31Å; D334-K342 VanDerWaalsContact CA-O 3.22Å; D334-K342 WeakPolarHBondContact CA-O 3.29Å; D334-K342 PolarHBondContact O-N 2.79Å; D334-K342 VanDerWaalsContact O-O 3.08Å; D334-P344 HydrophobicContact CB-CG 3.94Å
335	R	92.9	Very high	94.3	Very high	129 Å²	129	46.1 Å²	46.1	49%	0.487	26%	0.261	S	S	.	.	B	Isolated β-bridge	trans	-135.9	148.3	-179.8	-70	178.3	176.7	-84.2	-1.9	111.5	S333 G339 R340	S333-R335 WeakPolarHBondContact CB-O 3.18Å; S333-R335 PolarHBondContact OG-N 3.43Å; S333-R335 VanDerWaalsContact OG-N 3.15Å; S333-R335 PolarHBondContact OG-O 3.36Å; R335-G339 PolarHBondContact NH1-O 3.35Å; R335-R340 CarbonylContact C-O 3.6Å; R335-R340 VanDerWaalsContact CA-O 3.26Å; R335-R340 WeakPolarHBondContact CA-O 3.39Å
336	T	90.6	Very high	94.1	Very high	16 Å²	16	46.1 Å²	46.1	10%	0.098	26%	0.261	C	S	.	.			trans	-80.1	163.6	165.4	60.8	0	0	0	0	110.4	D270 C338 G339 R340 K342	D270-T336 HydrophobicContact CB-CG2 3.75Å; D270-T336 WeakPolarHBondContact OD1-CG2 3.44Å; T336-C338 PolarHBondContact O-N 3.28Å; T336-C338 PolarHBondContact OG1-SG 3.45Å; T336-G339 WeakPolarHBondContact O-CA 3.26Å; T336-G339 PolarHBondContact O-N 3.43Å; T336-R340 HydrophobicContact CG2-CB 4.44Å; T336-R340 PolarHBondContact N-O 3.15Å; T336-R340 WeakPolarHBondContact OG1-CB 3.38Å; T336-R340 PolarHBondContact OG1-N 3.34Å; T336-R340 VanDerWaalsContact OG1-N 3.11Å; T336-R340 PolarHBondContact OG1-O 3.22Å; T336-K342 HydrophobicContact CG2-CB 4.1Å; T336-K342 HydrophobicContact CG2-CD 4.49Å
337	S	84.6	Confident	94.1	Very high	123 Å²	123	43.5 Å²	43.5	86%	0.86	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-23.6	176	-42.1	0	0	0	0	113.6	G339	S337-G339 VanDerWaalsContact C-N 3.35Å
338	C	88.1	Confident	93.9	Very high	95 Å²	95	45.2 Å²	45.2	64%	0.642	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	7.1	174.8	69.8	0	0	0	0	114.1	T336	T336-C338 PolarHBondContact O-N 3.28Å; T336-C338 PolarHBondContact OG1-SG 3.45Å
339	G	88.8	Confident	93.8	Very high	38 Å²	38	45.9 Å²	45.9	39%	0.392	26%	0.261	S	S	.	.	S	Bend	trans	86.5	-0.2	173.7	0	0	0	0	0	115.9	R335 T336 S337	R335-G339 PolarHBondContact NH1-O 3.35Å; T336-G339 WeakPolarHBondContact O-CA 3.26Å; T336-G339 PolarHBondContact O-N 3.43Å; S337-G339 VanDerWaalsContact C-N 3.35Å
340	R	91.3	Very high	93.9	Very high	142 Å²	142	45.1 Å²	45.1	54%	0.536	26%	0.255	S	S	.	.			trans	-68.9	145	173.6	-57.4	-175.9	-57.8	-171.3	4.8	110.7	D270 R335 T336	D270-R340 IonicContact OD1-CZ 3.88Å; D270-R340 IonicContact OD1-NE 3.73Å; D270-R340 IonicContact OD1-NH2 2.99Å; D270-R340 PolarHBondContact OD1-NH2 3.08Å; R335-R340 CarbonylContact C-O 3.6Å; R335-R340 VanDerWaalsContact CA-O 3.26Å; R335-R340 WeakPolarHBondContact CA-O 3.39Å; T336-R340 HydrophobicContact CG2-CB 4.44Å; T336-R340 PolarHBondContact N-O 3.15Å; T336-R340 WeakPolarHBondContact OG1-CB 3.38Å; T336-R340 PolarHBondContact OG1-N 3.34Å; T336-R340 VanDerWaalsContact OG1-N 3.11Å; T336-R340 PolarHBondContact OG1-O 3.22Å
341	C	90.9	Very high	93.9	Very high	100 Å²	100	45.7 Å²	45.7	68%	0.676	26%	0.257	S	S	*	.	B	Isolated β-bridge	trans	-62	139.2	173.1	-56.1	0	0	0	0	110.5	D334	D334-C341 CarbonylContact O-C 3.38Å; D334-C341 WeakPolarHBondContact O-CA 3.05Å
342	K	93	Very high	93.9	Very high	12 Å²	12	45.7 Å²	45.7	5%	0.052	26%	0.257	C	S	.	.			trans	-133.7	145.8	177.6	164.5	175.3	164.9	-81.2	0	107.8	D270 H330 L331 S333 D334 T336 P344	D270-K342 HydrophobicContact CB-CB 4.3Å; D270-K342 HydrophobicContact CB-CD 4.18Å; D270-K342 HydrophobicContact CB-CG 4.17Å; D270-K342 WeakPolarHBondContact O-CD 3.16Å; H330-K342 PolarHBondContact O-NZ 3.33Å; L331-K342 PolarHBondContact O-NZ 3.05Å; S333-K342 PolarHBondContact O-NZ 2.87Å; D334-K342 CarbonylContact C-O 3.49Å; D334-K342 VanDerWaalsContact C-O 3.31Å; D334-K342 VanDerWaalsContact CA-O 3.22Å; D334-K342 WeakPolarHBondContact CA-O 3.29Å; D334-K342 PolarHBondContact O-N 2.79Å; D334-K342 VanDerWaalsContact O-O 3.08Å; T336-K342 HydrophobicContact CG2-CB 4.1Å; T336-K342 HydrophobicContact CG2-CD 4.49Å; K342-P344 WeakPolarHBondContact O-CD 3.32Å
343	V	93.3	Very high	93.9	Very high	51 Å²	51	46.6 Å²	46.6	31%	0.309	27%	0.265	S	S	.	.			trans	-76.7	124.7	171.2	-178.1	0	0	0	0	108.5	R373 D375	V343-R373 HydrophobicContact CG1-CB 4.08Å; V343-D375 HydrophobicContact CG1-CB 4.35Å
344	P	95	Very high	94	Very high	19 Å²	19	45.1 Å²	45.1	12%	0.123	25%	0.254	C	S	.	.			trans	-60.8	147.6	174.6	-23.7	35	0	0	0	111.6	D334 K342 L374	D334-P344 HydrophobicContact CB-CG 3.94Å; K342-P344 WeakPolarHBondContact O-CD 3.32Å; P344-L374 HydrophobicContact CB-CB 4.24Å; P344-L374 HydrophobicContact CB-CD1 4.14Å; P344-L374 WeakPolarHBondContact O-CB 3.4Å; P344-L374 PolarHBondContact O-N 2.94Å
345	I	95.8	Very high	94.2	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.6	179.8	-65.9	162.7	0	0	0	108.1	I265 L271 L331 H332 A371 L372 R373	I265-I345 HydrophobicContact CD1-CD1 4.45Å; I265-I345 HydrophobicContact CG2-CD1 4.42Å; L271-I345 HydrophobicContact CD1-CD1 3.87Å; L331-I345 CarbonylContact C-O 3.54Å; L331-I345 PolarHBondContact O-N 3.44Å; H332-I345 PolarHBondContact CD2-O 3.27Å; I345-A371 HydrophobicContact CG2-CB 4.07Å; I345-L372 WeakPolarHBondContact CA-O 2.92Å; I345-R373 HydrophobicContact CG1-CG 4.11Å
346	A	95.9	Very high	94.5	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.2	165.2	0	0	0	0	0	109.3	R348 A371 L372 L374 F412 D416	A346-R348 HydrophobicContact CB-CG 4.13Å; A346-A371 CarbonylContact O-C 3.6Å; A346-A371 VanDerWaalsContact O-CA 3.24Å; A346-A371 WeakPolarHBondContact O-CA 3.4Å; A346-L372 PolarHBondContact N-O 3.26Å; A346-L372 PolarHBondContact O-N 3.22Å; A346-L374 HydrophobicContact CB-CD1 4.06Å; A346-L374 HydrophobicContact CB-CD2 4.17Å; A346-L374 HydrophobicContact CB-CG 4.36Å; A346-F412 HydrophobicContact CB-CB 3.57Å; A346-D416 WeakPolarHBondContact CA-OD2 3.33Å
347	H	97.2	Very high	94.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.21	C	C	.	.			trans	-77.8	-41.3	-176	-174.5	-88.5	0	0	0	112.3	L331 D349 I350 L365 C366 D367 F368 D416	L331-H347 HydrophobicContact CD1-CB 4.28Å; H347-D349 PolarHBondContact CE1-O 3.14Å; H347-D349 VanDerWaalsContact CE1-O 3.28Å; H347-D349 PolarHBondContact ND1-N 3.48Å; H347-D349 PolarHBondContact ND1-O 2.98Å; H347-D349 PolarHBondContact O-N 3.08Å; H347-I350 HydrophobicContact CB-CD1 4.09Å; H347-I350 HydrophobicContact CB-CG1 3.7Å; H347-I350 WeakPolarHBondContact ND1-CG1 3.45Å; H347-I350 PolarHBondContact ND1-N 3.02Å; H347-L365 HydrophobicContact CB-CD2 4.28Å; H347-L365 WeakPolarHBondContact CD2-CD2 3.29Å; H347-C366 PolarHBondContact NE2-O 2.86Å; H347-C366 VanDerWaalsContact NE2-O 3.1Å; H347-D367 PolarHBondContact NE2-O 3.39Å; H347-F368 AromaticContact CD2-CD1 3.87Å; H347-F368 AromaticContact CD2-CE1 3.85Å; H347-D416 PolarHBondContact N-OD2 3.44Å
348	R	95.6	Very high	95.5	Very high	37 Å²	37	30.9 Å²	30.9	14%	0.14	18%	0.176	C	C	.	.	S	Bend	trans	66.1	-2.7	174.5	-60.6	165.1	58.5	-155.5	7	116.7	A346 L370 S386 V389 F412 D416	A346-R348 HydrophobicContact CB-CG 4.13Å; R348-L370 WeakPolarHBondContact CD-O 3.43Å; R348-L370 PolarHBondContact NH1-O 3.42Å; R348-S386 VanDerWaalsContact NH2-C 3.29Å; R348-S386 PolarHBondContact NH2-O 3.38Å; R348-S386 PolarHBondContact NH2-OG 3.33Å; R348-V389 HydrophobicContact CB-CG2 4.35Å; R348-V389 VanDerWaalsContact CZ-CG2 3.44Å; R348-F412 HydrophobicContact CG-CD1 4.46Å; R348-D416 WeakPolarHBondContact CA-OD1 3.44Å; R348-D416 PolarHBondContact N-OD1 3.19Å
349	D	96.6	Very high	95.9	Very high	13 Å²	13	34.4 Å²	34.4	7%	0.07	18%	0.18	C	C	.	.			trans	-141.8	45.3	170.9	-159.5	34	0	0	0	112.1	H347 K351 N354 L370 G390 T391	H347-D349 PolarHBondContact CE1-O 3.14Å; H347-D349 VanDerWaalsContact CE1-O 3.28Å; H347-D349 PolarHBondContact ND1-N 3.48Å; H347-D349 PolarHBondContact ND1-O 2.98Å; H347-D349 PolarHBondContact O-N 3.08Å; D349-K351 PolarHBondContact O-N 3.26Å; D349-K351 IonicContact OD1-NZ 2.99Å; D349-K351 VanDerWaalsContact OD2-CE 3.25Å; D349-K351 WeakPolarHBondContact OD2-CE 3.42Å; D349-K351 IonicContact OD2-NZ 3.57Å; D349-K351 PolarHBondContact OD2-NZ 3.4Å; D349-N354 PolarHBondContact O-ND2 2.94Å; D349-N354 PolarHBondContact OD2-ND2 3.44Å; D349-L370 HydrophobicContact CB-CD1 4.04Å; D349-G390 WeakPolarHBondContact OD1-CA 3.45Å; D349-T391 WeakPolarHBondContact OD1-CB 3.32Å; D349-T391 PolarHBondContact OD1-N 3.32Å; D349-T391 PolarHBondContact OD1-OG1 3.46Å
350	I	98.6	Very high	96.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.			trans	-68.8	122.3	174.4	-61.6	179.6	0	0	0	108.6	V328 H347 D416 S419 V423	V328-I350 HydrophobicContact CG1-CD1 4.23Å; V328-I350 HydrophobicContact CG2-CD1 3.8Å; H347-I350 HydrophobicContact CB-CD1 4.09Å; H347-I350 HydrophobicContact CB-CG1 3.7Å; H347-I350 WeakPolarHBondContact ND1-CG1 3.45Å; H347-I350 PolarHBondContact ND1-N 3.02Å; I350-D416 HydrophobicContact CD1-CB 3.69Å; I350-S419 WeakPolarHBondContact O-CB 3.4Å; I350-V423 HydrophobicContact CG2-CG2 4.32Å
351	K	98.1	Very high	96.6	Very high	29 Å²	29	31.3 Å²	31.3	13%	0.126	17%	0.165	C	C	.	.			trans	-162.1	159.4	177.5	58.3	-172.3	171.7	-165.2	0	109.4	D349 S353 N354 T391 Y394	D349-K351 PolarHBondContact O-N 3.26Å; D349-K351 IonicContact OD1-NZ 2.99Å; D349-K351 VanDerWaalsContact OD2-CE 3.25Å; D349-K351 WeakPolarHBondContact OD2-CE 3.42Å; D349-K351 IonicContact OD2-NZ 3.57Å; D349-K351 PolarHBondContact OD2-NZ 3.4Å; K351-S353 WeakPolarHBondContact CD-OG 3.46Å; K351-S353 WeakPolarHBondContact CE-OG 3.39Å; K351-S353 WeakPolarHBondContact CG-OG 3.39Å; K351-S353 PolarHBondContact O-N 3.19Å; K351-N354 WeakPolarHBondContact CE-ND2 3.38Å; K351-N354 WeakPolarHBondContact CE-OD1 3.39Å; K351-N354 HydrophobicContact CG-CB 3.98Å; K351-N354 PolarHBondContact O-N 3.39Å; K351-T391 HydrophobicContact CD-CG2 4.32Å; K351-T391 WeakPolarHBondContact CD-OG1 3.36Å; K351-T391 PolarHBondContact NZ-OG1 3.2Å; K351-Y394 HydrophobicContact CB-CD1 3.99Å; K351-Y394 HydrophobicContact CB-CD2 3.65Å; K351-Y394 HydrophobicContact CB-CE1 3.89Å; K351-Y394 HydrophobicContact CB-CE2 3.53Å; K351-Y394 HydrophobicContact CB-CG 3.88Å
352	S	98.4	Very high	96.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-59.8	-27.5	-178.4	49.7	0	0	0	0	114.1	L303 Q304 N354 Y394 E426	L303-S352 WeakPolarHBondContact CB-O 3.25Å; L303-S352 PolarHBondContact N-O 3.45Å; Q304-S352 PolarHBondContact N-O 2.9Å; S352-N354 VanDerWaalsContact C-N 3.29Å; S352-N354 PolarHBondContact O-N 2.75Å; S352-Y394 PolarHBondContact OG-OH 3.46Å; S352-E426 VanDerWaalsContact CB-OE2 3.26Å; S352-E426 WeakPolarHBondContact CB-OE2 3.36Å; S352-E426 PolarHBondContact OG-OE1 2.93Å; S352-E426 PolarHBondContact OG-OE2 3.33Å
353	S	97	Very high	97.2	Very high	37 Å²	37	26.7 Å²	26.7	26%	0.259	14%	0.135	S	C	.	.	G	3₁₀ helix	trans	-73	-17.8	174	74	0	0	0	0	114.4	N302 K351	N302-S353 WeakPolarHBondContact CB-O 3.46Å; K351-S353 WeakPolarHBondContact CD-OG 3.46Å; K351-S353 WeakPolarHBondContact CE-OG 3.39Å; K351-S353 WeakPolarHBondContact CG-OG 3.39Å; K351-S353 PolarHBondContact O-N 3.19Å
354	N	97.9	Very high	97.4	Very high	11 Å²	11	24.4 Å²	24.4	6%	0.059	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-104.3	11.7	-179.5	-73.7	14.1	0	0	0	112.4	D349 K351 S352 C366 D367	D349-N354 PolarHBondContact O-ND2 2.94Å; D349-N354 PolarHBondContact OD2-ND2 3.44Å; K351-N354 WeakPolarHBondContact CE-ND2 3.38Å; K351-N354 WeakPolarHBondContact CE-OD1 3.39Å; K351-N354 HydrophobicContact CG-CB 3.98Å; K351-N354 PolarHBondContact O-N 3.39Å; S352-N354 VanDerWaalsContact C-N 3.29Å; S352-N354 PolarHBondContact O-N 2.75Å; N354-C366 VanDerWaalsContact C-SG 3.59Å; N354-C366 PolarHBondContact O-N 3.21Å; N354-C366 PolarHBondContact O-SG 3.27Å; N354-D367 HydrophobicContact CB-CB 4.31Å; N354-D367 WeakPolarHBondContact ND2-CB 3.29Å; N354-D367 PolarHBondContact ND2-OD2 3.07Å
355	I	98.8	Very high	97.6	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.2	175.5	-65.7	161.2	0	0	0	107.3	N302 L303 L324 C363 L365 V423	N302-I355 CarbonylContact C-O 3.37Å; N302-I355 VanDerWaalsContact CA-O 3.22Å; N302-I355 WeakPolarHBondContact CA-O 3.36Å; L303-I355 HydrophobicContact CB-CB 4.08Å; L303-I355 HydrophobicContact CB-CG2 4.09Å; L303-I355 HydrophobicContact CD2-CB 4.35Å; L303-I355 HydrophobicContact CD2-CD1 4.35Å; L303-I355 HydrophobicContact CD2-CG2 4.07Å; L303-I355 PolarHBondContact N-O 2.85Å; L324-I355 HydrophobicContact CD1-CD1 3.62Å; L324-I355 HydrophobicContact CD1-CG1 4.24Å; L324-I355 HydrophobicContact CD2-CD1 4.12Å; I355-C363 HydrophobicContact CG2-CB 3.49Å; I355-C363 VanDerWaalsContact CG2-CB 3.49Å; I355-L365 HydrophobicContact CD1-CD1 4.44Å; I355-L365 HydrophobicContact CG1-CD1 3.6Å; I355-V423 HydrophobicContact CD1-CB 4.41Å; I355-V423 HydrophobicContact CD1-CG1 3.65Å; I355-V423 HydrophobicContact CD1-CG2 4.17Å
356	L	98.6	Very high	97.6	Very high	31 Å²	31	24.2 Å²	24.2	16%	0.162	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	140	179.3	-61.2	175.2	0	0	0	110.6	L277 H298 G301 N302 C363 C364 C366	L277-L356 HydrophobicContact CD1-CD1 3.92Å; L277-L356 HydrophobicContact CD2-CD1 4.12Å; H298-L356 HydrophobicContact CB-CB 4.26Å; G301-L356 WeakPolarHBondContact O-CA 3.2Å; N302-L356 HydrophobicContact CB-CD2 4.24Å; L356-C363 CarbonylContact O-C 3.55Å; L356-C363 WeakPolarHBondContact O-CA 3.43Å; L356-C363 WeakPolarHBondContact O-CB 3.42Å; L356-C364 PolarHBondContact N-O 3.16Å; L356-C364 PolarHBondContact O-N 3.36Å; L356-C366 HydrophobicContact CD1-CB 4.26Å; L356-C366 HydrophobicContact CG-CB 4.49Å
357	V	98.8	Very high	97.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	126.4	177.3	-173.9	0	0	0	0	109.5	L300 G301 L303 F306 L320 M361	L300-V357 HydrophobicContact CB-CB 3.93Å; L300-V357 HydrophobicContact CB-CG1 4.17Å; L300-V357 HydrophobicContact CD1-CB 4.47Å; L300-V357 HydrophobicContact CD1-CG1 3.81Å; G301-V357 PolarHBondContact O-N 3.31Å; L303-V357 HydrophobicContact CB-CG2 4.18Å; L303-V357 HydrophobicContact CD1-CG2 3.86Å; F306-V357 HydrophobicContact CB-CG2 3.88Å; F306-V357 HydrophobicContact CD1-CG2 4.17Å; F306-V357 HydrophobicContact CD2-CB 4.46Å; F306-V357 HydrophobicContact CD2-CG1 4.34Å; F306-V357 HydrophobicContact CD2-CG2 4.4Å; F306-V357 HydrophobicContact CE2-CG1 4.37Å; F306-V357 HydrophobicContact CG-CB 4.43Å; F306-V357 HydrophobicContact CG-CG1 4.46Å; F306-V357 HydrophobicContact CG-CG2 3.89Å; L320-V357 HydrophobicContact CD2-CG1 4.15Å; L320-V357 HydrophobicContact CD2-CG2 4.31Å; V357-M361 HydrophobicContact CG1-SD 4.32Å
358	K	98.1	Very high	97.4	Very high	31 Å²	31	25.5 Å²	25.5	14%	0.135	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-88.2	160.8	177.1	-67.5	170.1	53.3	-155.3	0	110.5	L300 D360 M361 T362 C364	L300-K358 WeakPolarHBondContact CD1-O 3.26Å; K358-D360 WeakPolarHBondContact CB-OD1 3.48Å; K358-D360 WeakPolarHBondContact CE-OD2 3.49Å; K358-D360 IonicContact NZ-OD1 2.71Å; K358-D360 IonicContact NZ-OD2 3.52Å; K358-D360 PolarHBondContact NZ-OD2 2.94Å; K358-D360 PolarHBondContact O-N 3.01Å; K358-D360 VanDerWaalsContact O-N 3.16Å; K358-M361 PolarHBondContact O-N 3.14Å; K358-T362 VanDerWaalsContact CB-O 3.3Å; K358-T362 WeakPolarHBondContact CB-O 3.18Å; K358-T362 WeakPolarHBondContact CD-OG1 3.45Å; K358-T362 WeakPolarHBondContact CE-OG1 3.21Å; K358-T362 PolarHBondContact N-O 3.17Å; K358-T362 PolarHBondContact NZ-OG1 2.81Å; K358-C364 HydrophobicContact CD-CB 4.41Å
359	K	96.8	Very high	97.2	Very high	170 Å²	170	24.1 Å²	24.1	74%	0.739	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.6	179.6	-68.2	-176.5	178.5	179.1	0	113.9	P299 M361	P299-K359 HydrophobicContact CG-CG 4.22Å; K359-M361 VanDerWaalsContact C-N 3.25Å
360	D	96.4	Very high	96.9	Very high	84 Å²	84	24.8 Å²	24.8	45%	0.449	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	11.3	177.3	61.7	5.6	0	0	0	112.6	K358 T362	K358-D360 WeakPolarHBondContact CB-OD1 3.48Å; K358-D360 WeakPolarHBondContact CE-OD2 3.49Å; K358-D360 IonicContact NZ-OD1 2.71Å; K358-D360 IonicContact NZ-OD2 3.52Å; K358-D360 PolarHBondContact NZ-OD2 2.94Å; K358-D360 PolarHBondContact O-N 3.01Å; K358-D360 VanDerWaalsContact O-N 3.16Å; D360-T362 VanDerWaalsContact CG-OG1 3.25Å; D360-T362 PolarHBondContact O-N 3.44Å; D360-T362 VanDerWaalsContact O-N 3.1Å; D360-T362 WeakPolarHBondContact OD1-CB 3.14Å; D360-T362 PolarHBondContact OD1-N 3.12Å; D360-T362 PolarHBondContact OD1-OG1 2.7Å; D360-T362 PolarHBondContact OD2-OG1 3.16Å
361	M	97.4	Very high	96.7	Very high	31 Å²	31	24.9 Å²	24.9	15%	0.153	13%	0.128	C	C	.	.	S	Bend	trans	63	7.1	-177.1	-65.9	-59	-65	0	0	115.6	L300 F306 D316 L319 L320 V357 K358 K359	L300-M361 HydrophobicContact CD1-SD 4.42Å; F306-M361 HydrophobicContact CE1-CE 3.78Å; F306-M361 HydrophobicContact CZ-CE 3.59Å; F306-M361 HydrophobicContact CZ-SD 3.93Å; D316-M361 HydrophobicContact CB-CE 3.73Å; L319-M361 HydrophobicContact CB-CB 4.44Å; L319-M361 WeakPolarHBondContact CB-O 3.42Å; L319-M361 HydrophobicContact CD1-CB 3.83Å; L320-M361 HydrophobicContact CD1-CE 4.44Å; L320-M361 VanDerWaalsContact CD2-O 3.27Å; L320-M361 WeakPolarHBondContact CD2-O 3.4Å; L320-M361 WeakPolarHBondContact CG-O 3.45Å; V357-M361 HydrophobicContact CG1-SD 4.32Å; K358-M361 PolarHBondContact O-N 3.14Å; K359-M361 VanDerWaalsContact C-N 3.25Å
362	T	98.4	Very high	96.4	Very high	13 Å²	13	24.5 Å²	24.5	8%	0.08	13%	0.127	C	C	.	.			trans	-80.1	168.2	162	68.4	0	0	0	0	110.1	L319 K358 D360	L319-T362 HydrophobicContact CD2-CG2 4.18Å; K358-T362 VanDerWaalsContact CB-O 3.3Å; K358-T362 WeakPolarHBondContact CB-O 3.18Å; K358-T362 WeakPolarHBondContact CD-OG1 3.45Å; K358-T362 WeakPolarHBondContact CE-OG1 3.21Å; K358-T362 PolarHBondContact N-O 3.17Å; K358-T362 PolarHBondContact NZ-OG1 2.81Å; D360-T362 VanDerWaalsContact CG-OG1 3.25Å; D360-T362 PolarHBondContact O-N 3.44Å; D360-T362 VanDerWaalsContact O-N 3.1Å; D360-T362 WeakPolarHBondContact OD1-CB 3.14Å; D360-T362 PolarHBondContact OD1-N 3.12Å; D360-T362 PolarHBondContact OD1-OG1 2.7Å; D360-T362 PolarHBondContact OD2-OG1 3.16Å
363	C	98.6	Very high	96.1	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.014	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	165.4	174.8	72.5	0	0	0	0	113	N275 L320 S323 L324 I355 L356	N275-C363 WeakPolarHBondContact CB-O 3.44Å; N275-C363 PolarHBondContact ND2-O 2.63Å; L320-C363 HydrophobicContact CD2-CB 4.14Å; S323-C363 PolarHBondContact OG-N 3.49Å; S323-C363 PolarHBondContact OG-SG 2.93Å; L324-C363 PolarHBondContact N-SG 3.42Å; I355-C363 HydrophobicContact CG2-CB 3.49Å; I355-C363 VanDerWaalsContact CG2-CB 3.49Å; L356-C363 CarbonylContact O-C 3.55Å; L356-C363 WeakPolarHBondContact O-CA 3.43Å; L356-C363 WeakPolarHBondContact O-CB 3.42Å
364	C	98.3	Very high	95.7	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.014	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146.1	164	66.8	0	0	0	0	111.9	N275 H298 L356 K358	N275-C364 CarbonylContact O-C 3.54Å; N275-C364 WeakPolarHBondContact O-CA 3.3Å; N275-C364 WeakPolarHBondContact O-CB 3.44Å; H298-C364 VanDerWaalsContact CD2-SG 3.58Å; H298-C364 PolarHBondContact NE2-SG 3.15Å; L356-C364 PolarHBondContact N-O 3.16Å; L356-C364 PolarHBondContact O-N 3.36Å; K358-C364 HydrophobicContact CD-CB 4.41Å
365	L	98.4	Very high	95.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	139.8	177.8	-163.9	67.1	0	0	0	110.6	N275 L277 V327 L331 H347 I355	N275-L365 PolarHBondContact O-N 2.81Å; L277-L365 WeakPolarHBondContact CB-O 3.37Å; L277-L365 PolarHBondContact N-O 2.65Å; V327-L365 HydrophobicContact CG1-CB 4.08Å; V327-L365 HydrophobicContact CG2-CB 3.92Å; L331-L365 HydrophobicContact CD1-CD2 3.61Å; H347-L365 HydrophobicContact CB-CD2 4.28Å; H347-L365 WeakPolarHBondContact CD2-CD2 3.29Å; I355-L365 HydrophobicContact CD1-CD1 4.44Å; I355-L365 HydrophobicContact CG1-CD1 3.6Å
366	C	95.9	Very high	93.8	Very high	16 Å²	16	37 Å²	37	11%	0.108	19%	0.185	C	C	.	.			trans	-134.9	177.4	177.7	75.3	0	0	0	0	111.1	L277 H347 N354 L356	L277-C366 HydrophobicContact CB-CB 3.98Å; L277-C366 HydrophobicContact CD2-CB 3.5Å; L277-C366 VanDerWaalsContact CD2-CB 3.5Å; L277-C366 HydrophobicContact CG-CB 4.36Å; H347-C366 PolarHBondContact NE2-O 2.86Å; H347-C366 VanDerWaalsContact NE2-O 3.1Å; N354-C366 VanDerWaalsContact C-SG 3.59Å; N354-C366 PolarHBondContact O-N 3.21Å; N354-C366 PolarHBondContact O-SG 3.27Å; L356-C366 HydrophobicContact CD1-CB 4.26Å; L356-C366 HydrophobicContact CG-CB 4.49Å
367	D	93.8	Very high	92.8	Very high	28 Å²	28	40 Å²	40	15%	0.15	21%	0.209	C	C	.	.			trans	66.6	66.2	175.8	-164.1	22.4	0	0	0	115	K249 H347 N354 G369	K249-D367 IonicContact NZ-OD1 3.67Å; K249-D367 PolarHBondContact NZ-OD1 3.36Å; H347-D367 PolarHBondContact NE2-O 3.39Å; N354-D367 HydrophobicContact CB-CB 4.31Å; N354-D367 WeakPolarHBondContact ND2-CB 3.29Å; N354-D367 PolarHBondContact ND2-OD2 3.07Å; D367-G369 PolarHBondContact O-N 3.43Å
368	F	94.6	Very high	91.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-81.9	19.6	177.4	-64.5	-94	0	0	0	113.5	N261 E262 I265 F266 V276 L331 H347 L370 A371	N261-F368 PolarHBondContact ND2-O 2.7Å; E262-F368 VanDerWaalsContact CG-C 3.41Å; E262-F368 HydrophobicContact CG-CB 4.08Å; I265-F368 HydrophobicContact CB-CB 4.2Å; I265-F368 HydrophobicContact CG2-CB 3.83Å; I265-F368 HydrophobicContact CG2-CD1 3.68Å; I265-F368 HydrophobicContact CG2-CE1 4.42Å; I265-F368 HydrophobicContact CG2-CG 3.8Å; F266-F368 HydrophobicContact CD1-CD2 4.38Å; F266-F368 HydrophobicContact CD1-CE2 4.44Å; F266-F368 HydrophobicContact CD2-CD2 4.49Å; F266-F368 AromaticContact CE1-CD2 3.65Å; F266-F368 HydrophobicContact CE1-CD2 3.65Å; F266-F368 AromaticContact CE1-CE2 3.57Å; F266-F368 HydrophobicContact CE1-CE2 3.57Å; F266-F368 AromaticContact CE2-CD2 3.79Å; F266-F368 HydrophobicContact CE2-CD2 3.79Å; F266-F368 AromaticContact CZ-CD2 3.33Å; F266-F368 HydrophobicContact CZ-CD2 3.33Å; F266-F368 AromaticContact CZ-CE2 3.62Å; F266-F368 HydrophobicContact CZ-CE2 3.62Å; V276-F368 HydrophobicContact CG1-CE2 4.11Å; V276-F368 HydrophobicContact CG1-CZ 3.98Å; L331-F368 HydrophobicContact CD1-CE1 3.96Å; L331-F368 HydrophobicContact CD2-CE1 3.92Å; L331-F368 HydrophobicContact CD2-CZ 4.42Å; H347-F368 AromaticContact CD2-CD1 3.87Å; H347-F368 AromaticContact CD2-CE1 3.85Å; F368-L370 PolarHBondContact O-N 3.36Å; F368-L370 VanDerWaalsContact O-N 3.17Å; F368-A371 HydrophobicContact CB-CB 3.84Å; F368-A371 HydrophobicContact CD1-CB 3.86Å; F368-A371 HydrophobicContact CG-CB 4.35Å; F368-A371 WeakPolarHBondContact O-CB 3.46Å; F368-A371 PolarHBondContact O-N 2.67Å
369	G	91.1	Very high	90.5	Very high	7 Å²	7	43.1 Å²	43.1	7%	0.072	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-59.8	-30.6	-175	0	0	0	0	0	113.3	N261 E262 D367	N261-G369 PolarHBondContact ND2-O 3.15Å; E262-G369 WeakPolarHBondContact OE1-CA 3.44Å; E262-G369 PolarHBondContact OE1-N 2.89Å; D367-G369 PolarHBondContact O-N 3.43Å
370	L	91.4	Very high	89.2	Confident	27 Å²	27	40.1 Å²	40.1	14%	0.141	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-105.3	0.4	178	-62	179.3	0	0	0	113.6	F223 R348 D349 F368 V389	F223-L370 HydrophobicContact CE2-CD2 4.31Å; F223-L370 HydrophobicContact CE2-CG 4.36Å; F223-L370 HydrophobicContact CZ-CD2 4.08Å; R348-L370 WeakPolarHBondContact CD-O 3.43Å; R348-L370 PolarHBondContact NH1-O 3.42Å; D349-L370 HydrophobicContact CB-CD1 4.04Å; F368-L370 PolarHBondContact O-N 3.36Å; F368-L370 VanDerWaalsContact O-N 3.17Å; L370-V389 HydrophobicContact CB-CG2 4.38Å; L370-V389 HydrophobicContact CD1-CB 4.35Å; L370-V389 HydrophobicContact CD1-CG2 4.3Å; L370-V389 HydrophobicContact CD2-CB 4.43Å; L370-V389 HydrophobicContact CD2-CG2 4.46Å
371	A	93.6	Very high	87.9	Confident	3 Å²	3	41.9 Å²	41.9	3%	0.025	24%	0.236	C	C	.	.			trans	-63.8	147	-176.9	0	0	0	0	0	111	N261 I265 I345 A346 F368	N261-A371 PolarHBondContact ND2-O 3.04Å; I265-A371 HydrophobicContact CD1-CB 4.47Å; I265-A371 HydrophobicContact CG1-CB 4.38Å; I345-A371 HydrophobicContact CG2-CB 4.07Å; A346-A371 CarbonylContact O-C 3.6Å; A346-A371 VanDerWaalsContact O-CA 3.24Å; A346-A371 WeakPolarHBondContact O-CA 3.4Å; F368-A371 HydrophobicContact CB-CB 3.84Å; F368-A371 HydrophobicContact CD1-CB 3.86Å; F368-A371 HydrophobicContact CG-CB 4.35Å; F368-A371 WeakPolarHBondContact O-CB 3.46Å; F368-A371 PolarHBondContact O-N 2.67Å
372	L	92.1	Very high	86.6	Confident	21 Å²	21	45.5 Å²	45.5	11%	0.11	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.1	-179.2	-175.3	65.3	0	0	0	109.5	I345 A346 L374 L378 L383 F412	I345-L372 WeakPolarHBondContact CA-O 2.92Å; A346-L372 PolarHBondContact N-O 3.26Å; A346-L372 PolarHBondContact O-N 3.22Å; L372-L374 HydrophobicContact CB-CD2 4.45Å; L372-L374 HydrophobicContact CD2-CD2 3.87Å; L372-L374 HydrophobicContact CG-CD2 4.07Å; L372-L374 PolarHBondContact O-N 2.66Å; L372-L378 HydrophobicContact CD1-CD1 4.13Å; L372-L378 HydrophobicContact CD1-CD2 4.25Å; L372-L378 HydrophobicContact CD2-CD1 4.23Å; L372-L378 HydrophobicContact CG-CD1 4.19Å; L372-L383 HydrophobicContact CD2-CD1 3.62Å; L372-F412 HydrophobicContact CD2-CD1 4.45Å; L372-F412 HydrophobicContact CD2-CE1 4.31Å; L372-F412 HydrophobicContact CD2-CZ 4.37Å
373	R	92.1	Very high	85.4	Confident	79 Å²	79	45.4 Å²	45.4	30%	0.298	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	120.5	164.6	-78.4	-178.5	170	130.9	-1.6	108.6	D264 I265 D268 V343 I345 D375 L378	D264-R373 PolarHBondContact O-NH1 3.01Å; D264-R373 PolarHBondContact O-NH2 3Å; I265-R373 HydrophobicContact CD1-CG 3.66Å; D268-R373 IonicContact OD2-CZ 3.72Å; D268-R373 IonicContact OD2-NE 2.6Å; D268-R373 IonicContact OD2-NH2 2.91Å; D268-R373 PolarHBondContact OD2-NH2 3.44Å; V343-R373 HydrophobicContact CG1-CB 4.08Å; I345-R373 HydrophobicContact CG1-CG 4.11Å; R373-D375 PolarHBondContact O-N 3.4Å; R373-L378 VanDerWaalsContact O-CD1 3.25Å; R373-L378 WeakPolarHBondContact O-CD1 3.3Å
374	L	89.8	Confident	83.9	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.037	27%	0.272	C	S	.	.			trans	-86.6	66.5	-177.1	-56.3	175.6	0	0	0	110.1	P344 A346 L372 I409 F412 K413	P344-L374 HydrophobicContact CB-CB 4.24Å; P344-L374 HydrophobicContact CB-CD1 4.14Å; P344-L374 WeakPolarHBondContact O-CB 3.4Å; P344-L374 PolarHBondContact O-N 2.94Å; A346-L374 HydrophobicContact CB-CD1 4.06Å; A346-L374 HydrophobicContact CB-CD2 4.17Å; A346-L374 HydrophobicContact CB-CG 4.36Å; L372-L374 HydrophobicContact CB-CD2 4.45Å; L372-L374 HydrophobicContact CD2-CD2 3.87Å; L372-L374 HydrophobicContact CG-CD2 4.07Å; L372-L374 PolarHBondContact O-N 2.66Å; L374-I409 HydrophobicContact CB-CG2 3.46Å; L374-I409 VanDerWaalsContact CB-CG2 3.46Å; L374-I409 HydrophobicContact CD1-CG2 3.47Å; L374-I409 VanDerWaalsContact CD1-CG2 3.47Å; L374-I409 HydrophobicContact CD2-CG2 4.09Å; L374-I409 HydrophobicContact CG-CG2 3.82Å; L374-F412 HydrophobicContact CD2-CB 4.18Å; L374-F412 HydrophobicContact CD2-CD2 4.12Å; L374-F412 HydrophobicContact CD2-CG 4.26Å; L374-K413 HydrophobicContact CD1-CD 4.48Å; L374-K413 HydrophobicContact CD1-CG 3.96Å
375	D	83.9	Confident	82.4	Confident	72 Å²	72	54.4 Å²	54.4	39%	0.385	31%	0.306	S	S	.	.			trans	-84.8	142.8	175.2	-161.9	-27.8	0	0	0	110.2	V343 R373 S377 L378	V343-D375 HydrophobicContact CG1-CB 4.35Å; R373-D375 PolarHBondContact O-N 3.4Å; D375-S377 PolarHBondContact O-N 3.19Å; D375-S377 VanDerWaalsContact O-N 3.16Å; D375-S377 PolarHBondContact OD1-N 3.21Å; D375-S377 VanDerWaalsContact OD1-N 3.12Å; D375-S377 PolarHBondContact OD2-OG 3.28Å; D375-L378 WeakPolarHBondContact O-CB 3.2Å; D375-L378 WeakPolarHBondContact O-CG 3.2Å; D375-L378 PolarHBondContact O-N 3.23Å; D375-L378 VanDerWaalsContact O-N 3.14Å
376	N	72.7	Confident	80.9	Confident	152 Å²	152	55.4 Å²	55.4	81%	0.813	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.2	173.7	-69.1	-14.9	0	0	0	112.6
377	S	75.9	Confident	79.4	Confident	94 Å²	94	55.2 Å²	55.2	66%	0.657	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-3.7	174	71.3	0	0	0	0	114.7	D375 S379	D375-S377 PolarHBondContact O-N 3.19Å; D375-S377 VanDerWaalsContact O-N 3.16Å; D375-S377 PolarHBondContact OD1-N 3.21Å; D375-S377 VanDerWaalsContact OD1-N 3.12Å; D375-S377 PolarHBondContact OD2-OG 3.28Å; S377-S379 PolarHBondContact O-N 2.93Å
378	L	75.9	Confident	78.8	Confident	48 Å²	48	57.9 Å²	57.9	25%	0.251	33%	0.326	S	S	.	.			trans	-62.1	131.8	178.4	-76.1	173.4	0	0	0	111	L372 R373 D375 L383	L372-L378 HydrophobicContact CD1-CD1 4.13Å; L372-L378 HydrophobicContact CD1-CD2 4.25Å; L372-L378 HydrophobicContact CD2-CD1 4.23Å; L372-L378 HydrophobicContact CG-CD1 4.19Å; R373-L378 VanDerWaalsContact O-CD1 3.25Å; R373-L378 WeakPolarHBondContact O-CD1 3.3Å; D375-L378 WeakPolarHBondContact O-CB 3.2Å; D375-L378 WeakPolarHBondContact O-CG 3.2Å; D375-L378 PolarHBondContact O-N 3.23Å; D375-L378 VanDerWaalsContact O-N 3.14Å; L378-L383 HydrophobicContact CD1-CD1 4.32Å
379	S	74.2	Confident	78.4	Confident	49 Å²	49	59.5 Å²	59.5	34%	0.343	34%	0.336	S	S	.	.			trans	-75.3	151.2	174	67.2	0	0	0	0	111.5	S377 D381 E382 L383	S377-S379 PolarHBondContact O-N 2.93Å; S379-D381 PolarHBondContact O-N 2.69Å; S379-E382 WeakPolarHBondContact CB-OE2 3.47Å; S379-E382 PolarHBondContact N-OE2 3.38Å; S379-E382 PolarHBondContact O-N 3.33Å; S379-E382 WeakPolarHBondContact OG-CB 3.19Å; S379-E382 WeakPolarHBondContact OG-CG 3.31Å; S379-E382 PolarHBondContact OG-N 2.54Å; S379-E382 PolarHBondContact OG-OE2 3.25Å; S379-L383 PolarHBondContact O-N 3.44Å; S379-L383 VanDerWaalsContact O-N 3.12Å
380	V	69.1	Low	78.4	Confident	108 Å²	108	60.1 Å²	60.1	66%	0.655	34%	0.342	S	S	*	.	H	α-helix	trans	-58.1	-33.9	175	-179.6	0	0	0	0	111.2	L383 A384	V380-L383 PolarHBondContact O-N 2.91Å; V380-A384 VanDerWaalsContact O-CB 3.3Å; V380-A384 WeakPolarHBondContact O-CB 3.31Å; V380-A384 PolarHBondContact O-N 2.99Å
381	D	68.6	Low	78.6	Confident	120 Å²	120	61 Å²	61	64%	0.642	35%	0.349	S	S	*	.	H	α-helix	trans	-70.5	-39.1	178.5	-68.7	-28.5	0	0	0	112.6	S379 L383 N385	S379-D381 PolarHBondContact O-N 2.69Å; D381-L383 VanDerWaalsContact C-N 3.26Å; D381-L383 PolarHBondContact O-N 3.32Å; D381-N385 PolarHBondContact O-N 3.44Å; D381-N385 VanDerWaalsContact O-N 3.12Å; D381-N385 PolarHBondContact O-ND2 3.29Å
382	E	71.3	Confident	78.6	Confident	107 Å²	107	61.6 Å²	61.6	50%	0.5	35%	0.354	S	S	.	.	H	α-helix	trans	-64.2	-35.2	173.2	-75.1	164.4	140.6	0	0	111.4	S379 S386	S379-E382 WeakPolarHBondContact CB-OE2 3.47Å; S379-E382 PolarHBondContact N-OE2 3.38Å; S379-E382 PolarHBondContact O-N 3.33Å; S379-E382 WeakPolarHBondContact OG-CB 3.19Å; S379-E382 WeakPolarHBondContact OG-CG 3.31Å; S379-E382 PolarHBondContact OG-N 2.54Å; S379-E382 PolarHBondContact OG-OE2 3.25Å; E382-S386 VanDerWaalsContact O-CB 3.29Å; E382-S386 WeakPolarHBondContact O-CB 3.03Å; E382-S386 PolarHBondContact O-N 3Å; E382-S386 PolarHBondContact O-OG 3.15Å
383	L	72.1	Confident	78.9	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.063	35%	0.351	C	S	.	.	H	α-helix	trans	-75.8	-39.5	179.4	-149.2	54.1	0	0	0	112.1	L372 L378 S379 V380 D381 S386 G387 L406 F412	L372-L383 HydrophobicContact CD2-CD1 3.62Å; L378-L383 HydrophobicContact CD1-CD1 4.32Å; S379-L383 PolarHBondContact O-N 3.44Å; S379-L383 VanDerWaalsContact O-N 3.12Å; V380-L383 PolarHBondContact O-N 2.91Å; D381-L383 VanDerWaalsContact C-N 3.26Å; D381-L383 PolarHBondContact O-N 3.32Å; L383-S386 WeakPolarHBondContact O-CA 3.22Å; L383-S386 VanDerWaalsContact O-CB 3.29Å; L383-S386 WeakPolarHBondContact O-CB 3.05Å; L383-S386 PolarHBondContact O-N 3.09Å; L383-S386 VanDerWaalsContact O-N 3.07Å; L383-G387 PolarHBondContact O-N 2.69Å; L383-L406 HydrophobicContact CB-CB 4.41Å; L383-L406 HydrophobicContact CB-CD2 4.34Å; L383-L406 HydrophobicContact CD2-CB 3.79Å; L383-L406 HydrophobicContact CD2-CD2 4.49Å; L383-L406 WeakPolarHBondContact CD2-O 2.95Å; L383-L406 HydrophobicContact CG-CB 4.02Å; L383-L406 HydrophobicContact CG-CD2 3.85Å; L383-L406 HydrophobicContact CG-CG 4.41Å; L383-F412 HydrophobicContact CD1-CD2 4.43Å; L383-F412 HydrophobicContact CD1-CE1 4.33Å; L383-F412 HydrophobicContact CD1-CE2 3.38Å; L383-F412 HydrophobicContact CD1-CZ 3.32Å; L383-F412 HydrophobicContact CD2-CE2 4.14Å; L383-F412 HydrophobicContact CG-CE2 3.83Å; L383-F412 HydrophobicContact CG-CZ 3.73Å
384	A	66.5	Low	79.2	Confident	54 Å²	54	58 Å²	58	45%	0.446	34%	0.338	S	S	.	.	H	α-helix	trans	-65.6	-40.9	177.2	0	0	0	0	0	112.3	V380 S386 G387 L406	V380-A384 VanDerWaalsContact O-CB 3.3Å; V380-A384 WeakPolarHBondContact O-CB 3.31Å; V380-A384 PolarHBondContact O-N 2.99Å; A384-S386 PolarHBondContact O-N 3.05Å; A384-G387 PolarHBondContact O-N 3.35Å; A384-L406 HydrophobicContact CB-CD1 3.87Å
385	N	68	Low	79.5	Confident	138 Å²	138	58.3 Å²	58.3	74%	0.738	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.4	174.2	-69.8	-47.9	0	0	0	113.2	D381	D381-N385 PolarHBondContact O-N 3.44Å; D381-N385 VanDerWaalsContact O-N 3.12Å; D381-N385 PolarHBondContact O-ND2 3.29Å
386	S	66.1	Low	80.2	Confident	21 Å²	21	54.9 Å²	54.9	15%	0.147	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-7.7	-179.5	-73.9	0	0	0	0	113.6	R348 E382 L383 A384 Q388	R348-S386 VanDerWaalsContact NH2-C 3.29Å; R348-S386 PolarHBondContact NH2-O 3.38Å; R348-S386 PolarHBondContact NH2-OG 3.33Å; E382-S386 VanDerWaalsContact O-CB 3.29Å; E382-S386 WeakPolarHBondContact O-CB 3.03Å; E382-S386 PolarHBondContact O-N 3Å; E382-S386 PolarHBondContact O-OG 3.15Å; L383-S386 WeakPolarHBondContact O-CA 3.22Å; L383-S386 VanDerWaalsContact O-CB 3.29Å; L383-S386 WeakPolarHBondContact O-CB 3.05Å; L383-S386 PolarHBondContact O-N 3.09Å; L383-S386 VanDerWaalsContact O-N 3.07Å; A384-S386 PolarHBondContact O-N 3.05Å; S386-Q388 PolarHBondContact O-N 3.08Å
387	G	65.1	Low	81.3	Confident	13 Å²	13	47.8 Å²	47.8	13%	0.134	28%	0.284	C	S	.	.	S	Bend	trans	-63.9	-42.1	-166.4	0	0	0	0	0	116.3	L383 A384 I404	L383-G387 PolarHBondContact O-N 2.69Å; A384-G387 PolarHBondContact O-N 3.35Å; G387-I404 WeakPolarHBondContact O-CD1 3.35Å
388	Q	80.8	Confident	82.2	Confident	83 Å²	83	44.1 Å²	44.1	39%	0.388	26%	0.257	S	S	.	.	S	Bend	trans	-119	72.8	-175	-171	169	70.8	0	0	111.5	S386 M395 V399 L400 S402	S386-Q388 PolarHBondContact O-N 3.08Å; Q388-M395 HydrophobicContact CG-CE 4.43Å; Q388-M395 HydrophobicContact CG-SD 4.38Å; Q388-V399 PolarHBondContact NE2-O 3.29Å; Q388-V399 VanDerWaalsContact NE2-O 3.09Å; Q388-L400 PolarHBondContact NE2-O 3.32Å; Q388-S402 PolarHBondContact NE2-OG 2.95Å; Q388-S402 VanDerWaalsContact NE2-OG 3.1Å
389	V	87.3	Confident	83.1	Confident	35 Å²	35	42.3 Å²	42.3	21%	0.212	25%	0.248	C	C	.	.			trans	-123.2	168.6	172.9	-51.6	0	0	0	0	110.6	R348 L370 M395	R348-V389 HydrophobicContact CB-CG2 4.35Å; R348-V389 VanDerWaalsContact CZ-CG2 3.44Å; L370-V389 HydrophobicContact CB-CG2 4.38Å; L370-V389 HydrophobicContact CD1-CB 4.35Å; L370-V389 HydrophobicContact CD1-CG2 4.3Å; L370-V389 HydrophobicContact CD2-CB 4.43Å; L370-V389 HydrophobicContact CD2-CG2 4.46Å; V389-M395 VanDerWaalsContact C-CE 3.45Å; V389-M395 VanDerWaalsContact O-CE 3.25Å; V389-M395 WeakPolarHBondContact O-CE 3.24Å
390	G	90.8	Very high	84.1	Confident	20 Å²	20	40 Å²	40	21%	0.206	23%	0.231	C	C	.	.	S	Bend	trans	101.9	-170.5	-179.5	0	0	0	0	0	112.2	D349 M395	D349-G390 WeakPolarHBondContact OD1-CA 3.45Å; G390-M395 WeakPolarHBondContact O-CE 3.03Å
391	T	94.1	Very high	85.1	Confident	45 Å²	45	37.9 Å²	37.9	28%	0.276	21%	0.214	S	C	.	.			trans	-89	117.5	-176.9	-55.8	0	0	0	0	110.5	D349 K351 R393 Y394 M395	D349-T391 WeakPolarHBondContact OD1-CB 3.32Å; D349-T391 PolarHBondContact OD1-N 3.32Å; D349-T391 PolarHBondContact OD1-OG1 3.46Å; K351-T391 HydrophobicContact CD-CG2 4.32Å; K351-T391 WeakPolarHBondContact CD-OG1 3.36Å; K351-T391 PolarHBondContact NZ-OG1 3.2Å; T391-R393 HydrophobicContact CG2-CB 4.48Å; T391-R393 PolarHBondContact O-N 3.01Å; T391-Y394 HydrophobicContact CG2-CD2 3.95Å; T391-Y394 HydrophobicContact CG2-CE2 4.42Å; T391-Y394 PolarHBondContact O-N 3.34Å; T391-M395 PolarHBondContact O-N 2.91Å
392	A	95.3	Very high	86	Confident	15 Å²	15	35.6 Å²	35.6	12%	0.124	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-48.1	-39.1	-173.3	0	0	0	0	0	114.5	Y394 M395 P451 V453 M456	A392-Y394 PolarHBondContact O-N 3.2Å; A392-M395 PolarHBondContact O-N 2.89Å; A392-P451 WeakPolarHBondContact CB-O 3.46Å; A392-V453 HydrophobicContact CB-CG2 4.11Å; A392-M456 HydrophobicContact CB-CG 4.18Å; A392-M456 WeakPolarHBondContact O-CG 3.34Å
393	R	97	Very high	86.6	Confident	13 Å²	13	39.1 Å²	39.1	5%	0.049	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-58.1	-31.1	178.8	-175.3	-177.5	-65.8	-71.4	3.4	113.9	T391 P443 F444 R448 E449 P451 M456	T391-R393 HydrophobicContact CG2-CB 4.48Å; T391-R393 PolarHBondContact O-N 3.01Å; R393-P443 WeakPolarHBondContact CD-O 3.39Å; R393-P443 VanDerWaalsContact CG-O 3.28Å; R393-P443 WeakPolarHBondContact CG-O 3.26Å; R393-P443 PolarHBondContact NH1-O 3.14Å; R393-F444 HydrophobicContact CG-CD2 4.45Å; R393-F444 VanDerWaalsContact NH1-C 3.34Å; R393-F444 PolarHBondContact NH1-O 3.28Å; R393-R448 PolarHBondContact NH2-O 2.93Å; R393-E449 PolarHBondContact NH2-O 3.19Å; R393-P451 HydrophobicContact CB-CG 4.03Å; R393-M456 WeakPolarHBondContact O-CE 3.12Å
394	Y	98.1	Very high	87.1	Confident	11 Å²	11	39.3 Å²	39.3	4%	0.043	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-103.9	-4.7	-175.6	-63.6	-93	0	0	0	112.8	K351 S352 T391 A392 A396 S419 L422 V423 E426 P443	K351-Y394 HydrophobicContact CB-CD1 3.99Å; K351-Y394 HydrophobicContact CB-CD2 3.65Å; K351-Y394 HydrophobicContact CB-CE1 3.89Å; K351-Y394 HydrophobicContact CB-CE2 3.53Å; K351-Y394 HydrophobicContact CB-CG 3.88Å; S352-Y394 PolarHBondContact OG-OH 3.46Å; T391-Y394 HydrophobicContact CG2-CD2 3.95Å; T391-Y394 HydrophobicContact CG2-CE2 4.42Å; T391-Y394 PolarHBondContact O-N 3.34Å; A392-Y394 PolarHBondContact O-N 3.2Å; Y394-A396 PolarHBondContact O-N 3.32Å; Y394-S419 PolarHBondContact O-OG 2.81Å; Y394-S419 VanDerWaalsContact O-OG 3.05Å; Y394-L422 HydrophobicContact CD1-CB 4.06Å; Y394-L422 HydrophobicContact CD1-CD1 4.01Å; Y394-L422 HydrophobicContact CE1-CB 4.31Å; Y394-L422 HydrophobicContact CG-CD1 4.49Å; Y394-V423 HydrophobicContact CE1-CG2 4.22Å; Y394-E426 WeakPolarHBondContact CE1-OE1 3.36Å; Y394-E426 PolarHBondContact OH-OE1 2.97Å; Y394-P443 HydrophobicContact CE1-CG 3.9Å
395	M	97.3	Very high	87.8	Confident	14 Å²	14	40.4 Å²	40.4	7%	0.069	22%	0.216	C	C	.	.			trans	-64.5	131.4	-178.1	-73.2	-177.7	178.8	0	0	111.6	Q388 V389 G390 T391 A392 V399 L400 Y418 V453	Q388-M395 HydrophobicContact CG-CE 4.43Å; Q388-M395 HydrophobicContact CG-SD 4.38Å; V389-M395 VanDerWaalsContact C-CE 3.45Å; V389-M395 VanDerWaalsContact O-CE 3.25Å; V389-M395 WeakPolarHBondContact O-CE 3.24Å; G390-M395 WeakPolarHBondContact O-CE 3.03Å; T391-M395 PolarHBondContact O-N 2.91Å; A392-M395 PolarHBondContact O-N 2.89Å; M395-V399 HydrophobicContact CB-CB 4.18Å; M395-V399 HydrophobicContact CB-CG1 4.06Å; M395-V399 HydrophobicContact CG-CG1 3.88Å; M395-V399 HydrophobicContact SD-CG1 3.95Å; M395-L400 HydrophobicContact CB-CD2 3.71Å; M395-L400 HydrophobicContact CB-CG 3.78Å; M395-L400 HydrophobicContact CG-CD2 4.44Å; M395-L400 HydrophobicContact SD-CD2 3.98Å; M395-Y418 WeakPolarHBondContact O-CE1 3.15Å; M395-V453 HydrophobicContact SD-CG2 4.38Å
396	A	97.4	Very high	88.3	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.008	19%	0.194	C	C	.	.			trans	-63.6	156.2	173.1	0	0	0	0	0	111.9	Y394 E398 V399 L400 A415 Y418	Y394-A396 PolarHBondContact O-N 3.32Å; A396-E398 VanDerWaalsContact C-N 3.33Å; A396-E398 VanDerWaalsContact CB-OE1 3.27Å; A396-E398 WeakPolarHBondContact CB-OE1 3.49Å; A396-E398 PolarHBondContact O-N 3.26Å; A396-V399 HydrophobicContact CB-CG2 3.87Å; A396-V399 WeakPolarHBondContact O-CA 3.01Å; A396-V399 WeakPolarHBondContact O-CB 3.19Å; A396-V399 PolarHBondContact O-N 3.19Å; A396-L400 PolarHBondContact O-N 2.97Å; A396-A415 HydrophobicContact CB-CB 4.01Å; A396-Y418 VanDerWaalsContact CA-CD1 3.46Å; A396-Y418 HydrophobicContact CB-CD1 3.84Å; A396-Y418 HydrophobicContact CB-CD2 4.39Å; A396-Y418 HydrophobicContact CB-CG 3.74Å
397	P	96.9	Very high	88.8	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.013	23%	0.229	C	C	.	.	H	α-helix	trans	-47.3	-49.5	179.1	-30.9	35.9	0	0	0	114.6	V399 L400 E401 Y418 V460 L461 H492	P397-V399 VanDerWaalsContact C-N 3.29Å; P397-V399 PolarHBondContact O-N 3.38Å; P397-L400 WeakPolarHBondContact O-CB 3.37Å; P397-L400 PolarHBondContact O-N 2.86Å; P397-E401 PolarHBondContact O-N 3.12Å; P397-Y418 HydrophobicContact CG-CE2 4.19Å; P397-V460 HydrophobicContact CB-CG1 4.47Å; P397-V460 HydrophobicContact CG-CG1 3.84Å; P397-L461 HydrophobicContact CB-CD2 3.56Å; P397-H492 WeakPolarHBondContact CB-ND1 3.49Å
398	E	95.1	Very high	89.6	Confident	18 Å²	18	46.1 Å²	46.1	8%	0.084	24%	0.235	C	C	.	.	H	α-helix	trans	-67.1	-27.7	-179.6	66.7	-78.4	-175.3	0	0	113.3	A396 S402 R403 I404 R497	A396-E398 VanDerWaalsContact C-N 3.33Å; A396-E398 VanDerWaalsContact CB-OE1 3.27Å; A396-E398 WeakPolarHBondContact CB-OE1 3.49Å; A396-E398 PolarHBondContact O-N 3.26Å; E398-S402 PolarHBondContact O-N 2.88Å; E398-R403 PolarHBondContact O-N 3.03Å; E398-I404 HydrophobicContact CG-CG1 4.17Å; E398-I404 PolarHBondContact O-N 3.23Å; E398-R497 IonicContact OE1-CZ 3.32Å; E398-R497 IonicContact OE1-NH1 3.92Å; E398-R497 PolarHBondContact OE1-NH1 3.07Å; E398-R497 IonicContact OE1-NH2 3.57Å; E398-R497 PolarHBondContact OE1-NH2 3.39Å; E398-R497 IonicContact OE2-CZ 2.63Å; E398-R497 IonicContact OE2-NH1 3.79Å; E398-R497 IonicContact OE2-NH2 3.32Å; E398-R497 PolarHBondContact OE2-NH2 3.25Å
399	V	94.4	Very high	89.6	Confident	10 Å²	10	44.2 Å²	44.2	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-73.4	-42.2	173.5	-176.7	0	0	0	0	109.8	Q388 M395 A396 P397 E401 S402 I404 A415	Q388-V399 PolarHBondContact NE2-O 3.29Å; Q388-V399 VanDerWaalsContact NE2-O 3.09Å; M395-V399 HydrophobicContact CB-CB 4.18Å; M395-V399 HydrophobicContact CB-CG1 4.06Å; M395-V399 HydrophobicContact CG-CG1 3.88Å; M395-V399 HydrophobicContact SD-CG1 3.95Å; A396-V399 HydrophobicContact CB-CG2 3.87Å; A396-V399 WeakPolarHBondContact O-CA 3.01Å; A396-V399 WeakPolarHBondContact O-CB 3.19Å; A396-V399 PolarHBondContact O-N 3.19Å; P397-V399 VanDerWaalsContact C-N 3.29Å; P397-V399 PolarHBondContact O-N 3.38Å; V399-E401 VanDerWaalsContact C-N 3.34Å; V399-E401 PolarHBondContact O-N 3.33Å; V399-S402 PolarHBondContact O-N 2.84Å; V399-S402 VanDerWaalsContact O-N 3.15Å; V399-I404 HydrophobicContact CB-CD1 4.26Å; V399-I404 HydrophobicContact CG1-CD1 4.42Å; V399-I404 HydrophobicContact CG2-CD1 3.67Å; V399-I404 HydrophobicContact CG2-CG1 4.13Å; V399-A415 HydrophobicContact CG2-CB 3.77Å
400	L	94.4	Very high	89.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-36.9	176.3	-69.7	172.1	0	0	0	111.9	Q388 M395 A396 P397 S402 V453 M456 K457 V460 L461	Q388-L400 PolarHBondContact NE2-O 3.32Å; M395-L400 HydrophobicContact CB-CD2 3.71Å; M395-L400 HydrophobicContact CB-CG 3.78Å; M395-L400 HydrophobicContact CG-CD2 4.44Å; M395-L400 HydrophobicContact SD-CD2 3.98Å; A396-L400 PolarHBondContact O-N 2.97Å; P397-L400 WeakPolarHBondContact O-CB 3.37Å; P397-L400 PolarHBondContact O-N 2.86Å; L400-S402 PolarHBondContact O-N 2.87Å; L400-V453 HydrophobicContact CD2-CG1 3.97Å; L400-M456 HydrophobicContact CD1-CB 4.04Å; L400-M456 HydrophobicContact CD2-CB 3.79Å; L400-K457 HydrophobicContact CB-CG 4.07Å; L400-K457 WeakPolarHBondContact O-CE 3.33Å; L400-V460 HydrophobicContact CD1-CB 3.86Å; L400-V460 HydrophobicContact CD1-CG1 4.03Å; L400-V460 HydrophobicContact CD1-CG2 4.21Å; L400-L461 HydrophobicContact CB-CD1 4.17Å
401	E	90.4	Very high	89.8	Confident	64 Å²	64	44.8 Å²	44.8	30%	0.299	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-8.8	174.6	-71.4	-168.1	-176	0	0	114	P397 V399 R403 L461	P397-E401 PolarHBondContact O-N 3.12Å; V399-E401 VanDerWaalsContact C-N 3.34Å; V399-E401 PolarHBondContact O-N 3.33Å; E401-R403 HydrophobicContact CB-CB 4.09Å; E401-R403 HydrophobicContact CB-CG 3.9Å; E401-R403 PolarHBondContact O-N 3.43Å; E401-R403 VanDerWaalsContact OE2-CD 3.29Å; E401-R403 WeakPolarHBondContact OE2-CD 3.21Å; E401-R403 IonicContact OE2-CZ 3.5Å; E401-R403 IonicContact OE2-NE 3.31Å; E401-R403 IonicContact OE2-NH1 3.66Å; E401-R403 PolarHBondContact OE2-NH1 2.96Å; E401-L461 HydrophobicContact CG-CD1 3.33Å; E401-L461 HydrophobicContact CG-CD2 3.94Å; E401-L461 HydrophobicContact CG-CG 4.26Å
402	S	87.8	Confident	89.8	Confident	71 Å²	71	42.9 Å²	42.9	50%	0.497	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	38.6	-169.2	-53.4	0	0	0	0	112.2	Q388 E398 V399 L400	Q388-S402 PolarHBondContact NE2-OG 2.95Å; Q388-S402 VanDerWaalsContact NE2-OG 3.1Å; E398-S402 PolarHBondContact O-N 2.88Å; V399-S402 PolarHBondContact O-N 2.84Å; V399-S402 VanDerWaalsContact O-N 3.15Å; L400-S402 PolarHBondContact O-N 2.87Å
403	R	84.1	Confident	89.8	Confident	181 Å²	181	43.4 Å²	43.4	68%	0.683	21%	0.21	S	C	*	.			trans	-119.4	22.4	-176.3	-70.5	-172.7	-175.2	169.2	-10.7	113.6	E398 E401 N405	E398-R403 PolarHBondContact O-N 3.03Å; E401-R403 HydrophobicContact CB-CB 4.09Å; E401-R403 HydrophobicContact CB-CG 3.9Å; E401-R403 PolarHBondContact O-N 3.43Å; E401-R403 VanDerWaalsContact OE2-CD 3.29Å; E401-R403 WeakPolarHBondContact OE2-CD 3.21Å; E401-R403 IonicContact OE2-CZ 3.5Å; E401-R403 IonicContact OE2-NE 3.31Å; E401-R403 IonicContact OE2-NH1 3.66Å; E401-R403 PolarHBondContact OE2-NH1 2.96Å; R403-N405 PolarHBondContact O-N 2.91Å
404	I	82.6	Confident	89.9	Confident	17 Å²	17	43.5 Å²	43.5	9%	0.087	21%	0.211	C	C	.	.			trans	-53.9	129.2	171.2	-63.7	-179.1	0	0	0	108.7	G387 E398 V399 L406 F412	G387-I404 WeakPolarHBondContact O-CD1 3.35Å; E398-I404 HydrophobicContact CG-CG1 4.17Å; E398-I404 PolarHBondContact O-N 3.23Å; V399-I404 HydrophobicContact CB-CD1 4.26Å; V399-I404 HydrophobicContact CG1-CD1 4.42Å; V399-I404 HydrophobicContact CG2-CD1 3.67Å; V399-I404 HydrophobicContact CG2-CG1 4.13Å; I404-L406 HydrophobicContact CB-CD2 4.41Å; I404-L406 HydrophobicContact CG2-CD2 4.21Å; I404-L406 PolarHBondContact O-N 3.47Å; I404-F412 HydrophobicContact CD1-CE1 4.25Å; I404-F412 HydrophobicContact CG2-CE1 4.1Å; I404-F412 HydrophobicContact CG2-CE2 4.12Å; I404-F412 HydrophobicContact CG2-CZ 3.88Å
405	N	81.3	Confident	89.8	Confident	77 Å²	77	43.4 Å²	43.4	41%	0.412	21%	0.213	S	C	.	.			trans	-72.2	101.4	174.6	-179.3	0.1	0	0	0	109.1	R403 E407 N408 S411	R403-N405 PolarHBondContact O-N 2.91Å; N405-E407 PolarHBondContact O-N 3.23Å; N405-E407 WeakPolarHBondContact OD1-CB 3.46Å; N405-E407 PolarHBondContact OD1-N 3.41Å; N405-N408 HydrophobicContact CB-CB 4.37Å; N405-N408 CarbonylContact O-C 3.52Å; N405-N408 PolarHBondContact O-N 2.83Å; N405-N408 PolarHBondContact OD1-N 3.21Å; N405-S411 WeakPolarHBondContact CB-OG 3.44Å; N405-S411 PolarHBondContact O-OG 2.96Å; N405-S411 VanDerWaalsContact O-OG 3.09Å
406	L	78.3	Confident	89.9	Confident	53 Å²	53	42.8 Å²	42.8	28%	0.277	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-15.7	-179.8	-51.6	178.7	0	0	0	112.3	L383 A384 I404 F412	L383-L406 HydrophobicContact CB-CB 4.41Å; L383-L406 HydrophobicContact CB-CD2 4.34Å; L383-L406 HydrophobicContact CD2-CB 3.79Å; L383-L406 HydrophobicContact CD2-CD2 4.49Å; L383-L406 WeakPolarHBondContact CD2-O 2.95Å; L383-L406 HydrophobicContact CG-CB 4.02Å; L383-L406 HydrophobicContact CG-CD2 3.85Å; L383-L406 HydrophobicContact CG-CG 4.41Å; A384-L406 HydrophobicContact CB-CD1 3.87Å; I404-L406 HydrophobicContact CB-CD2 4.41Å; I404-L406 HydrophobicContact CG2-CD2 4.21Å; I404-L406 PolarHBondContact O-N 3.47Å; L406-F412 HydrophobicContact CD2-CZ 4.06Å
407	E	76.1	Confident	90	Very high	188 Å²	188	42.9 Å²	42.9	88%	0.879	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-24.5	174.5	-58.2	-176.6	169.9	0	0	111.9	N405	N405-E407 PolarHBondContact O-N 3.23Å; N405-E407 WeakPolarHBondContact OD1-CB 3.46Å; N405-E407 PolarHBondContact OD1-N 3.41Å
408	N	82.8	Confident	90	Very high	51 Å²	51	42.8 Å²	42.8	27%	0.273	21%	0.21	S	C	.	.			trans	-106.9	103	178.1	-173.3	7.3	0	0	0	110.8	N405 E410 S411 E495	N405-N408 HydrophobicContact CB-CB 4.37Å; N405-N408 CarbonylContact O-C 3.52Å; N405-N408 PolarHBondContact O-N 2.83Å; N405-N408 PolarHBondContact OD1-N 3.21Å; N408-E410 PolarHBondContact O-N 3.49Å; N408-E410 VanDerWaalsContact O-N 3.1Å; N408-E410 WeakPolarHBondContact OD1-CB 3.4Å; N408-E410 PolarHBondContact OD1-N 3.13Å; N408-S411 VanDerWaalsContact O-CB 3.26Å; N408-S411 WeakPolarHBondContact O-CB 3.18Å; N408-S411 PolarHBondContact O-N 3.42Å; N408-S411 PolarHBondContact O-OG 3.14Å; N408-E495 PolarHBondContact ND2-OE1 2.87Å
409	I	80.8	Confident	90.2	Very high	43 Å²	43	42.4 Å²	42.4	22%	0.221	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-31.7	174.2	-74.2	173.5	0	0	0	112.6	L374 S411 F412	L374-I409 HydrophobicContact CB-CG2 3.46Å; L374-I409 VanDerWaalsContact CB-CG2 3.46Å; L374-I409 HydrophobicContact CD1-CG2 3.47Å; L374-I409 VanDerWaalsContact CD1-CG2 3.47Å; L374-I409 HydrophobicContact CD2-CG2 4.09Å; L374-I409 HydrophobicContact CG-CG2 3.82Å; I409-S411 PolarHBondContact O-N 3.14Å; I409-F412 PolarHBondContact O-N 2.94Å
410	E	89.9	Confident	90.4	Very high	61 Å²	61	41.9 Å²	41.9	29%	0.285	21%	0.206	S	C	.	.	H	α-helix	trans	-61.7	-25.7	-179.5	-158.1	59.9	-148.2	0	0	112.4	N408 F412 K413 Q414	N408-E410 PolarHBondContact O-N 3.49Å; N408-E410 VanDerWaalsContact O-N 3.1Å; N408-E410 WeakPolarHBondContact OD1-CB 3.4Å; N408-E410 PolarHBondContact OD1-N 3.13Å; E410-F412 PolarHBondContact O-N 3.41Å; E410-K413 WeakPolarHBondContact O-CB 3.4Å; E410-K413 PolarHBondContact O-N 2.92Å; E410-K413 VanDerWaalsContact OE1-CD 3.29Å; E410-K413 WeakPolarHBondContact OE1-CD 3.34Å; E410-K413 IonicContact OE1-NZ 3.52Å; E410-K413 VanDerWaalsContact OE2-CD 3.31Å; E410-K413 WeakPolarHBondContact OE2-CD 3.45Å; E410-K413 IonicContact OE2-NZ 2.74Å; E410-K413 PolarHBondContact OE2-NZ 3.5Å; E410-Q414 HydrophobicContact CG-CG 4.42Å; E410-Q414 WeakPolarHBondContact O-CG 3.11Å; E410-Q414 PolarHBondContact O-N 3.13Å
411	S	91.6	Very high	90.6	Very high	6 Å²	6	41.9 Å²	41.9	4%	0.042	21%	0.206	C	C	.	.	H	α-helix	trans	-56.3	-36.3	177.3	-45.3	0	0	0	0	112.8	N405 N408 I409 Q414 A415	N405-S411 WeakPolarHBondContact CB-OG 3.44Å; N405-S411 PolarHBondContact O-OG 2.96Å; N405-S411 VanDerWaalsContact O-OG 3.09Å; N408-S411 VanDerWaalsContact O-CB 3.26Å; N408-S411 WeakPolarHBondContact O-CB 3.18Å; N408-S411 PolarHBondContact O-N 3.42Å; N408-S411 PolarHBondContact O-OG 3.14Å; I409-S411 PolarHBondContact O-N 3.14Å; S411-Q414 VanDerWaalsContact CA-OE1 3.32Å; S411-A415 PolarHBondContact O-N 2.79Å; S411-A415 VanDerWaalsContact O-N 3.13Å
412	F	93.4	Very high	91.1	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-71.1	-34.8	178.2	-67.5	-81.6	0	0	0	112.1	A346 R348 L372 L374 L383 I404 L406 I409 E410 A415 D416	A346-F412 HydrophobicContact CB-CB 3.57Å; R348-F412 HydrophobicContact CG-CD1 4.46Å; L372-F412 HydrophobicContact CD2-CD1 4.45Å; L372-F412 HydrophobicContact CD2-CE1 4.31Å; L372-F412 HydrophobicContact CD2-CZ 4.37Å; L374-F412 HydrophobicContact CD2-CB 4.18Å; L374-F412 HydrophobicContact CD2-CD2 4.12Å; L374-F412 HydrophobicContact CD2-CG 4.26Å; L383-F412 HydrophobicContact CD1-CD2 4.43Å; L383-F412 HydrophobicContact CD1-CE1 4.33Å; L383-F412 HydrophobicContact CD1-CE2 3.38Å; L383-F412 HydrophobicContact CD1-CZ 3.32Å; L383-F412 HydrophobicContact CD2-CE2 4.14Å; L383-F412 HydrophobicContact CG-CE2 3.83Å; L383-F412 HydrophobicContact CG-CZ 3.73Å; I404-F412 HydrophobicContact CD1-CE1 4.25Å; I404-F412 HydrophobicContact CG2-CE1 4.1Å; I404-F412 HydrophobicContact CG2-CE2 4.12Å; I404-F412 HydrophobicContact CG2-CZ 3.88Å; L406-F412 HydrophobicContact CD2-CZ 4.06Å; I409-F412 PolarHBondContact O-N 2.94Å; E410-F412 PolarHBondContact O-N 3.41Å; F412-A415 PolarHBondContact O-N 2.61Å; F412-D416 PolarHBondContact O-N 3.07Å
413	K	96.8	Very high	91.6	Very high	26 Å²	26	35.5 Å²	35.5	11%	0.113	17%	0.168	C	C	.	.	H	α-helix	trans	-71.7	-40.2	176.2	-62.5	174.3	-173.4	169.3	0	111.2	H332 L374 E410 A415 D416 V417	H332-K413 HydrophobicContact CB-CD 3.94Å; H332-K413 HydrophobicContact CB-CG 4.21Å; H332-K413 PolarHBondContact CE1-O 3.17Å; H332-K413 WeakPolarHBondContact O-CE 3.32Å; H332-K413 PolarHBondContact O-NZ 3.2Å; L374-K413 HydrophobicContact CD1-CD 4.48Å; L374-K413 HydrophobicContact CD1-CG 3.96Å; E410-K413 WeakPolarHBondContact O-CB 3.4Å; E410-K413 PolarHBondContact O-N 2.92Å; E410-K413 VanDerWaalsContact OE1-CD 3.29Å; E410-K413 WeakPolarHBondContact OE1-CD 3.34Å; E410-K413 IonicContact OE1-NZ 3.52Å; E410-K413 VanDerWaalsContact OE2-CD 3.31Å; E410-K413 WeakPolarHBondContact OE2-CD 3.45Å; E410-K413 IonicContact OE2-NZ 2.74Å; E410-K413 PolarHBondContact OE2-NZ 3.5Å; K413-A415 VanDerWaalsContact C-N 3.27Å; K413-A415 PolarHBondContact O-N 3.15Å; K413-D416 WeakPolarHBondContact O-CB 3.43Å; K413-D416 PolarHBondContact O-N 3.37Å; K413-D416 VanDerWaalsContact O-N 3.15Å; K413-V417 WeakPolarHBondContact O-CG2 3.36Å; K413-V417 PolarHBondContact O-N 2.87Å
414	Q	97.8	Very high	92.3	Very high	15 Å²	15	27 Å²	27	7%	0.07	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-35.6	175.2	-69.1	161.5	-22.6	0	0	111.6	E410 S411 V417 Y418 P494 E495 R497	E410-Q414 HydrophobicContact CG-CG 4.42Å; E410-Q414 WeakPolarHBondContact O-CG 3.11Å; E410-Q414 PolarHBondContact O-N 3.13Å; S411-Q414 VanDerWaalsContact CA-OE1 3.32Å; Q414-V417 PolarHBondContact O-N 3.12Å; Q414-Y418 PolarHBondContact O-N 3.2Å; Q414-Y418 VanDerWaalsContact O-N 3.13Å; Q414-P494 HydrophobicContact CB-CB 3.83Å; Q414-P494 VanDerWaalsContact CD-O 3.24Å; Q414-P494 HydrophobicContact CG-CB 4.32Å; Q414-P494 VanDerWaalsContact CG-O 3.31Å; Q414-P494 WeakPolarHBondContact CG-O 3.3Å; Q414-P494 PolarHBondContact NE2-O 2.82Å; Q414-E495 VanDerWaalsContact NE2-CD 3.32Å; Q414-E495 PolarHBondContact NE2-OE1 2.99Å; Q414-E495 PolarHBondContact NE2-OE2 3.48Å; Q414-R497 VanDerWaalsContact C-NH1 3.31Å; Q414-R497 PolarHBondContact O-NH1 2.91Å
415	A	97.4	Very high	93.1	Very high	10 Å²	10	27.5 Å²	27.5	8%	0.083	14%	0.137	C	C	.	.	H	α-helix	trans	-68.4	-38.2	173.7	0	0	0	0	0	113	A396 V399 S411 F412 K413 V417 Y418 S419	A396-A415 HydrophobicContact CB-CB 4.01Å; V399-A415 HydrophobicContact CG2-CB 3.77Å; S411-A415 PolarHBondContact O-N 2.79Å; S411-A415 VanDerWaalsContact O-N 3.13Å; F412-A415 PolarHBondContact O-N 2.61Å; K413-A415 VanDerWaalsContact C-N 3.27Å; K413-A415 PolarHBondContact O-N 3.15Å; A415-V417 VanDerWaalsContact C-N 3.35Å; A415-Y418 PolarHBondContact O-N 3.19Å; A415-S419 PolarHBondContact O-N 3.1Å; A415-S419 VanDerWaalsContact O-N 3.14Å; A415-S419 PolarHBondContact O-OG 2.84Å
416	D	98.5	Very high	93.9	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-62.5	-41	171.6	-85	-10.5	0	0	0	111.5	H332 A346 H347 R348 I350 F412 K413 Y418 S419 M420	H332-D416 IonicContact CD2-OD2 2.69Å; H332-D416 IonicContact CE1-OD2 2.69Å; H332-D416 WeakPolarHBondContact NE2-CB 3.13Å; H332-D416 IonicContact NE2-OD2 3.98Å; H332-D416 PolarHBondContact NE2-OD2 3.18Å; A346-D416 WeakPolarHBondContact CA-OD2 3.33Å; H347-D416 PolarHBondContact N-OD2 3.44Å; R348-D416 WeakPolarHBondContact CA-OD1 3.44Å; R348-D416 PolarHBondContact N-OD1 3.19Å; I350-D416 HydrophobicContact CD1-CB 3.69Å; F412-D416 PolarHBondContact O-N 3.07Å; K413-D416 WeakPolarHBondContact O-CB 3.43Å; K413-D416 PolarHBondContact O-N 3.37Å; K413-D416 VanDerWaalsContact O-N 3.15Å; D416-Y418 PolarHBondContact O-N 3.22Å; D416-S419 WeakPolarHBondContact O-CB 3.28Å; D416-S419 PolarHBondContact O-N 3.03Å; D416-M420 WeakPolarHBondContact O-CB 3.49Å; D416-M420 PolarHBondContact O-N 3.12Å
417	V	98.8	Very high	94.8	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.018	11%	0.105	C	C	.	.	H	α-helix	trans	-60.6	-44.7	176.4	168.4	0	0	0	0	111.3	K413 Q414 A415 S419 M420 A421 C489 R497 L498 I503	K413-V417 WeakPolarHBondContact O-CG2 3.36Å; K413-V417 PolarHBondContact O-N 2.87Å; Q414-V417 PolarHBondContact O-N 3.12Å; A415-V417 VanDerWaalsContact C-N 3.35Å; V417-S419 VanDerWaalsContact C-N 3.3Å; V417-S419 PolarHBondContact O-N 3.19Å; V417-M420 WeakPolarHBondContact O-CB 3.44Å; V417-M420 PolarHBondContact O-N 3.45Å; V417-A421 PolarHBondContact O-N 3.21Å; V417-C489 HydrophobicContact CG1-CB 3.68Å; V417-R497 HydrophobicContact CG1-CB 4.27Å; V417-L498 VanDerWaalsContact CG1-O 3.3Å; V417-L498 WeakPolarHBondContact CG1-O 3.29Å; V417-I503 HydrophobicContact CG1-CD1 4.25Å
418	Y	98.8	Very high	95.9	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-57.2	-46.5	175	177.3	-84.6	0	0	0	111.3	M395 A396 P397 Q414 A415 D416 M420 A421 L422 W490	M395-Y418 WeakPolarHBondContact O-CE1 3.15Å; A396-Y418 VanDerWaalsContact CA-CD1 3.46Å; A396-Y418 HydrophobicContact CB-CD1 3.84Å; A396-Y418 HydrophobicContact CB-CD2 4.39Å; A396-Y418 HydrophobicContact CB-CG 3.74Å; P397-Y418 HydrophobicContact CG-CE2 4.19Å; Q414-Y418 PolarHBondContact O-N 3.2Å; Q414-Y418 VanDerWaalsContact O-N 3.13Å; A415-Y418 PolarHBondContact O-N 3.19Å; D416-Y418 PolarHBondContact O-N 3.22Å; Y418-M420 VanDerWaalsContact C-N 3.34Å; Y418-M420 PolarHBondContact O-N 3.36Å; Y418-A421 WeakPolarHBondContact O-CB 3.45Å; Y418-A421 PolarHBondContact O-N 3.2Å; Y418-L422 HydrophobicContact CD1-CD1 4.16Å; Y418-L422 HydrophobicContact CE1-CD1 3.6Å; Y418-L422 HydrophobicContact CE1-CG 4.18Å; Y418-L422 PolarHBondContact O-N 3.25Å; Y418-W490 HydrophobicContact CD2-CB 3.84Å; Y418-W490 HydrophobicContact CE2-CB 3.81Å
419	S	98.8	Very high	96.6	Very high	9 Å²	9	10.7 Å²	10.7	6%	0.063	6%	0.055	C	C	.	.	H	α-helix	trans	-63.4	-40.8	179.1	-54.3	0	0	0	0	111.6	I350 Y394 A415 D416 V417 L422 V423	I350-S419 WeakPolarHBondContact O-CB 3.4Å; Y394-S419 PolarHBondContact O-OG 2.81Å; Y394-S419 VanDerWaalsContact O-OG 3.05Å; A415-S419 PolarHBondContact O-N 3.1Å; A415-S419 VanDerWaalsContact O-N 3.14Å; A415-S419 PolarHBondContact O-OG 2.84Å; D416-S419 WeakPolarHBondContact O-CB 3.28Å; D416-S419 PolarHBondContact O-N 3.03Å; V417-S419 VanDerWaalsContact C-N 3.3Å; V417-S419 PolarHBondContact O-N 3.19Å; S419-L422 PolarHBondContact O-N 2.83Å; S419-V423 PolarHBondContact O-N 3.45Å
420	M	98.9	Very high	97.4	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-63.1	-39	175.1	-177.4	174.4	66.1	0	0	112	L324 V328 D416 V417 Y418 L422 V423 L424 A500 I503	L324-M420 HydrophobicContact CD2-CG 3.89Å; L324-M420 HydrophobicContact CG-CG 3.93Å; L324-M420 HydrophobicContact CG-SD 4.14Å; V328-M420 HydrophobicContact CB-SD 3.8Å; V328-M420 HydrophobicContact CG1-SD 4.21Å; V328-M420 HydrophobicContact CG2-SD 3.64Å; D416-M420 WeakPolarHBondContact O-CB 3.49Å; D416-M420 PolarHBondContact O-N 3.12Å; V417-M420 WeakPolarHBondContact O-CB 3.44Å; V417-M420 PolarHBondContact O-N 3.45Å; Y418-M420 VanDerWaalsContact C-N 3.34Å; Y418-M420 PolarHBondContact O-N 3.36Å; M420-L422 VanDerWaalsContact C-N 3.29Å; M420-L422 PolarHBondContact O-N 3.04Å; M420-V423 PolarHBondContact O-N 3.3Å; M420-V423 VanDerWaalsContact O-N 3.12Å; M420-L424 HydrophobicContact CG-CD1 4.33Å; M420-L424 HydrophobicContact CG-CG 4.39Å; M420-L424 WeakPolarHBondContact O-CG 3.46Å; M420-L424 PolarHBondContact O-N 3.31Å; M420-A500 HydrophobicContact CE-CB 4.06Å; M420-I503 HydrophobicContact CE-CB 4.48Å; M420-I503 HydrophobicContact CE-CD1 3.29Å; M420-I503 HydrophobicContact CE-CG1 4.48Å; M420-I503 HydrophobicContact CE-CG2 4.48Å
421	A	98.9	Very high	97.8	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-59.5	-40.6	176.7	0	0	0	0	0	112.1	V417 Y418 V423 L424 W425 I486 C489 W490	V417-A421 PolarHBondContact O-N 3.21Å; Y418-A421 WeakPolarHBondContact O-CB 3.45Å; Y418-A421 PolarHBondContact O-N 3.2Å; A421-V423 VanDerWaalsContact C-N 3.35Å; A421-L424 PolarHBondContact O-N 3.05Å; A421-W425 PolarHBondContact O-N 3.25Å; A421-I486 HydrophobicContact CB-CG2 4.29Å; A421-C489 HydrophobicContact CB-CB 3.51Å; A421-W490 HydrophobicContact CB-CB 4Å
422	L	98.9	Very high	98.1	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.5	-40.3	174.8	-63.4	176.4	0	0	0	111.8	Y394 Y418 S419 M420 W425 E426 P443 F444 P467 W490	Y394-L422 HydrophobicContact CD1-CB 4.06Å; Y394-L422 HydrophobicContact CD1-CD1 4.01Å; Y394-L422 HydrophobicContact CE1-CB 4.31Å; Y394-L422 HydrophobicContact CG-CD1 4.49Å; Y418-L422 HydrophobicContact CD1-CD1 4.16Å; Y418-L422 HydrophobicContact CE1-CD1 3.6Å; Y418-L422 HydrophobicContact CE1-CG 4.18Å; Y418-L422 PolarHBondContact O-N 3.25Å; S419-L422 PolarHBondContact O-N 2.83Å; M420-L422 VanDerWaalsContact C-N 3.29Å; M420-L422 PolarHBondContact O-N 3.04Å; L422-W425 WeakPolarHBondContact O-CB 3.45Å; L422-W425 PolarHBondContact O-N 3.41Å; L422-E426 WeakPolarHBondContact O-CG 3.43Å; L422-E426 PolarHBondContact O-N 2.03Å; L422-P443 HydrophobicContact CB-CB 4.3Å; L422-P443 HydrophobicContact CB-CG 3.95Å; L422-P443 HydrophobicContact CD2-CB 4.15Å; L422-F444 HydrophobicContact CD1-CE2 4.35Å; L422-F444 HydrophobicContact CD2-CE2 4.06Å; L422-F444 HydrophobicContact CD2-CZ 4.47Å; L422-P467 HydrophobicContact CD2-CG 3.73Å; L422-W490 HydrophobicContact CD2-CE3 3.97Å; L422-W490 HydrophobicContact CD2-CZ3 4.37Å
423	V	98.9	Very high	98.1	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-67.9	-41.3	176	178.4	0	0	0	0	111.7	L303 L324 I350 I355 Y394 S419 M420 A421 W425 E426 I427	L303-V423 HydrophobicContact CD2-CG1 3.64Å; L324-V423 HydrophobicContact CD2-CB 4Å; L324-V423 HydrophobicContact CD2-CG1 3.61Å; I350-V423 HydrophobicContact CG2-CG2 4.32Å; I355-V423 HydrophobicContact CD1-CB 4.41Å; I355-V423 HydrophobicContact CD1-CG1 3.65Å; I355-V423 HydrophobicContact CD1-CG2 4.17Å; Y394-V423 HydrophobicContact CE1-CG2 4.22Å; S419-V423 PolarHBondContact O-N 3.45Å; M420-V423 PolarHBondContact O-N 3.3Å; M420-V423 VanDerWaalsContact O-N 3.12Å; A421-V423 VanDerWaalsContact C-N 3.35Å; V423-W425 VanDerWaalsContact C-N 3.25Å; V423-W425 PolarHBondContact O-N 3.13Å; V423-E426 WeakPolarHBondContact O-CB 3.25Å; V423-E426 PolarHBondContact O-N 2.01Å; V423-E426 VanDerWaalsContact O-N 3.09Å; V423-I427 HydrophobicContact CG1-CD1 4.27Å; V423-I427 WeakPolarHBondContact O-CG1 3.18Å; V423-I427 PolarHBondContact O-N 3.4Å
424	L	98.8	Very high	98.1	Very high	3 Å²	3	9.9 Å²	9.9	2%	0.016	6%	0.062	C	C	.	.	H	α-helix	trans	-60	-38.9	174.4	-70.2	174.4	0	0	0	111.1	L324 M420 A421 I427 I428 I486 I503 F507	L324-L424 HydrophobicContact CD2-CD2 4.26Å; L324-L424 HydrophobicContact CD2-CG 4.47Å; M420-L424 HydrophobicContact CG-CD1 4.33Å; M420-L424 HydrophobicContact CG-CG 4.39Å; M420-L424 WeakPolarHBondContact O-CG 3.46Å; M420-L424 PolarHBondContact O-N 3.31Å; A421-L424 PolarHBondContact O-N 3.05Å; L424-I427 HydrophobicContact CD2-CD1 4.38Å; L424-I427 PolarHBondContact O-N 2.84Å; L424-I428 WeakPolarHBondContact O-CG1 3.35Å; L424-I428 PolarHBondContact O-N 2.99Å; L424-I486 HydrophobicContact CB-CD1 3.74Å; L424-I486 HydrophobicContact CB-CG1 3.78Å; L424-I486 HydrophobicContact CD1-CG1 4.39Å; L424-I503 HydrophobicContact CD1-CG2 4.25Å; L424-F507 HydrophobicContact CD1-CE2 4.46Å; L424-F507 HydrophobicContact CD2-CE2 4.15Å; L424-F507 HydrophobicContact CD2-CZ 4.01Å
425	W	98.7	Very high	97.9	Very high	27 Å²	27	11.7 Å²	11.7	10%	0.102	8%	0.084	C	C	.	.	H	α-helix	trans	-61.5	-42.2	172.5	175.6	91	0	0	0	112.1	A421 L422 V423 I427 I428 S429 P443 P467 E468 W473 I486 W490	A421-W425 PolarHBondContact O-N 3.25Å; L422-W425 WeakPolarHBondContact O-CB 3.45Å; L422-W425 PolarHBondContact O-N 3.41Å; V423-W425 VanDerWaalsContact C-N 3.25Å; V423-W425 PolarHBondContact O-N 3.13Å; W425-I427 VanDerWaalsContact C-N 3.33Å; W425-I427 PolarHBondContact O-N 3.19Å; W425-I428 PolarHBondContact O-N 2.86Å; W425-S429 WeakPolarHBondContact O-CB 3.27Å; W425-S429 PolarHBondContact O-N 2.85Å; W425-P443 HydrophobicContact CE3-CG 4.27Å; W425-P443 HydrophobicContact CZ3-CG 4.42Å; W425-P467 HydrophobicContact CD2-CB 3.41Å; W425-P467 VanDerWaalsContact CD2-CB 3.41Å; W425-P467 HydrophobicContact CD2-CG 4.16Å; W425-P467 HydrophobicContact CE3-CB 3.87Å; W425-P467 HydrophobicContact CE3-CG 4.29Å; W425-P467 HydrophobicContact CG-CB 3.87Å; W425-P467 HydrophobicContact CH2-CB 4.04Å; W425-P467 HydrophobicContact CZ2-CB 3.58Å; W425-P467 HydrophobicContact CZ3-CB 4.16Å; W425-E468 PolarHBondContact NE1-O 3.33Å; W425-W473 AromaticContact CD1-CZ3 3.94Å; W425-W473 HydrophobicContact CZ2-CH2 4.36Å; W425-W473 AromaticContact NE1-CH2 3.7Å; W425-W473 AromaticContact NE1-CZ3 3.7Å; W425-I486 HydrophobicContact CB-CD1 4.22Å; W425-W490 HydrophobicContact CB-CZ3 4.1Å; W425-W490 AromaticContact CD1-CH2 3.98Å; W425-W490 HydrophobicContact CG-CH2 4.49Å; W425-W490 HydrophobicContact CG-CZ3 4.18Å
426	E	98.7	Very high	97.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.2	-44.3	175.1	-68.1	174.1	-100.5	0	0	111.6	L307 S352 Y394 L422 V423 S429 Y440 P443	L307-E426 HydrophobicContact CD1-CB 4.02Å; S352-E426 VanDerWaalsContact CB-OE2 3.26Å; S352-E426 WeakPolarHBondContact CB-OE2 3.36Å; S352-E426 PolarHBondContact OG-OE1 2.93Å; S352-E426 PolarHBondContact OG-OE2 3.33Å; Y394-E426 WeakPolarHBondContact CE1-OE1 3.36Å; Y394-E426 PolarHBondContact OH-OE1 2.97Å; L422-E426 WeakPolarHBondContact O-CG 3.43Å; L422-E426 PolarHBondContact O-N 2.03Å; V423-E426 WeakPolarHBondContact O-CB 3.25Å; V423-E426 PolarHBondContact O-N 2.01Å; V423-E426 VanDerWaalsContact O-N 3.09Å; E426-S429 PolarHBondContact O-N 3.42Å; E426-S429 PolarHBondContact O-OG 2.84Å; E426-Y440 HydrophobicContact CB-CE2 4.3Å; E426-Y440 HydrophobicContact CG-CE2 4.32Å; E426-Y440 PolarHBondContact OE2-OH 3.43Å; E426-P443 HydrophobicContact CG-CG 3.74Å
427	I	98.7	Very high	97.6	Very high	3 Å²	3	20.8 Å²	20.8	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-60.6	-49.4	177.4	-63.5	167.3	0	0	0	110.2	L303 L307 I312 L317 L320 V423 L424 W425 S429 R430	L303-I427 HydrophobicContact CD1-CG1 4.48Å; L303-I427 HydrophobicContact CD2-CD1 3.99Å; L303-I427 HydrophobicContact CD2-CG1 3.95Å; L307-I427 HydrophobicContact CD1-CG1 4.19Å; I312-I427 HydrophobicContact CD1-CG2 3.56Å; L317-I427 HydrophobicContact CB-CG2 4.07Å; L317-I427 HydrophobicContact CG-CG2 3.84Å; L320-I427 HydrophobicContact CB-CD1 4.04Å; L320-I427 HydrophobicContact CB-CG2 4.33Å; L320-I427 HydrophobicContact CD1-CG2 4.44Å; V423-I427 HydrophobicContact CG1-CD1 4.27Å; V423-I427 WeakPolarHBondContact O-CG1 3.18Å; V423-I427 PolarHBondContact O-N 3.4Å; L424-I427 HydrophobicContact CD2-CD1 4.38Å; L424-I427 PolarHBondContact O-N 2.84Å; W425-I427 VanDerWaalsContact C-N 3.33Å; W425-I427 PolarHBondContact O-N 3.19Å; I427-S429 VanDerWaalsContact C-N 3.32Å; I427-S429 PolarHBondContact O-N 2.84Å; I427-R430 PolarHBondContact O-N 2.04Å
428	I	97.9	Very high	97.4	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-59.5	-42.9	177.7	-64.5	172.4	0	0	0	111.4	L317 L424 W425 R430 C431 I434 W473 I479 V482 I486	L317-I428 HydrophobicContact CD1-CB 4.36Å; L317-I428 HydrophobicContact CD1-CG1 3.88Å; L424-I428 WeakPolarHBondContact O-CG1 3.35Å; L424-I428 PolarHBondContact O-N 2.99Å; W425-I428 PolarHBondContact O-N 2.86Å; I428-R430 PolarHBondContact O-N 3.44Å; I428-C431 WeakPolarHBondContact O-CB 3.48Å; I428-C431 PolarHBondContact O-N 3.09Å; I428-I434 HydrophobicContact CG2-CG2 3.88Å; I428-W473 HydrophobicContact CB-CE3 4.45Å; I428-W473 HydrophobicContact CB-CZ3 4.19Å; I428-W473 HydrophobicContact CG2-CD2 4.18Å; I428-W473 HydrophobicContact CG2-CE3 3.41Å; I428-W473 VanDerWaalsContact CG2-CE3 3.41Å; I428-W473 HydrophobicContact CG2-CZ3 3.62Å; I428-I479 HydrophobicContact CG2-CG2 3.86Å; I428-V482 HydrophobicContact CD1-CB 4.05Å; I428-V482 HydrophobicContact CD1-CG1 3.71Å; I428-V482 HydrophobicContact CG1-CG1 4.3Å; I428-I486 HydrophobicContact CD1-CD1 3.32Å; I428-I486 HydrophobicContact CG1-CD1 4.39Å
429	S	97.7	Very high	97.3	Very high	13 Å²	13	36 Å²	36	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-59.4	-16	-175.9	79.3	0	0	0	0	114.1	W425 E426 I427 V437	W425-S429 WeakPolarHBondContact O-CB 3.27Å; W425-S429 PolarHBondContact O-N 2.85Å; E426-S429 PolarHBondContact O-N 3.42Å; E426-S429 PolarHBondContact O-OG 2.84Å; I427-S429 VanDerWaalsContact C-N 3.32Å; I427-S429 PolarHBondContact O-N 2.84Å; S429-V437 WeakPolarHBondContact O-CG1 3.31Å
430	R	98.3	Very high	97.3	Very high	18 Å²	18	37 Å²	37	7%	0.068	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	7.5	179.4	-60.4	-59.9	-66.9	148.5	5.2	113.7	L307 H310 I311 I312 I427 I428 K438 Y440	L307-R430 HydrophobicContact CB-CG 4.11Å; L307-R430 HydrophobicContact CD2-CB 4.01Å; L307-R430 HydrophobicContact CD2-CG 4.32Å; L307-R430 PolarHBondContact O-NE 3.22Å; H310-R430 PolarHBondContact O-NE 2.03Å; H310-R430 PolarHBondContact O-NH2 3.01Å; I311-R430 CarbonylContact C-O 3.56Å; I311-R430 WeakPolarHBondContact CA-O 3.49Å; I311-R430 VanDerWaalsContact CG1-NH2 3.28Å; I311-R430 WeakPolarHBondContact CG2-O 3.49Å; I312-R430 WeakPolarHBondContact CG1-O 3.34Å; I312-R430 PolarHBondContact N-O 3.24Å; I427-R430 PolarHBondContact O-N 2.04Å; I428-R430 PolarHBondContact O-N 3.44Å; R430-K438 PolarHBondContact NH1-O 3.44Å; R430-Y440 HydrophobicContact CG-CD2 4.14Å
431	C	97.8	Very high	97.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-85.7	127.6	178.6	-177.3	0	0	0	0	111.8	I312 L317 I428 A433 I434 V437	I312-C431 HydrophobicContact CG1-CB 4.16Å; I312-C431 WeakPolarHBondContact O-CA 3.49Å; L317-C431 HydrophobicContact CB-CB 4.48Å; L317-C431 HydrophobicContact CD1-CB 3.61Å; I428-C431 WeakPolarHBondContact O-CB 3.48Å; I428-C431 PolarHBondContact O-N 3.09Å; C431-A433 PolarHBondContact O-N 2.83Å; C431-I434 HydrophobicContact CB-CG2 4.39Å; C431-I434 WeakPolarHBondContact O-CD1 3.19Å; C431-I434 WeakPolarHBondContact O-CG1 3.4Å; C431-I434 PolarHBondContact O-N 2.72Å; C431-V437 WeakPolarHBondContact O-CG2 3.48Å
432	S	96.8	Very high	97	Very high	62 Å²	62	44.4 Å²	44.4	43%	0.434	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-60.1	-24	177.4	49.5	0	0	0	0	114.3	I312 I434 G435	I312-S432 PolarHBondContact O-N 3.23Å; I312-S432 PolarHBondContact O-OG 2.92Å; S432-I434 PolarHBondContact O-N 3.5Å; S432-G435 PolarHBondContact O-N 3.31Å
433	A	95	Very high	96.9	Very high	35 Å²	35	44.4 Å²	44.4	29%	0.289	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-70	-11.6	179.1	0	0	0	0	0	113.7	W314 C431 G435 I479	W314-A433 HydrophobicContact CB-CB 4.18Å; C431-A433 PolarHBondContact O-N 2.83Å; A433-G435 PolarHBondContact O-N 3.33Å; A433-I479 VanDerWaalsContact C-CD1 3.47Å; A433-I479 HydrophobicContact CB-CD1 3.5Å; A433-I479 VanDerWaalsContact CB-CD1 3.5Å
434	I	95.5	Very high	96.7	Very high	8 Å²	8	45.1 Å²	45.1	4%	0.041	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-79.8	-3.1	173.5	80.2	-162.6	0	0	0	113.3	I428 C431 S432 V437 W473 I479	I428-I434 HydrophobicContact CG2-CG2 3.88Å; C431-I434 HydrophobicContact CB-CG2 4.39Å; C431-I434 WeakPolarHBondContact O-CD1 3.19Å; C431-I434 WeakPolarHBondContact O-CG1 3.4Å; C431-I434 PolarHBondContact O-N 2.72Å; S432-I434 PolarHBondContact O-N 3.5Å; I434-V437 HydrophobicContact CD1-CG1 4.45Å; I434-V437 HydrophobicContact CD1-CG2 4.2Å; I434-V437 HydrophobicContact CG1-CG2 4.15Å; I434-W473 HydrophobicContact CB-CB 4.24Å; I434-W473 HydrophobicContact CB-CD2 4.39Å; I434-W473 HydrophobicContact CB-CG 3.85Å; I434-W473 HydrophobicContact CD1-CD2 4.42Å; I434-W473 HydrophobicContact CD1-CZ2 4.13Å; I434-W473 HydrophobicContact CG2-CB 4.19Å; I434-W473 HydrophobicContact CG2-CD2 4.2Å; I434-W473 HydrophobicContact CG2-CG 3.96Å; I434-I479 HydrophobicContact CB-CD1 4.45Å; I434-I479 HydrophobicContact CG2-CD1 3.56Å; I434-I479 HydrophobicContact CG2-CG2 4.28Å
435	G	93.5	Very high	96.2	Very high	52 Å²	52	46.3 Å²	46.3	54%	0.536	25%	0.25	S	S	.	.	S	Bend	trans	89.9	-117.8	-174.8	0	0	0	0	0	112.3	S432 A433 V437	S432-G435 PolarHBondContact O-N 3.31Å; A433-G435 PolarHBondContact O-N 3.33Å; G435-V437 PolarHBondContact O-N 2.85Å
436	E	93.8	Very high	95.5	Very high	174 Å²	174	51.8 Å²	51.8	81%	0.813	28%	0.281	S	S	*	.	S	Bend	trans	-72.5	110.9	179.8	-170.7	-175.7	171.5	0	0	111
437	V	96.8	Very high	94.9	Very high	29 Å²	29	53.7 Å²	53.7	18%	0.176	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-92.6	117.6	-178.4	-169	0	0	0	0	110.5	I311 S429 C431 I434 G435	I311-V437 HydrophobicContact CD1-CB 4.22Å; I311-V437 HydrophobicContact CD1-CG1 4.46Å; I311-V437 HydrophobicContact CG1-CG1 4.26Å; I311-V437 HydrophobicContact CG2-CB 4.44Å; I311-V437 HydrophobicContact CG2-CG1 4.38Å; I311-V437 HydrophobicContact CG2-CG2 4.01Å; S429-V437 WeakPolarHBondContact O-CG1 3.31Å; C431-V437 WeakPolarHBondContact O-CG2 3.48Å; I434-V437 HydrophobicContact CD1-CG1 4.45Å; I434-V437 HydrophobicContact CD1-CG2 4.2Å; I434-V437 HydrophobicContact CG1-CG2 4.15Å; G435-V437 PolarHBondContact O-N 2.85Å
438	K	95.1	Very high	94	Very high	151 Å²	151	63.6 Å²	63.6	66%	0.657	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-78	160.5	176.1	-63.9	178.1	-176.9	171.6	0	111.4	R430	R430-K438 PolarHBondContact NH1-O 3.44Å
439	E	96.3	Very high	93.1	Very high	171 Å²	171	71.1 Å²	71.1	80%	0.799	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-51.3	143.1	170.3	-69.7	-178.6	172.5	0	0	111.7	K441	E439-K441 PolarHBondContact O-N 2.93Å
440	Y	97.3	Very high	92.5	Very high	29 Å²	29	78.2 Å²	78.2	11%	0.114	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-57.8	134.2	178.2	172.1	-95.1	0	0	0	110.9	Q304 L307 T308 E426 R430	Q304-Y440 HydrophobicContact CG-CE1 3.92Å; Q304-Y440 WeakPolarHBondContact CG-OH 3.34Å; L307-Y440 HydrophobicContact CB-CD2 3.88Å; L307-Y440 HydrophobicContact CB-CE2 4.11Å; L307-Y440 HydrophobicContact CD1-CE2 4.45Å; T308-Y440 WeakPolarHBondContact OG1-CD1 3.4Å; E426-Y440 HydrophobicContact CB-CE2 4.3Å; E426-Y440 HydrophobicContact CG-CE2 4.32Å; E426-Y440 PolarHBondContact OE2-OH 3.43Å; R430-Y440 HydrophobicContact CG-CD2 4.14Å
441	K	95.8	Very high	92	Very high	124 Å²	124	78 Å²	78	54%	0.539	40%	0.396	S	S	.	.			trans	-134.6	139.6	167.7	-67.2	-173.7	-179.8	-176.9	0	108.3	E439	E439-K441 PolarHBondContact O-N 2.93Å
442	P	96.3	Very high	91.7	Very high	32 Å²	32	81.8 Å²	81.8	21%	0.208	42%	0.421	C	S	.	.			trans	-64.1	161.9	171.5	31	-36.3	0	0	0	110	F444 G445	P442-F444 PolarHBondContact O-N 2.87Å; P442-G445 WeakPolarHBondContact O-CA 3.29Å; P442-G445 PolarHBondContact O-N 3.35Å
443	P	97	Very high	91.5	Very high	0 Å²	0	80.6 Å²	80.6	0%	0	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	133.7	176	-25.4	34.6	0	0	0	110.6	R393 Y394 L422 W425 E426 G445 P467	R393-P443 WeakPolarHBondContact CD-O 3.39Å; R393-P443 VanDerWaalsContact CG-O 3.28Å; R393-P443 WeakPolarHBondContact CG-O 3.26Å; R393-P443 PolarHBondContact NH1-O 3.14Å; Y394-P443 HydrophobicContact CE1-CG 3.9Å; L422-P443 HydrophobicContact CB-CB 4.3Å; L422-P443 HydrophobicContact CB-CG 3.95Å; L422-P443 HydrophobicContact CD2-CB 4.15Å; W425-P443 HydrophobicContact CE3-CG 4.27Å; W425-P443 HydrophobicContact CZ3-CG 4.42Å; E426-P443 HydrophobicContact CG-CG 3.74Å; P443-G445 VanDerWaalsContact C-N 3.28Å; P443-G445 PolarHBondContact O-N 2.76Å; P443-P467 HydrophobicContact CB-CG 3.95Å
444	F	95.6	Very high	91.3	Very high	15 Å²	15	84.1 Å²	84.1	7%	0.066	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	36.1	-172.4	-43.6	-84	0	0	0	113.5	R393 L422 P442 N446 L447 M456 V460 P467	R393-F444 HydrophobicContact CG-CD2 4.45Å; R393-F444 VanDerWaalsContact NH1-C 3.34Å; R393-F444 PolarHBondContact NH1-O 3.28Å; L422-F444 HydrophobicContact CD1-CE2 4.35Å; L422-F444 HydrophobicContact CD2-CE2 4.06Å; L422-F444 HydrophobicContact CD2-CZ 4.47Å; P442-F444 PolarHBondContact O-N 2.87Å; F444-N446 VanDerWaalsContact C-OD1 3.25Å; F444-N446 WeakPolarHBondContact CA-OD1 3.4Å; F444-N446 PolarHBondContact O-N 2.8Å; F444-N446 PolarHBondContact O-OD1 3.31Å; F444-L447 HydrophobicContact CB-CD1 3.77Å; F444-L447 HydrophobicContact CB-CG 4.15Å; F444-L447 VanDerWaalsContact O-CB 3.32Å; F444-L447 WeakPolarHBondContact O-CB 3.45Å; F444-L447 PolarHBondContact O-N 3.4Å; F444-M456 HydrophobicContact CD2-CE 3.67Å; F444-M456 HydrophobicContact CE2-CE 3.87Å; F444-M456 HydrophobicContact CG-CE 4.14Å; F444-M456 HydrophobicContact CZ-CE 4.5Å; F444-V460 HydrophobicContact CE1-CG2 4.09Å; F444-V460 HydrophobicContact CE2-CG2 4.23Å; F444-V460 HydrophobicContact CZ-CG2 3.72Å; F444-P467 HydrophobicContact CE2-CG 4.42Å; F444-P467 HydrophobicContact CZ-CG 4.39Å
445	G	86.9	Confident	91.2	Very high	29 Å²	29	85.5 Å²	85.5	30%	0.299	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-1.9	-179.3	0	0	0	0	0	115.3	P442 P443 L447	P442-G445 WeakPolarHBondContact O-CA 3.29Å; P442-G445 PolarHBondContact O-N 3.35Å; P443-G445 VanDerWaalsContact C-N 3.28Å; P443-G445 PolarHBondContact O-N 2.76Å; G445-L447 VanDerWaalsContact C-N 3.29Å
446	N	85.4	Confident	91.3	Very high	141 Å²	141	83 Å²	83	75%	0.754	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-16.4	165.9	60.8	-36.3	0	0	0	112.9	F444	F444-N446 VanDerWaalsContact C-OD1 3.25Å; F444-N446 WeakPolarHBondContact CA-OD1 3.4Å; F444-N446 PolarHBondContact O-N 2.8Å; F444-N446 PolarHBondContact O-OD1 3.31Å
447	L	84.8	Confident	91.4	Very high	40 Å²	40	77.5 Å²	77.5	21%	0.209	38%	0.38	C	S	.	.	S	Bend	trans	-81.3	175.1	171.6	-57.1	178.7	0	0	0	111	F444 G445 P451 M456	F444-L447 HydrophobicContact CB-CD1 3.77Å; F444-L447 HydrophobicContact CB-CG 4.15Å; F444-L447 VanDerWaalsContact O-CB 3.32Å; F444-L447 WeakPolarHBondContact O-CB 3.45Å; F444-L447 PolarHBondContact O-N 3.4Å; G445-L447 VanDerWaalsContact C-N 3.29Å; L447-P451 HydrophobicContact CB-CB 4.47Å; L447-P451 HydrophobicContact CD1-CB 4.38Å; L447-M456 HydrophobicContact CD1-SD 3.58Å; L447-M456 VanDerWaalsContact CD1-SD 3.58Å
448	R	81.1	Confident	91.2	Very high	212 Å²	212	78.8 Å²	78.8	80%	0.8	39%	0.386	S	S	*	.			trans	-55.7	155.6	171	-61.5	-177.6	-177.2	-176.3	0.8	110.8	R393 H450 P451	R393-R448 PolarHBondContact NH2-O 2.93Å; R448-H450 VanDerWaalsContact C-N 3.29Å; R448-H450 PolarHBondContact O-N 2.72Å; R448-P451 WeakPolarHBondContact O-CD 3.39Å
449	E	78.8	Confident	91.2	Very high	158 Å²	158	72.6 Å²	72.6	74%	0.738	36%	0.361	S	S	*	.	S	Bend	trans	-56.5	-41.7	-179.5	-173	171.3	-169.9	0	0	112.6	R393 P451	R393-E449 PolarHBondContact NH2-O 3.19Å; E449-P451 WeakPolarHBondContact O-CD 3.18Å
450	H	84.3	Confident	91.2	Very high	162 Å²	162	64.4 Å²	64.4	75%	0.75	32%	0.323	S	S	*	.	S	Bend	trans	-117.7	85.7	172.9	-58.5	-53.2	0	0	0	110.1	R448	R448-H450 VanDerWaalsContact C-N 3.29Å; R448-H450 PolarHBondContact O-N 2.72Å
451	P	88.9	Confident	91.1	Very high	15 Å²	15	64 Å²	64	10%	0.097	32%	0.323	C	S	.	.			trans	-70.8	137.7	-179.1	30.1	-33.1	0	0	0	109.5	A392 R393 L447 R448 E449 M456	A392-P451 WeakPolarHBondContact CB-O 3.46Å; R393-P451 HydrophobicContact CB-CG 4.03Å; L447-P451 HydrophobicContact CB-CB 4.47Å; L447-P451 HydrophobicContact CD1-CB 4.38Å; R448-P451 WeakPolarHBondContact O-CD 3.39Å; E449-P451 WeakPolarHBondContact O-CD 3.18Å; P451-M456 HydrophobicContact CB-CG 4Å; P451-M456 HydrophobicContact CB-SD 3.85Å; P451-M456 HydrophobicContact CG-CG 4.07Å; P451-M456 HydrophobicContact CG-SD 3.72Å
452	C	90.9	Very high	91	Very high	78 Å²	78	65 Å²	65	53%	0.527	32%	0.323	S	S	.	.			trans	-74.4	162.4	170.1	63.9	0	0	0	0	110.5	E454 S455 M456	C452-E454 PolarHBondContact O-N 2.94Å; C452-S455 PolarHBondContact O-N 3.48Å; C452-S455 VanDerWaalsContact O-N 3.16Å; C452-M456 PolarHBondContact O-N 2.94Å; C452-M456 VanDerWaalsContact O-N 3.16Å
453	V	92.1	Very high	90.9	Very high	38 Å²	38	68 Å²	68	23%	0.23	34%	0.338	C	S	.	.	H	α-helix	trans	-52.8	-41.4	177.5	173.4	0	0	0	0	111.5	A392 M395 L400 S455 M456 K457	A392-V453 HydrophobicContact CB-CG2 4.11Å; M395-V453 HydrophobicContact SD-CG2 4.38Å; L400-V453 HydrophobicContact CD2-CG1 3.97Å; V453-S455 PolarHBondContact O-N 3.42Å; V453-M456 WeakPolarHBondContact O-CB 3.42Å; V453-M456 PolarHBondContact O-N 2.94Å; V453-M456 VanDerWaalsContact O-N 3.13Å; V453-K457 HydrophobicContact CG1-CG 4.43Å; V453-K457 WeakPolarHBondContact O-CG 3.41Å; V453-K457 PolarHBondContact O-N 3.4Å
454	E	91.4	Very high	90.8	Very high	109 Å²	109	74.7 Å²	74.7	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-65.5	-41	-178.2	-158.6	61.7	-158.1	0	0	112.6	C452 M456 K457 D458	C452-E454 PolarHBondContact O-N 2.94Å; E454-M456 PolarHBondContact O-N 3.17Å; E454-K457 WeakPolarHBondContact O-CB 3.17Å; E454-K457 PolarHBondContact O-N 2.85Å; E454-K457 WeakPolarHBondContact OE2-CD 3.48Å; E454-K457 IonicContact OE2-NZ 2.83Å; E454-K457 PolarHBondContact OE2-NZ 3.05Å; E454-K457 VanDerWaalsContact OE2-NZ 3.1Å; E454-D458 PolarHBondContact O-N 3Å; E454-D458 VanDerWaalsContact O-N 3.12Å
455	S	92.8	Very high	90.8	Very high	36 Å²	36	75.2 Å²	75.2	25%	0.252	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-30.7	174.1	-176.4	0	0	0	0	112.4	C452 V453 S459	C452-S455 PolarHBondContact O-N 3.48Å; C452-S455 VanDerWaalsContact O-N 3.16Å; V453-S455 PolarHBondContact O-N 3.42Å; S455-S459 PolarHBondContact O-N 3.37Å; S455-S459 PolarHBondContact O-OG 3.44Å; S455-S459 VanDerWaalsContact O-OG 3.08Å
456	M	96.1	Very high	91.3	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-76.6	-37.6	176.4	-69	-57.2	-53.2	0	0	111.8	A392 R393 L400 F444 L447 P451 C452 V453 E454 D458 S459 V460	A392-M456 HydrophobicContact CB-CG 4.18Å; A392-M456 WeakPolarHBondContact O-CG 3.34Å; R393-M456 WeakPolarHBondContact O-CE 3.12Å; L400-M456 HydrophobicContact CD1-CB 4.04Å; L400-M456 HydrophobicContact CD2-CB 3.79Å; F444-M456 HydrophobicContact CD2-CE 3.67Å; F444-M456 HydrophobicContact CE2-CE 3.87Å; F444-M456 HydrophobicContact CG-CE 4.14Å; F444-M456 HydrophobicContact CZ-CE 4.5Å; L447-M456 HydrophobicContact CD1-SD 3.58Å; L447-M456 VanDerWaalsContact CD1-SD 3.58Å; P451-M456 HydrophobicContact CB-CG 4Å; P451-M456 HydrophobicContact CB-SD 3.85Å; P451-M456 HydrophobicContact CG-CG 4.07Å; P451-M456 HydrophobicContact CG-SD 3.72Å; C452-M456 PolarHBondContact O-N 2.94Å; C452-M456 VanDerWaalsContact O-N 3.16Å; V453-M456 WeakPolarHBondContact O-CB 3.42Å; V453-M456 PolarHBondContact O-N 2.94Å; V453-M456 VanDerWaalsContact O-N 3.13Å; E454-M456 PolarHBondContact O-N 3.17Å; M456-D458 VanDerWaalsContact C-N 3.3Å; M456-D458 PolarHBondContact O-N 3.38Å; M456-S459 PolarHBondContact O-N 3.13Å; M456-V460 HydrophobicContact CE-CG2 3.69Å; M456-V460 VanDerWaalsContact O-CB 3.29Å; M456-V460 WeakPolarHBondContact O-CB 3.5Å; M456-V460 WeakPolarHBondContact O-CG2 3.3Å; M456-V460 PolarHBondContact O-N 3.27Å
457	K	94.9	Very high	91.9	Very high	58 Å²	58	70.2 Å²	70.2	25%	0.252	34%	0.335	S	S	.	.	H	α-helix	trans	-56.9	-46.1	172	-73.8	-178.9	-178.7	162.9	0	111.5	L400 V453 E454 S459 L461 R462	L400-K457 HydrophobicContact CB-CG 4.07Å; L400-K457 WeakPolarHBondContact O-CE 3.33Å; V453-K457 HydrophobicContact CG1-CG 4.43Å; V453-K457 WeakPolarHBondContact O-CG 3.41Å; V453-K457 PolarHBondContact O-N 3.4Å; E454-K457 WeakPolarHBondContact O-CB 3.17Å; E454-K457 PolarHBondContact O-N 2.85Å; E454-K457 WeakPolarHBondContact OE2-CD 3.48Å; E454-K457 IonicContact OE2-NZ 2.83Å; E454-K457 PolarHBondContact OE2-NZ 3.05Å; E454-K457 VanDerWaalsContact OE2-NZ 3.1Å; K457-S459 VanDerWaalsContact C-N 3.34Å; K457-S459 PolarHBondContact O-N 3.41Å; K457-L461 HydrophobicContact CB-CD1 3.82Å; K457-L461 HydrophobicContact CB-CG 4.45Å; K457-L461 HydrophobicContact CD-CD1 4.39Å; K457-L461 HydrophobicContact CG-CD1 3.66Å; K457-L461 WeakPolarHBondContact O-CA 3.49Å; K457-L461 WeakPolarHBondContact O-CB 3.09Å; K457-L461 PolarHBondContact O-N 3.25Å; K457-R462 PolarHBondContact O-N 2.98Å; K457-R462 VanDerWaalsContact O-N 3.14Å
458	D	93.8	Very high	92.3	Very high	57 Å²	57	75 Å²	75	31%	0.305	36%	0.357	S	S	.	.	I	π-helix	trans	-53.7	-51.4	175.7	-86.1	11.6	0	0	0	111.9	E454 M456 R462 D463	E454-D458 PolarHBondContact O-N 3Å; E454-D458 VanDerWaalsContact O-N 3.12Å; M456-D458 VanDerWaalsContact C-N 3.3Å; M456-D458 PolarHBondContact O-N 3.38Å; D458-R462 VanDerWaalsContact CB-NH2 3.3Å; D458-R462 VanDerWaalsContact CG-CZ 3.41Å; D458-R462 WeakPolarHBondContact O-CB 3.15Å; D458-R462 IonicContact OD1-CZ 2.98Å; D458-R462 IonicContact OD1-NH1 3.57Å; D458-R462 PolarHBondContact OD1-NH1 3.08Å; D458-R462 IonicContact OD1-NH2 2.71Å; D458-R462 IonicContact OD2-CZ 3.71Å; D458-R462 IonicContact OD2-NH1 3.83Å; D458-R462 PolarHBondContact OD2-NH1 3.4Å; D458-R462 IonicContact OD2-NH2 2.89Å; D458-R462 PolarHBondContact OD2-NH2 2.98Å; D458-D463 WeakPolarHBondContact O-CB 3.33Å; D458-D463 PolarHBondContact O-N 3.24Å
459	S	94.2	Very high	93	Very high	20 Å²	20	66.4 Å²	66.4	14%	0.14	33%	0.326	C	S	.	.	I	π-helix	trans	-73.2	-44.2	-176	-54.7	0	0	0	0	112.7	S455 M456 K457 G465	S455-S459 PolarHBondContact O-N 3.37Å; S455-S459 PolarHBondContact O-OG 3.44Å; S455-S459 VanDerWaalsContact O-OG 3.08Å; M456-S459 PolarHBondContact O-N 3.13Å; K457-S459 VanDerWaalsContact C-N 3.34Å; K457-S459 PolarHBondContact O-N 3.41Å; S459-G465 WeakPolarHBondContact O-CA 3.29Å; S459-G465 PolarHBondContact O-N 2.71Å
460	V	96.8	Very high	93.7	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.299	C	S	.	.	I	π-helix	trans	-91.1	-37	-169.1	176.2	0	0	0	0	112.6	P397 L400 F444 M456 R464	P397-V460 HydrophobicContact CB-CG1 4.47Å; P397-V460 HydrophobicContact CG-CG1 3.84Å; L400-V460 HydrophobicContact CD1-CB 3.86Å; L400-V460 HydrophobicContact CD1-CG1 4.03Å; L400-V460 HydrophobicContact CD1-CG2 4.21Å; F444-V460 HydrophobicContact CE1-CG2 4.09Å; F444-V460 HydrophobicContact CE2-CG2 4.23Å; F444-V460 HydrophobicContact CZ-CG2 3.72Å; M456-V460 HydrophobicContact CE-CG2 3.69Å; M456-V460 VanDerWaalsContact O-CB 3.29Å; M456-V460 WeakPolarHBondContact O-CB 3.5Å; M456-V460 WeakPolarHBondContact O-CG2 3.3Å; M456-V460 PolarHBondContact O-N 3.27Å; V460-R464 WeakPolarHBondContact O-CA 3.42Å
461	L	94.6	Very high	94	Very high	20 Å²	20	59.3 Å²	59.3	11%	0.105	30%	0.3	C	S	.	.	I	π-helix	trans	-95.7	-54.8	-175.4	-54.1	174.9	0	0	0	112.2	P397 L400 E401 K457 R464	P397-L461 HydrophobicContact CB-CD2 3.56Å; L400-L461 HydrophobicContact CB-CD1 4.17Å; E401-L461 HydrophobicContact CG-CD1 3.33Å; E401-L461 HydrophobicContact CG-CD2 3.94Å; E401-L461 HydrophobicContact CG-CG 4.26Å; K457-L461 HydrophobicContact CB-CD1 3.82Å; K457-L461 HydrophobicContact CB-CG 4.45Å; K457-L461 HydrophobicContact CD-CD1 4.39Å; K457-L461 HydrophobicContact CG-CD1 3.66Å; K457-L461 WeakPolarHBondContact O-CA 3.49Å; K457-L461 WeakPolarHBondContact O-CB 3.09Å; K457-L461 PolarHBondContact O-N 3.25Å; L461-R464 WeakPolarHBondContact O-CD 3.49Å; L461-R464 PolarHBondContact O-NE 3Å
462	R	94.1	Very high	94	Very high	146 Å²	146	62 Å²	62	55%	0.551	32%	0.319	S	S	*	.	I	π-helix	trans	-72.6	-52.1	-176.4	-178.2	-169.7	65.9	-139.3	-5.1	110.4	K457 D458 R464	K457-R462 PolarHBondContact O-N 2.98Å; K457-R462 VanDerWaalsContact O-N 3.14Å; D458-R462 VanDerWaalsContact CB-NH2 3.3Å; D458-R462 VanDerWaalsContact CG-CZ 3.41Å; D458-R462 WeakPolarHBondContact O-CB 3.15Å; D458-R462 IonicContact OD1-CZ 2.98Å; D458-R462 IonicContact OD1-NH1 3.57Å; D458-R462 PolarHBondContact OD1-NH1 3.08Å; D458-R462 IonicContact OD1-NH2 2.71Å; D458-R462 IonicContact OD2-CZ 3.71Å; D458-R462 IonicContact OD2-NH1 3.83Å; D458-R462 PolarHBondContact OD2-NH1 3.4Å; D458-R462 IonicContact OD2-NH2 2.89Å; D458-R462 PolarHBondContact OD2-NH2 2.98Å; R462-R464 VanDerWaalsContact C-N 3.32Å
463	D	94.1	Very high	94.1	Very high	95 Å²	95	59.4 Å²	59.4	51%	0.508	30%	0.298	S	S	.	.	S	Bend	trans	-87.8	-5.9	-174	-56.3	-20.8	0	0	0	112.3	D458 G465	D458-D463 WeakPolarHBondContact O-CB 3.33Å; D458-D463 PolarHBondContact O-N 3.24Å; D463-G465 PolarHBondContact O-N 3.47Å; D463-G465 VanDerWaalsContact O-N 3.07Å
464	R	95.6	Very high	94	Very high	139 Å²	139	59.8 Å²	59.8	53%	0.525	30%	0.301	S	S	.	.			trans	53	26.6	-177.3	-56.7	-67.1	176.2	154.2	-14	113.1	V460 L461 R462 H492	V460-R464 WeakPolarHBondContact O-CA 3.42Å; L461-R464 WeakPolarHBondContact O-CD 3.49Å; L461-R464 PolarHBondContact O-NE 3Å; R462-R464 VanDerWaalsContact C-N 3.32Å; R464-H492 PolarHBondContact NH1-CD2 2.89Å; R464-H492 PolarHBondContact NH1-CE1 2.71Å; R464-H492 PolarHBondContact NH1-ND1 3.13Å; R464-H492 PolarHBondContact NH1-NE2 3.37Å; R464-H492 PolarHBondContact NH2-NE2 2.85Å
465	G	95.6	Very high	93.9	Very high	26 Å²	26	59.6 Å²	59.6	27%	0.268	31%	0.312	S	S	.	.			trans	-67.8	145.3	-175.3	0	0	0	0	0	112.5	S459 D463	S459-G465 WeakPolarHBondContact O-CA 3.29Å; S459-G465 PolarHBondContact O-N 2.71Å; D463-G465 PolarHBondContact O-N 3.47Å; D463-G465 VanDerWaalsContact O-N 3.07Å
466	R	97.5	Very high	93.7	Very high	55 Å²	55	60.8 Å²	60.8	21%	0.208	31%	0.313	C	S	.	.			trans	-133.7	158.8	167.9	-65.3	-63.2	-179	-84	-1.7	108.8	E468 W490	R466-E468 PolarHBondContact O-N 3.37Å; R466-W490 HydrophobicContact CB-CD2 4.2Å; R466-W490 HydrophobicContact CB-CE3 4.44Å; R466-W490 HydrophobicContact CB-CH2 4.15Å; R466-W490 HydrophobicContact CB-CZ2 3.89Å; R466-W490 HydrophobicContact CB-CZ3 4.42Å; R466-W490 HydrophobicContact CG-CD2 4.02Å; R466-W490 HydrophobicContact CG-CG 4.21Å; R466-W490 HydrophobicContact CG-CZ2 4.37Å; R466-W490 VanDerWaalsContact CZ-O 3.25Å; R466-W490 PolarHBondContact NE-O 3.36Å; R466-W490 PolarHBondContact NH2-O 2.97Å
467	P	96.9	Very high	93.4	Very high	10 Å²	10	64.4 Å²	64.4	7%	0.065	34%	0.343	C	S	.	.			trans	-52.7	137.9	167.4	-24.4	34.5	0	0	0	111.2	L422 W425 P443 F444 W490	L422-P467 HydrophobicContact CD2-CG 3.73Å; W425-P467 HydrophobicContact CD2-CB 3.41Å; W425-P467 VanDerWaalsContact CD2-CB 3.41Å; W425-P467 HydrophobicContact CD2-CG 4.16Å; W425-P467 HydrophobicContact CE3-CB 3.87Å; W425-P467 HydrophobicContact CE3-CG 4.29Å; W425-P467 HydrophobicContact CG-CB 3.87Å; W425-P467 HydrophobicContact CH2-CB 4.04Å; W425-P467 HydrophobicContact CZ2-CB 3.58Å; W425-P467 HydrophobicContact CZ3-CB 4.16Å; P443-P467 HydrophobicContact CB-CG 3.95Å; F444-P467 HydrophobicContact CE2-CG 4.42Å; F444-P467 HydrophobicContact CZ-CG 4.39Å; P467-W490 HydrophobicContact CB-CH2 4.38Å; P467-W490 HydrophobicContact CB-CZ3 4.14Å; P467-W490 HydrophobicContact CG-CZ3 3.98Å; P467-W490 VanDerWaalsContact O-CH2 3.31Å; P467-W490 WeakPolarHBondContact O-CH2 3.13Å
468	E	94.4	Very high	93.2	Very high	142 Å²	142	62.1 Å²	62.1	66%	0.664	34%	0.336	S	S	*	.			trans	-68.6	134.4	-175.4	-172	-176.7	173.8	0	0	110.8	W425 R466 P470	W425-E468 PolarHBondContact NE1-O 3.33Å; R466-E468 PolarHBondContact O-N 3.37Å; E468-P470 HydrophobicContact CG-CG 4.41Å; E468-P470 WeakPolarHBondContact O-CD 3.39Å
469	I	95.6	Very high	93.1	Very high	30 Å²	30	59.4 Å²	59.4	15%	0.154	32%	0.322	C	S	.	.			trans	-109.9	97.8	166.5	-60.8	177.1	0	0	0	107.1	W473 C483 I486 E487 W490	I469-W473 HydrophobicContact CG2-CE3 4.09Å; I469-C483 HydrophobicContact CD1-CB 4.21Å; I469-C483 HydrophobicContact CG2-CB 4.14Å; I469-I486 HydrophobicContact CD1-CG2 4.4Å; I469-E487 HydrophobicContact CD1-CG 4.11Å; I469-W490 HydrophobicContact CD1-CH2 3.72Å; I469-W490 HydrophobicContact CD1-CZ2 3.71Å; I469-W490 HydrophobicContact CG1-CH2 3.98Å; I469-W490 HydrophobicContact CG1-CZ2 4.28Å
470	P	93.6	Very high	93.1	Very high	26 Å²	26	63.8 Å²	63.8	17%	0.169	34%	0.34	C	S	.	.			trans	-61.5	139.7	176.6	-24.1	34.2	0	0	0	112	E468 S472 W473	E468-P470 HydrophobicContact CG-CG 4.41Å; E468-P470 WeakPolarHBondContact O-CD 3.39Å; P470-S472 PolarHBondContact O-N 3.28Å; P470-W473 HydrophobicContact CB-CG 4.46Å; P470-W473 HydrophobicContact CG-CD2 4.43Å; P470-W473 HydrophobicContact CG-CZ2 4.37Å; P470-W473 WeakPolarHBondContact O-CB 2.97Å; P470-W473 PolarHBondContact O-N 3.36Å
471	N	90.4	Very high	92.9	Very high	146 Å²	146	66.5 Å²	66.5	78%	0.781	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.5	174.8	-68	-25.1	0	0	0	113.6	W473 T474	N471-W473 VanDerWaalsContact C-N 3.28Å; N471-W473 PolarHBondContact O-N 2.75Å; N471-T474 PolarHBondContact O-OG1 3.09Å
472	S	89.4	Confident	92.9	Very high	70 Å²	70	65.6 Å²	65.6	49%	0.49	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.4	175.2	57.1	0	0	0	0	112.8	P470 T474 S475	P470-S472 PolarHBondContact O-N 3.28Å; S472-T474 VanDerWaalsContact C-N 3.3Å; S472-T474 PolarHBondContact O-N 3.46Å; S472-S475 PolarHBondContact O-OG 3.32Å
473	W	92.8	Very high	93	Very high	24 Å²	24	58.8 Å²	58.8	9%	0.091	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-67.6	-31.5	-178.7	-67.5	10.1	0	0	0	112.3	W425 I428 I434 I469 P470 N471 S475 I479	W425-W473 AromaticContact CD1-CZ3 3.94Å; W425-W473 HydrophobicContact CZ2-CH2 4.36Å; W425-W473 AromaticContact NE1-CH2 3.7Å; W425-W473 AromaticContact NE1-CZ3 3.7Å; I428-W473 HydrophobicContact CB-CE3 4.45Å; I428-W473 HydrophobicContact CB-CZ3 4.19Å; I428-W473 HydrophobicContact CG2-CD2 4.18Å; I428-W473 HydrophobicContact CG2-CE3 3.41Å; I428-W473 VanDerWaalsContact CG2-CE3 3.41Å; I428-W473 HydrophobicContact CG2-CZ3 3.62Å; I434-W473 HydrophobicContact CB-CB 4.24Å; I434-W473 HydrophobicContact CB-CD2 4.39Å; I434-W473 HydrophobicContact CB-CG 3.85Å; I434-W473 HydrophobicContact CD1-CD2 4.42Å; I434-W473 HydrophobicContact CD1-CZ2 4.13Å; I434-W473 HydrophobicContact CG2-CB 4.19Å; I434-W473 HydrophobicContact CG2-CD2 4.2Å; I434-W473 HydrophobicContact CG2-CG 3.96Å; I469-W473 HydrophobicContact CG2-CE3 4.09Å; P470-W473 HydrophobicContact CB-CG 4.46Å; P470-W473 HydrophobicContact CG-CD2 4.43Å; P470-W473 HydrophobicContact CG-CZ2 4.37Å; P470-W473 WeakPolarHBondContact O-CB 2.97Å; P470-W473 PolarHBondContact O-N 3.36Å; N471-W473 VanDerWaalsContact C-N 3.28Å; N471-W473 PolarHBondContact O-N 2.75Å; W473-S475 PolarHBondContact O-N 3.02Å; W473-I479 HydrophobicContact CB-CG2 4.23Å; W473-I479 WeakPolarHBondContact O-CG2 3.35Å
474	T	88.9	Confident	93.2	Very high	47 Å²	47	55.3 Å²	55.3	29%	0.288	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-81	8.8	-174.7	58.5	0	0	0	0	113.7	N471 S472 H476 Q480	N471-T474 PolarHBondContact O-OG1 3.09Å; S472-T474 VanDerWaalsContact C-N 3.3Å; S472-T474 PolarHBondContact O-N 3.46Å; T474-H476 PolarHBondContact O-N 3.03Å; T474-Q480 HydrophobicContact CG2-CB 4.36Å; T474-Q480 HydrophobicContact CG2-CG 4.26Å
475	S	89.6	Confident	93.2	Very high	105 Å²	105	48.9 Å²	48.9	73%	0.734	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-65.9	-29.2	172.4	-52.9	0	0	0	0	112.2	S472 W473	S472-S475 PolarHBondContact O-OG 3.32Å; W473-S475 PolarHBondContact O-N 3.02Å
476	H	89.1	Confident	93.4	Very high	61 Å²	61	47.6 Å²	47.6	28%	0.282	27%	0.273	S	S	.	.	S	Bend	trans	-92.1	122.5	175	-171.5	-83.6	0	0	0	109.9	W314 T474 G478 I479 Q480	W314-H476 AromaticContact CD2-CE1 3.51Å; W314-H476 AromaticContact CE2-CE1 3.53Å; W314-H476 AromaticContact CE3-CE1 3.86Å; W314-H476 AromaticContact CE3-ND1 3.99Å; W314-H476 AromaticContact CG-CE1 3.94Å; W314-H476 AromaticContact CZ2-CE1 3.92Å; W314-H476 AromaticContact NE1-CE1 3.87Å; T474-H476 PolarHBondContact O-N 3.03Å; H476-G478 VanDerWaalsContact C-N 3.31Å; H476-G478 PolarHBondContact ND1-N 3.21Å; H476-G478 PolarHBondContact O-N 3.24Å; H476-I479 HydrophobicContact CB-CB 4.09Å; H476-I479 HydrophobicContact CB-CD1 3.7Å; H476-I479 HydrophobicContact CB-CG1 4Å; H476-I479 PolarHBondContact ND1-N 3.32Å; H476-I479 PolarHBondContact O-N 3.41Å; H476-Q480 PolarHBondContact O-N 2.8Å
477	A	89.4	Confident	93.4	Very high	76 Å²	76	50.1 Å²	50.1	63%	0.628	29%	0.287	S	S	*	.	H	α-helix	trans	-57	-42.6	-174.9	0	0	0	0	0	112.7	I479 Q480 M481	A477-I479 PolarHBondContact O-N 2.94Å; A477-Q480 WeakPolarHBondContact O-CB 3.43Å; A477-Q480 PolarHBondContact O-N 3.49Å; A477-M481 PolarHBondContact O-N 3.28Å; A477-M481 VanDerWaalsContact O-N 3.08Å
478	G	90	Very high	93.5	Very high	10 Å²	10	53.2 Å²	53.2	10%	0.103	30%	0.301	C	S	.	.	H	α-helix	trans	-62.5	-40.5	175.5	0	0	0	0	0	113	W314 H476 M481 V482	W314-G478 WeakPolarHBondContact CH2-O 3.4Å; H476-G478 VanDerWaalsContact C-N 3.31Å; H476-G478 PolarHBondContact ND1-N 3.21Å; H476-G478 PolarHBondContact O-N 3.24Å; G478-M481 PolarHBondContact O-N 2.89Å; G478-V482 WeakPolarHBondContact O-CG2 3.48Å; G478-V482 PolarHBondContact O-N 3.33Å; G478-V482 VanDerWaalsContact O-N 3.14Å
479	I	92.7	Very high	93.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-68.9	-41.2	178.6	-67.4	167.2	0	0	0	109.6	W314 I428 A433 I434 W473 H476 A477 M481 V482 C483	W314-I479 HydrophobicContact CE3-CG1 3.79Å; W314-I479 HydrophobicContact CZ3-CB 4.43Å; W314-I479 HydrophobicContact CZ3-CG1 3.57Å; I428-I479 HydrophobicContact CG2-CG2 3.86Å; A433-I479 VanDerWaalsContact C-CD1 3.47Å; A433-I479 HydrophobicContact CB-CD1 3.5Å; A433-I479 VanDerWaalsContact CB-CD1 3.5Å; I434-I479 HydrophobicContact CB-CD1 4.45Å; I434-I479 HydrophobicContact CG2-CD1 3.56Å; I434-I479 HydrophobicContact CG2-CG2 4.28Å; W473-I479 HydrophobicContact CB-CG2 4.23Å; W473-I479 WeakPolarHBondContact O-CG2 3.35Å; H476-I479 HydrophobicContact CB-CB 4.09Å; H476-I479 HydrophobicContact CB-CD1 3.7Å; H476-I479 HydrophobicContact CB-CG1 4Å; H476-I479 PolarHBondContact ND1-N 3.32Å; H476-I479 PolarHBondContact O-N 3.41Å; A477-I479 PolarHBondContact O-N 2.94Å; I479-M481 VanDerWaalsContact C-N 3.26Å; I479-M481 PolarHBondContact O-N 2.93Å; I479-V482 PolarHBondContact O-N 2.98Å; I479-C483 WeakPolarHBondContact O-CB 3.32Å; I479-C483 PolarHBondContact O-N 2.92Å; I479-C483 PolarHBondContact O-SG 3.45Å; I479-C483 VanDerWaalsContact O-SG 3.32Å
480	Q	94.1	Very high	93.8	Very high	111 Å²	111	45.8 Å²	45.8	52%	0.519	27%	0.265	S	S	.	.	H	α-helix	trans	-55.4	-43.3	176	-176.2	-177.7	16.1	0	0	111.6	T474 H476 A477 C483 G484	T474-Q480 HydrophobicContact CG2-CB 4.36Å; T474-Q480 HydrophobicContact CG2-CG 4.26Å; H476-Q480 PolarHBondContact O-N 2.8Å; A477-Q480 WeakPolarHBondContact O-CB 3.43Å; A477-Q480 PolarHBondContact O-N 3.49Å; Q480-C483 PolarHBondContact O-N 2.72Å; Q480-G484 PolarHBondContact O-N 2.84Å
481	M	92.8	Very high	94	Very high	57 Å²	57	47.7 Å²	47.7	28%	0.281	27%	0.274	S	S	.	.	H	α-helix	trans	-66.9	-41.8	178.6	-167.8	-150	70.4	0	0	112.5	A477 G478 I479 G484 S485 R506 V510	A477-M481 PolarHBondContact O-N 3.28Å; A477-M481 VanDerWaalsContact O-N 3.08Å; G478-M481 PolarHBondContact O-N 2.89Å; I479-M481 VanDerWaalsContact C-N 3.26Å; I479-M481 PolarHBondContact O-N 2.93Å; M481-G484 PolarHBondContact O-N 2.89Å; M481-S485 PolarHBondContact O-N 2.98Å; M481-S485 PolarHBondContact O-OG 3.36Å; M481-R506 HydrophobicContact CE-CB 4.12Å; M481-R506 WeakPolarHBondContact CE-O 3.09Å; M481-V510 HydrophobicContact CE-CB 4.46Å; M481-V510 HydrophobicContact CE-CG2 3.1Å; M481-V510 HydrophobicContact SD-CG2 3.33Å; M481-V510 WeakPolarHBondContact SD-CG2 3.41Å
482	V	94.5	Very high	94.3	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-40.2	175.7	-173.2	0	0	0	0	110.7	W314 L317 I428 G478 I479 S485 I486 F507	W314-V482 HydrophobicContact CH2-CG2 4.38Å; L317-V482 HydrophobicContact CD2-CG2 4.47Å; I428-V482 HydrophobicContact CD1-CB 4.05Å; I428-V482 HydrophobicContact CD1-CG1 3.71Å; I428-V482 HydrophobicContact CG1-CG1 4.3Å; G478-V482 WeakPolarHBondContact O-CG2 3.48Å; G478-V482 PolarHBondContact O-N 3.33Å; G478-V482 VanDerWaalsContact O-N 3.14Å; I479-V482 PolarHBondContact O-N 2.98Å; V482-S485 WeakPolarHBondContact O-CB 3.31Å; V482-S485 PolarHBondContact O-N 3.11Å; V482-I486 HydrophobicContact CG1-CD1 4.29Å; V482-I486 WeakPolarHBondContact O-CG1 3.45Å; V482-I486 PolarHBondContact O-N 2.75Å; V482-F507 HydrophobicContact CG1-CE1 4.49Å; V482-F507 HydrophobicContact CG1-CZ 3.86Å; V482-F507 HydrophobicContact CG2-CE1 3.93Å; V482-F507 HydrophobicContact CG2-CZ 4.05Å
483	C	96.9	Very high	94.6	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.02	25%	0.246	C	C	.	.	H	α-helix	trans	-58.7	-46.9	173.7	-74.7	0	0	0	0	112	I469 I479 Q480 S485 I486 E487	I469-C483 HydrophobicContact CD1-CB 4.21Å; I469-C483 HydrophobicContact CG2-CB 4.14Å; I479-C483 WeakPolarHBondContact O-CB 3.32Å; I479-C483 PolarHBondContact O-N 2.92Å; I479-C483 PolarHBondContact O-SG 3.45Å; I479-C483 VanDerWaalsContact O-SG 3.32Å; Q480-C483 PolarHBondContact O-N 2.72Å; C483-S485 VanDerWaalsContact C-N 3.28Å; C483-S485 PolarHBondContact O-N 2.93Å; C483-I486 WeakPolarHBondContact O-CB 3.29Å; C483-I486 PolarHBondContact O-N 3.35Å; C483-E487 WeakPolarHBondContact O-CG 3.46Å; C483-E487 PolarHBondContact O-N 2.8Å
484	G	96.8	Very high	94.8	Very high	22 Å²	22	44 Å²	44	23%	0.227	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-38.6	175.4	0	0	0	0	0	112.4	Q480 M481 E487 E488	Q480-G484 PolarHBondContact O-N 2.84Å; M481-G484 PolarHBondContact O-N 2.89Å; G484-E487 PolarHBondContact O-N 2.89Å; G484-E488 PolarHBondContact O-N 2.92Å; G484-E488 VanDerWaalsContact O-N 3.13Å
485	S	96.9	Very high	95.1	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-42.9	174.6	-53.5	0	0	0	0	111.9	M481 V482 C483 E487 E488 C489 R506	M481-S485 PolarHBondContact O-N 2.98Å; M481-S485 PolarHBondContact O-OG 3.36Å; V482-S485 WeakPolarHBondContact O-CB 3.31Å; V482-S485 PolarHBondContact O-N 3.11Å; C483-S485 VanDerWaalsContact C-N 3.28Å; C483-S485 PolarHBondContact O-N 2.93Å; S485-E487 VanDerWaalsContact C-N 3.3Å; S485-E487 PolarHBondContact O-N 2.81Å; S485-E488 PolarHBondContact O-N 2.96Å; S485-C489 WeakPolarHBondContact O-CB 3.49Å; S485-C489 PolarHBondContact O-N 2.83Å; S485-C489 PolarHBondContact O-SG 3.06Å; S485-R506 WeakPolarHBondContact OG-CD 3.44Å; S485-R506 PolarHBondContact OG-NH1 3.18Å
486	I	98.3	Very high	95.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.5	-43.1	174.1	-71.4	166.5	0	0	0	110.8	A421 L424 W425 I428 I469 V482 C483 E488 C489 W490	A421-I486 HydrophobicContact CB-CG2 4.29Å; L424-I486 HydrophobicContact CB-CD1 3.74Å; L424-I486 HydrophobicContact CB-CG1 3.78Å; L424-I486 HydrophobicContact CD1-CG1 4.39Å; W425-I486 HydrophobicContact CB-CD1 4.22Å; I428-I486 HydrophobicContact CD1-CD1 3.32Å; I428-I486 HydrophobicContact CG1-CD1 4.39Å; I469-I486 HydrophobicContact CD1-CG2 4.4Å; V482-I486 HydrophobicContact CG1-CD1 4.29Å; V482-I486 WeakPolarHBondContact O-CG1 3.45Å; V482-I486 PolarHBondContact O-N 2.75Å; C483-I486 WeakPolarHBondContact O-CB 3.29Å; C483-I486 PolarHBondContact O-N 3.35Å; I486-E488 VanDerWaalsContact C-N 3.32Å; I486-E488 PolarHBondContact O-N 2.98Å; I486-C489 PolarHBondContact O-N 3.31Å; I486-C489 VanDerWaalsContact O-N 3.08Å; I486-W490 HydrophobicContact CG2-CD2 3.69Å; I486-W490 HydrophobicContact CG2-CE3 3.46Å; I486-W490 VanDerWaalsContact CG2-CE3 3.46Å; I486-W490 HydrophobicContact CG2-CG 4.5Å; I486-W490 HydrophobicContact CG2-CH2 3.6Å; I486-W490 HydrophobicContact CG2-CZ2 3.81Å; I486-W490 HydrophobicContact CG2-CZ3 3.42Å; I486-W490 VanDerWaalsContact CG2-CZ3 3.42Å; I486-W490 PolarHBondContact O-N 2.94Å
487	E	98.1	Very high	95.9	Very high	108 Å²	108	43 Å²	43	51%	0.505	24%	0.239	S	C	.	.	H	α-helix	trans	-60.1	-40.9	-179.8	-74	-179.8	150.3	0	0	113	I469 C483 G484 S485 W490	I469-E487 HydrophobicContact CD1-CG 4.11Å; C483-E487 WeakPolarHBondContact O-CG 3.46Å; C483-E487 PolarHBondContact O-N 2.8Å; G484-E487 PolarHBondContact O-N 2.89Å; S485-E487 VanDerWaalsContact C-N 3.3Å; S485-E487 PolarHBondContact O-N 2.81Å; E487-W490 HydrophobicContact CG-CZ2 4.27Å
488	E	98.4	Very high	96.4	Very high	74 Å²	74	40.8 Å²	40.8	35%	0.346	22%	0.216	S	C	.	.	H	α-helix	trans	-70	-35.7	173.2	-65.4	170.1	-109.9	0	0	112	G484 S485 I486 R497 L498 R506	G484-E488 PolarHBondContact O-N 2.92Å; G484-E488 VanDerWaalsContact O-N 3.13Å; S485-E488 PolarHBondContact O-N 2.96Å; I486-E488 VanDerWaalsContact C-N 3.32Å; I486-E488 PolarHBondContact O-N 2.98Å; E488-R497 WeakPolarHBondContact O-CA 3.19Å; E488-L498 HydrophobicContact CB-CD1 3.87Å; E488-L498 HydrophobicContact CB-CG 3.87Å; E488-L498 WeakPolarHBondContact OE2-CD2 3.32Å; E488-R506 VanDerWaalsContact CD-NH2 3.34Å; E488-R506 IonicContact OE1-CZ 2.93Å; E488-R506 VanDerWaalsContact OE1-CZ 3.32Å; E488-R506 IonicContact OE1-NH1 3.87Å; E488-R506 PolarHBondContact OE1-NH1 3.18Å; E488-R506 IonicContact OE1-NH2 3.92Å; E488-R506 PolarHBondContact OE1-NH2 3.43Å; E488-R506 IonicContact OE2-CZ 3.86Å; E488-R506 IonicContact OE2-NH1 2.81Å; E488-R506 IonicContact OE2-NH2 3.61Å; E488-R506 PolarHBondContact OE2-NH2 3.41Å
489	C	98.6	Very high	96.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-75.8	-29.2	-175.6	-67	0	0	0	0	114.4	V417 A421 S485 I486 D491 R497 I503	V417-C489 HydrophobicContact CG1-CB 3.68Å; A421-C489 HydrophobicContact CB-CB 3.51Å; S485-C489 WeakPolarHBondContact O-CB 3.49Å; S485-C489 PolarHBondContact O-N 2.83Å; S485-C489 PolarHBondContact O-SG 3.06Å; I486-C489 PolarHBondContact O-N 3.31Å; I486-C489 VanDerWaalsContact O-N 3.08Å; C489-D491 VanDerWaalsContact C-N 3.35Å; C489-R497 WeakPolarHBondContact O-CD 3.49Å; C489-R497 WeakPolarHBondContact O-CG 3.48Å; C489-I503 WeakPolarHBondContact SG-CD1 3.43Å
490	W	98.3	Very high	97	Very high	17 Å²	17	43.2 Å²	43.2	6%	0.064	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	20.8	177.7	68.6	16.2	0	0	0	113.3	Y418 A421 L422 W425 R466 P467 I469 I486 E487	Y418-W490 HydrophobicContact CD2-CB 3.84Å; Y418-W490 HydrophobicContact CE2-CB 3.81Å; A421-W490 HydrophobicContact CB-CB 4Å; L422-W490 HydrophobicContact CD2-CE3 3.97Å; L422-W490 HydrophobicContact CD2-CZ3 4.37Å; W425-W490 HydrophobicContact CB-CZ3 4.1Å; W425-W490 AromaticContact CD1-CH2 3.98Å; W425-W490 HydrophobicContact CG-CH2 4.49Å; W425-W490 HydrophobicContact CG-CZ3 4.18Å; R466-W490 HydrophobicContact CB-CD2 4.2Å; R466-W490 HydrophobicContact CB-CE3 4.44Å; R466-W490 HydrophobicContact CB-CH2 4.15Å; R466-W490 HydrophobicContact CB-CZ2 3.89Å; R466-W490 HydrophobicContact CB-CZ3 4.42Å; R466-W490 HydrophobicContact CG-CD2 4.02Å; R466-W490 HydrophobicContact CG-CG 4.21Å; R466-W490 HydrophobicContact CG-CZ2 4.37Å; R466-W490 VanDerWaalsContact CZ-O 3.25Å; R466-W490 PolarHBondContact NE-O 3.36Å; R466-W490 PolarHBondContact NH2-O 2.97Å; P467-W490 HydrophobicContact CB-CH2 4.38Å; P467-W490 HydrophobicContact CB-CZ3 4.14Å; P467-W490 HydrophobicContact CG-CZ3 3.98Å; P467-W490 VanDerWaalsContact O-CH2 3.31Å; P467-W490 WeakPolarHBondContact O-CH2 3.13Å; I469-W490 HydrophobicContact CD1-CH2 3.72Å; I469-W490 HydrophobicContact CD1-CZ2 3.71Å; I469-W490 HydrophobicContact CG1-CH2 3.98Å; I469-W490 HydrophobicContact CG1-CZ2 4.28Å; I486-W490 HydrophobicContact CG2-CD2 3.69Å; I486-W490 HydrophobicContact CG2-CE3 3.46Å; I486-W490 VanDerWaalsContact CG2-CE3 3.46Å; I486-W490 HydrophobicContact CG2-CG 4.5Å; I486-W490 HydrophobicContact CG2-CH2 3.6Å; I486-W490 HydrophobicContact CG2-CZ2 3.81Å; I486-W490 HydrophobicContact CG2-CZ3 3.42Å; I486-W490 VanDerWaalsContact CG2-CZ3 3.42Å; I486-W490 PolarHBondContact O-N 2.94Å; E487-W490 HydrophobicContact CG-CZ2 4.27Å
491	D	98.4	Very high	97.2	Very high	66 Å²	66	43.2 Å²	43.2	35%	0.353	23%	0.229	S	C	.	.			trans	-54.8	148.7	175.5	-160.2	-70.8	0	0	0	110.5	C489 D493 A496 R497	C489-D491 VanDerWaalsContact C-N 3.35Å; D491-D493 VanDerWaalsContact C-N 3.35Å; D491-D493 PolarHBondContact OD1-N 3.33Å; D491-A496 HydrophobicContact CB-CB 4.23Å; D491-R497 HydrophobicContact CB-CG 4.18Å; D491-R497 PolarHBondContact O-NE 3.47Å; D491-R497 PolarHBondContact O-NH2 3.16Å
492	H	96.6	Very high	97.4	Very high	53 Å²	53	42.6 Å²	42.6	25%	0.245	23%	0.23	C	C	.	.	S	Bend	trans	-67.7	-38.6	176.6	-176.3	88.3	0	0	0	112.3	P397 R464 P494 R497	P397-H492 WeakPolarHBondContact CB-ND1 3.49Å; R464-H492 PolarHBondContact NH1-CD2 2.89Å; R464-H492 PolarHBondContact NH1-CE1 2.71Å; R464-H492 PolarHBondContact NH1-ND1 3.13Å; R464-H492 PolarHBondContact NH1-NE2 3.37Å; R464-H492 PolarHBondContact NH2-NE2 2.85Å; H492-P494 WeakPolarHBondContact O-CD 3.49Å; H492-R497 PolarHBondContact O-NH2 2.96Å
493	D	96.4	Very high	97.6	Very high	83 Å²	83	42.6 Å²	42.6	44%	0.444	23%	0.23	S	C	.	.	S	Bend	trans	-78.1	116.2	174.1	-174.3	-2.4	0	0	0	109.4	D491 E495 A496	D491-D493 VanDerWaalsContact C-N 3.35Å; D491-D493 PolarHBondContact OD1-N 3.33Å; D493-E495 PolarHBondContact O-N 3.22Å; D493-E495 PolarHBondContact OD1-N 3.42Å; D493-E495 VanDerWaalsContact OD1-N 3.15Å; D493-A496 HydrophobicContact CB-CB 4.05Å; D493-A496 PolarHBondContact O-N 3.16Å
494	P	96.3	Very high	97.6	Very high	27 Å²	27	42.7 Å²	42.7	18%	0.175	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-62.8	-28.2	-179.3	28.3	-37	0	0	0	113.4	Q414 H492 A496 R497	Q414-P494 HydrophobicContact CB-CB 3.83Å; Q414-P494 VanDerWaalsContact CD-O 3.24Å; Q414-P494 HydrophobicContact CG-CB 4.32Å; Q414-P494 VanDerWaalsContact CG-O 3.31Å; Q414-P494 WeakPolarHBondContact CG-O 3.3Å; Q414-P494 PolarHBondContact NE2-O 2.82Å; H492-P494 WeakPolarHBondContact O-CD 3.49Å; P494-A496 VanDerWaalsContact C-N 3.29Å; P494-A496 PolarHBondContact O-N 2.81Å; P494-R497 PolarHBondContact O-N 2.79Å
495	E	95.8	Very high	97.5	Very high	120 Å²	120	46.2 Å²	46.2	56%	0.561	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-75.2	-18.3	178.6	-64.8	-66.1	157.8	0	0	113	N408 Q414 D493 R497	N408-E495 PolarHBondContact ND2-OE1 2.87Å; Q414-E495 VanDerWaalsContact NE2-CD 3.32Å; Q414-E495 PolarHBondContact NE2-OE1 2.99Å; Q414-E495 PolarHBondContact NE2-OE2 3.48Å; D493-E495 PolarHBondContact O-N 3.22Å; D493-E495 PolarHBondContact OD1-N 3.42Å; D493-E495 VanDerWaalsContact OD1-N 3.15Å; E495-R497 VanDerWaalsContact C-N 3.32Å
496	A	97.3	Very high	97.4	Very high	54 Å²	54	49.2 Å²	49.2	45%	0.446	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-82.8	-11.6	176.1	0	0	0	0	0	112.9	D491 D493 P494	D491-A496 HydrophobicContact CB-CB 4.23Å; D493-A496 HydrophobicContact CB-CB 4.05Å; D493-A496 PolarHBondContact O-N 3.16Å; P494-A496 VanDerWaalsContact C-N 3.29Å; P494-A496 PolarHBondContact O-N 2.81Å
497	R	98.3	Very high	97.2	Very high	17 Å²	17	49.5 Å²	49.5	6%	0.064	25%	0.254	C	S	.	.	S	Bend	trans	-75	144.2	-175.8	-60.5	175.8	-170	147.5	17.1	111.4	E398 Q414 V417 E488 C489 D491 H492 P494 E495	E398-R497 IonicContact OE1-CZ 3.32Å; E398-R497 IonicContact OE1-NH1 3.92Å; E398-R497 PolarHBondContact OE1-NH1 3.07Å; E398-R497 IonicContact OE1-NH2 3.57Å; E398-R497 PolarHBondContact OE1-NH2 3.39Å; E398-R497 IonicContact OE2-CZ 2.63Å; E398-R497 IonicContact OE2-NH1 3.79Å; E398-R497 IonicContact OE2-NH2 3.32Å; E398-R497 PolarHBondContact OE2-NH2 3.25Å; Q414-R497 VanDerWaalsContact C-NH1 3.31Å; Q414-R497 PolarHBondContact O-NH1 2.91Å; V417-R497 HydrophobicContact CG1-CB 4.27Å; E488-R497 WeakPolarHBondContact O-CA 3.19Å; C489-R497 WeakPolarHBondContact O-CD 3.49Å; C489-R497 WeakPolarHBondContact O-CG 3.48Å; D491-R497 HydrophobicContact CB-CG 4.18Å; D491-R497 PolarHBondContact O-NE 3.47Å; D491-R497 PolarHBondContact O-NH2 3.16Å; H492-R497 PolarHBondContact O-NH2 2.96Å; P494-R497 PolarHBondContact O-N 2.79Å; E495-R497 VanDerWaalsContact C-N 3.32Å
498	L	98.2	Very high	96.7	Very high	29 Å²	29	47.9 Å²	47.9	15%	0.152	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-60.7	155.2	167.9	-65.4	173.9	0	0	0	111	V417 E488 C502 I503 R506	V417-L498 VanDerWaalsContact CG1-O 3.3Å; V417-L498 WeakPolarHBondContact CG1-O 3.29Å; E488-L498 HydrophobicContact CB-CD1 3.87Å; E488-L498 HydrophobicContact CB-CG 3.87Å; E488-L498 WeakPolarHBondContact OE2-CD2 3.32Å; L498-C502 HydrophobicContact CB-CB 4.43Å; L498-C502 HydrophobicContact CD2-CB 4.36Å; L498-I503 HydrophobicContact CB-CD1 4.26Å; L498-I503 HydrophobicContact CB-CG1 4.05Å; L498-I503 HydrophobicContact CD1-CG1 4.21Å; L498-R506 VanDerWaalsContact CD1-CZ 3.48Å
499	T	98.4	Very high	96.1	Very high	60 Å²	60	49.2 Å²	49.2	37%	0.368	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-81.5	156.8	167.3	72.1	0	0	0	0	110.3	H501 C502 I503	T499-H501 PolarHBondContact O-N 3.37Å; T499-H501 PolarHBondContact OG1-N 2.98Å; T499-C502 PolarHBondContact O-N 3.2Å; T499-C502 VanDerWaalsContact O-N 3.14Å; T499-C502 PolarHBondContact OG1-N 3Å; T499-C502 VanDerWaalsContact OG1-N 3.16Å; T499-C502 PolarHBondContact OG1-SG 3.44Å; T499-I503 WeakPolarHBondContact O-CD1 3.41Å; T499-I503 WeakPolarHBondContact O-CG1 3.45Å; T499-I503 PolarHBondContact O-N 3.15Å
500	A	98.1	Very high	95.1	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-57	-31.5	172.1	0	0	0	0	0	113	V328 A329 M420 I503 A504	V328-A500 HydrophobicContact CB-CB 3.86Å; V328-A500 HydrophobicContact CG1-CB 3.57Å; A329-A500 HydrophobicContact CB-CB 4.08Å; M420-A500 HydrophobicContact CE-CB 4.06Å; A500-I503 PolarHBondContact O-N 3.28Å; A500-A504 PolarHBondContact O-N 3.18Å
501	H	97.4	Very high	93.7	Very high	111 Å²	111	52 Å²	52	51%	0.514	27%	0.272	S	S	.	.	H	α-helix	trans	-65.5	-47.1	175.4	-173.8	53.6	0	0	0	112.1	A329 T499 I503 A504 E505	A329-H501 HydrophobicContact CB-CB 4.3Å; T499-H501 PolarHBondContact O-N 3.37Å; T499-H501 PolarHBondContact OG1-N 2.98Å; H501-I503 PolarHBondContact O-N 3.49Å; H501-A504 WeakPolarHBondContact O-CB 2.95Å; H501-A504 PolarHBondContact O-N 3.09Å; H501-A504 VanDerWaalsContact O-N 3.14Å; H501-E505 IonicContact NE2-OE1 2.74Å; H501-E505 PolarHBondContact O-N 3.1Å
502	C	97.9	Very high	92	Very high	45 Å²	45	56 Å²	56	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-59.4	-34.5	176.2	-63.6	0	0	0	0	112.2	L498 T499 R506	L498-C502 HydrophobicContact CB-CB 4.43Å; L498-C502 HydrophobicContact CD2-CB 4.36Å; T499-C502 PolarHBondContact O-N 3.2Å; T499-C502 VanDerWaalsContact O-N 3.14Å; T499-C502 PolarHBondContact OG1-N 3Å; T499-C502 VanDerWaalsContact OG1-N 3.16Å; T499-C502 PolarHBondContact OG1-SG 3.44Å; C502-R506 WeakPolarHBondContact O-CG 3.38Å; C502-R506 PolarHBondContact O-N 3.43Å; C502-R506 VanDerWaalsContact O-N 3.08Å
503	I	97.6	Very high	90.5	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-71.7	-41.6	178.3	-60.2	156.3	0	0	0	110.3	A325 V417 M420 L424 C489 L498 T499 A500 H501 E505 R506 F507	A325-I503 HydrophobicContact CB-CB 4.33Å; A325-I503 HydrophobicContact CB-CG2 3.87Å; V417-I503 HydrophobicContact CG1-CD1 4.25Å; M420-I503 HydrophobicContact CE-CB 4.48Å; M420-I503 HydrophobicContact CE-CD1 3.29Å; M420-I503 HydrophobicContact CE-CG1 4.48Å; M420-I503 HydrophobicContact CE-CG2 4.48Å; L424-I503 HydrophobicContact CD1-CG2 4.25Å; C489-I503 WeakPolarHBondContact SG-CD1 3.43Å; L498-I503 HydrophobicContact CB-CD1 4.26Å; L498-I503 HydrophobicContact CB-CG1 4.05Å; L498-I503 HydrophobicContact CD1-CG1 4.21Å; T499-I503 WeakPolarHBondContact O-CD1 3.41Å; T499-I503 WeakPolarHBondContact O-CG1 3.45Å; T499-I503 PolarHBondContact O-N 3.15Å; A500-I503 PolarHBondContact O-N 3.28Å; H501-I503 PolarHBondContact O-N 3.49Å; I503-E505 VanDerWaalsContact C-N 3.33Å; I503-E505 PolarHBondContact O-N 2.81Å; I503-R506 PolarHBondContact O-N 2.74Å; I503-F507 HydrophobicContact CG2-CD2 3.99Å; I503-F507 HydrophobicContact CG2-CE2 3.87Å; I503-F507 VanDerWaalsContact O-CD2 3.31Å; I503-F507 WeakPolarHBondContact O-CD2 3.32Å; I503-F507 PolarHBondContact O-N 2.87Å; I503-F507 VanDerWaalsContact O-N 3.08Å
504	A	96.9	Very high	89.1	Confident	6 Å²	6	57.2 Å²	57.2	5%	0.05	29%	0.291	C	S	.	.	H	α-helix	trans	-59	-44.8	174	0	0	0	0	0	111.2	A325 R326 A500 H501 R506 F507 D508	A325-A504 HydrophobicContact CB-CB 4.03Å; R326-A504 HydrophobicContact CG-CB 4.22Å; A500-A504 PolarHBondContact O-N 3.18Å; H501-A504 WeakPolarHBondContact O-CB 2.95Å; H501-A504 PolarHBondContact O-N 3.09Å; H501-A504 VanDerWaalsContact O-N 3.14Å; A504-R506 PolarHBondContact O-N 3.29Å; A504-F507 PolarHBondContact O-N 3.15Å; A504-F507 VanDerWaalsContact O-N 3.15Å; A504-D508 PolarHBondContact O-N 3.3Å
505	E	95.5	Very high	87.7	Confident	96 Å²	96	61.4 Å²	61.4	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-59.4	-43.7	175.1	-70	-177.4	144.8	0	0	112.2	H501 I503 F507 D508 D509	H501-E505 IonicContact NE2-OE1 2.74Å; H501-E505 PolarHBondContact O-N 3.1Å; I503-E505 VanDerWaalsContact C-N 3.33Å; I503-E505 PolarHBondContact O-N 2.81Å; E505-F507 VanDerWaalsContact C-N 3.28Å; E505-F507 PolarHBondContact O-N 3.46Å; E505-D508 PolarHBondContact O-N 2.82Å; E505-D508 VanDerWaalsContact O-N 3.09Å; E505-D509 PolarHBondContact O-N 2.92Å
506	R	94.9	Very high	85.9	Confident	66 Å²	66	59.7 Å²	59.7	25%	0.249	30%	0.301	C	S	.	.	H	α-helix	trans	-60.8	-36.7	176	-73.6	-176.4	-177	-169.3	3.4	112.6	M481 S485 E488 L498 C502 I503 A504 V510	M481-R506 HydrophobicContact CE-CB 4.12Å; M481-R506 WeakPolarHBondContact CE-O 3.09Å; S485-R506 WeakPolarHBondContact OG-CD 3.44Å; S485-R506 PolarHBondContact OG-NH1 3.18Å; E488-R506 VanDerWaalsContact CD-NH2 3.34Å; E488-R506 IonicContact OE1-CZ 2.93Å; E488-R506 VanDerWaalsContact OE1-CZ 3.32Å; E488-R506 IonicContact OE1-NH1 3.87Å; E488-R506 PolarHBondContact OE1-NH1 3.18Å; E488-R506 IonicContact OE1-NH2 3.92Å; E488-R506 PolarHBondContact OE1-NH2 3.43Å; E488-R506 IonicContact OE2-CZ 3.86Å; E488-R506 IonicContact OE2-NH1 2.81Å; E488-R506 IonicContact OE2-NH2 3.61Å; E488-R506 PolarHBondContact OE2-NH2 3.41Å; L498-R506 VanDerWaalsContact CD1-CZ 3.48Å; C502-R506 WeakPolarHBondContact O-CG 3.38Å; C502-R506 PolarHBondContact O-N 3.43Å; C502-R506 VanDerWaalsContact O-N 3.08Å; I503-R506 PolarHBondContact O-N 2.74Å; A504-R506 PolarHBondContact O-N 3.29Å; R506-V510 WeakPolarHBondContact O-CG2 3.44Å; R506-V510 PolarHBondContact O-N 2.87Å
507	F	93.1	Very high	84.2	Confident	5 Å²	5	59.3 Å²	59.3	2%	0.022	30%	0.295	C	S	.	.	H	α-helix	trans	-67.7	-36.5	174.3	-87.2	-75.9	0	0	0	112.3	L317 W318 A325 L424 V482 I503 A504 E505 V510 E511	L317-F507 HydrophobicContact CD2-CE1 4.45Å; W318-F507 AromaticContact CD1-CD1 3.89Å; W318-F507 PolarHBondContact NE1-O 3.02Å; A325-F507 HydrophobicContact CB-CD2 4.22Å; L424-F507 HydrophobicContact CD1-CE2 4.46Å; L424-F507 HydrophobicContact CD2-CE2 4.15Å; L424-F507 HydrophobicContact CD2-CZ 4.01Å; V482-F507 HydrophobicContact CG1-CE1 4.49Å; V482-F507 HydrophobicContact CG1-CZ 3.86Å; V482-F507 HydrophobicContact CG2-CE1 3.93Å; V482-F507 HydrophobicContact CG2-CZ 4.05Å; I503-F507 HydrophobicContact CG2-CD2 3.99Å; I503-F507 HydrophobicContact CG2-CE2 3.87Å; I503-F507 VanDerWaalsContact O-CD2 3.31Å; I503-F507 WeakPolarHBondContact O-CD2 3.32Å; I503-F507 PolarHBondContact O-N 2.87Å; I503-F507 VanDerWaalsContact O-N 3.08Å; A504-F507 PolarHBondContact O-N 3.15Å; A504-F507 VanDerWaalsContact O-N 3.15Å; E505-F507 VanDerWaalsContact C-N 3.28Å; E505-F507 PolarHBondContact O-N 3.46Å; F507-V510 PolarHBondContact O-N 3.2Å; F507-E511 PolarHBondContact O-N 3.02Å
508	D	89	Confident	82.3	Confident	74 Å²	74	63.8 Å²	63.8	40%	0.396	32%	0.32	S	S	.	.	H	α-helix	trans	-69.2	-36.5	177.3	-65.4	-16.3	0	0	0	111.5	A504 E505 V510 E511 Y512	A504-D508 PolarHBondContact O-N 3.3Å; E505-D508 PolarHBondContact O-N 2.82Å; E505-D508 VanDerWaalsContact O-N 3.09Å; D508-V510 VanDerWaalsContact C-N 3.32Å; D508-V510 PolarHBondContact O-N 2.87Å; D508-E511 WeakPolarHBondContact O-CB 3.48Å; D508-E511 PolarHBondContact O-N 3.11Å; D508-Y512 PolarHBondContact O-N 3.03Å
509	D	84.4	Confident	80	Confident	103 Å²	103	66 Å²	66	55%	0.551	34%	0.337	S	S	*	.	H	α-helix	trans	-63.7	-35.6	175.6	-76.3	-19.8	0	0	0	112.6	E505 E511 Y512 L513	E505-D509 PolarHBondContact O-N 2.92Å; D509-E511 VanDerWaalsContact C-N 3.34Å; D509-Y512 WeakPolarHBondContact O-CB 3.36Å; D509-Y512 PolarHBondContact O-N 2.02Å; D509-L513 PolarHBondContact O-N 2.69Å
510	V	77.4	Confident	77.7	Confident	7 Å²	7	66 Å²	66	4%	0.042	34%	0.34	C	S	.	.	H	α-helix	trans	-64.4	-39.5	174.9	169.1	0	0	0	0	111.7	W314 M481 R506 F507 D508 Y512 L513 D514	W314-V510 HydrophobicContact CH2-CG1 4.42Å; W314-V510 HydrophobicContact CZ2-CG1 3.7Å; M481-V510 HydrophobicContact CE-CB 4.46Å; M481-V510 HydrophobicContact CE-CG2 3.1Å; M481-V510 HydrophobicContact SD-CG2 3.33Å; M481-V510 WeakPolarHBondContact SD-CG2 3.41Å; R506-V510 WeakPolarHBondContact O-CG2 3.44Å; R506-V510 PolarHBondContact O-N 2.87Å; F507-V510 PolarHBondContact O-N 3.2Å; D508-V510 VanDerWaalsContact C-N 3.32Å; D508-V510 PolarHBondContact O-N 2.87Å; V510-Y512 PolarHBondContact O-N 3.04Å; V510-L513 PolarHBondContact O-N 3.11Å; V510-L513 VanDerWaalsContact O-N 3.15Å; V510-D514 PolarHBondContact O-N 2.9Å
511	E	70.4	Confident	75.5	Confident	67 Å²	67	70.5 Å²	70.5	31%	0.313	36%	0.364	S	S	.	.	H	α-helix	trans	-60.7	-38.1	177.6	-165.4	-170.7	162.7	0	0	111.2	W318 F507 D508 D509 K515	W318-E511 HydrophobicContact CH2-CB 4.43Å; W318-E511 HydrophobicContact CH2-CG 4Å; W318-E511 WeakPolarHBondContact CH2-OE2 3.33Å; W318-E511 HydrophobicContact CZ2-CB 3.62Å; W318-E511 HydrophobicContact CZ2-CG 3.69Å; W318-E511 VanDerWaalsContact CZ2-OE2 3.27Å; W318-E511 WeakPolarHBondContact CZ2-OE2 3.47Å; F507-E511 PolarHBondContact O-N 3.02Å; D508-E511 WeakPolarHBondContact O-CB 3.48Å; D508-E511 PolarHBondContact O-N 3.11Å; D509-E511 VanDerWaalsContact C-N 3.34Å; E511-K515 HydrophobicContact CG-CD 4.38Å; E511-K515 WeakPolarHBondContact O-CB 2.91Å; E511-K515 VanDerWaalsContact O-CG 3.27Å; E511-K515 WeakPolarHBondContact O-CG 3.46Å; E511-K515 PolarHBondContact O-N 3.07Å; E511-K515 VanDerWaalsContact O-N 3.16Å; E511-K515 WeakPolarHBondContact OE1-CE 3.37Å; E511-K515 IonicContact OE1-NZ 2.69Å; E511-K515 PolarHBondContact OE1-NZ 3.35Å
512	Y	61.4	Low	73.3	Confident	152 Å²	152	68.1 Å²	68.1	60%	0.596	36%	0.359	S	S	*	.	H	α-helix	trans	-66	-40.4	176.6	-176.7	-104.3	0	0	0	112.1	D508 D509 V510 L516	D508-Y512 PolarHBondContact O-N 3.03Å; D509-Y512 WeakPolarHBondContact O-CB 3.36Å; D509-Y512 PolarHBondContact O-N 2.02Å; V510-Y512 PolarHBondContact O-N 3.04Å; Y512-L516 HydrophobicContact CD1-CD1 3.79Å; Y512-L516 HydrophobicContact CE1-CD1 3.29Å; Y512-L516 HydrophobicContact CE1-CG 4.26Å; Y512-L516 HydrophobicContact CE2-CD1 4.47Å; Y512-L516 WeakPolarHBondContact O-CG 3.15Å; Y512-L516 PolarHBondContact O-N 3.43Å; Y512-L516 VanDerWaalsContact O-N 3.16Å
513	L	65.5	Low	71.1	Confident	106 Å²	106	72.7 Å²	72.7	56%	0.555	38%	0.376	S	S	*	.	H	α-helix	trans	-70.7	-43.4	179.5	-68.4	174.5	0	0	0	112.7	D509 V510 K515 L516 S517	D509-L513 PolarHBondContact O-N 2.69Å; V510-L513 PolarHBondContact O-N 3.11Å; V510-L513 VanDerWaalsContact O-N 3.15Å; L513-K515 VanDerWaalsContact C-N 3.31Å; L513-K515 PolarHBondContact O-N 3.08Å; L513-L516 PolarHBondContact O-N 3.24Å; L513-L516 VanDerWaalsContact O-N 3.16Å; L513-S517 PolarHBondContact O-N 2.98Å; L513-S517 PolarHBondContact O-OG 3.27Å
514	D	67.3	Low	68.8	Low	54 Å²	54	79.1 Å²	79.1	29%	0.289	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-38.9	176.9	-80.9	1.3	0	0	0	110.9	W314 V510 L516 S517 D518	W314-D514 PolarHBondContact NE1-OD2 2.04Å; V510-D514 PolarHBondContact O-N 2.9Å; D514-L516 VanDerWaalsContact C-N 3.33Å; D514-L516 PolarHBondContact O-N 2.75Å; D514-S517 WeakPolarHBondContact CA-OG 3.29Å; D514-S517 PolarHBondContact O-N 3.17Å; D514-S517 PolarHBondContact O-OG 3.12Å; D514-D518 PolarHBondContact O-N 2.78Å
515	K	66.5	Low	66.2	Low	116 Å²	116	86 Å²	86	50%	0.504	44%	0.435	S	S	.	.	H	α-helix	trans	-64.2	-35.1	174.4	-78.7	172.8	174.7	167.9	0	113.3	E511 L513 C519	E511-K515 HydrophobicContact CG-CD 4.38Å; E511-K515 WeakPolarHBondContact O-CB 2.91Å; E511-K515 VanDerWaalsContact O-CG 3.27Å; E511-K515 WeakPolarHBondContact O-CG 3.46Å; E511-K515 PolarHBondContact O-N 3.07Å; E511-K515 VanDerWaalsContact O-N 3.16Å; E511-K515 WeakPolarHBondContact OE1-CE 3.37Å; E511-K515 IonicContact OE1-NZ 2.69Å; E511-K515 PolarHBondContact OE1-NZ 3.35Å; L513-K515 VanDerWaalsContact C-N 3.31Å; L513-K515 PolarHBondContact O-N 3.08Å; K515-C519 PolarHBondContact O-N 3.07Å; K515-C519 PolarHBondContact O-SG 3.1Å
516	L	59.1	Low	63.6	Low	83 Å²	83	87.4 Å²	87.4	44%	0.435	44%	0.443	S	S	.	.	H	α-helix	trans	-72.1	-39.1	176.6	-77.4	172.7	0	0	0	111.9	Y512 L513 D514 C519 S520	Y512-L516 HydrophobicContact CD1-CD1 3.79Å; Y512-L516 HydrophobicContact CE1-CD1 3.29Å; Y512-L516 HydrophobicContact CE1-CG 4.26Å; Y512-L516 HydrophobicContact CE2-CD1 4.47Å; Y512-L516 WeakPolarHBondContact O-CG 3.15Å; Y512-L516 PolarHBondContact O-N 3.43Å; Y512-L516 VanDerWaalsContact O-N 3.16Å; L513-L516 PolarHBondContact O-N 3.24Å; L513-L516 VanDerWaalsContact O-N 3.16Å; D514-L516 VanDerWaalsContact C-N 3.33Å; D514-L516 PolarHBondContact O-N 2.75Å; L516-C519 PolarHBondContact O-N 3.14Å; L516-S520 PolarHBondContact O-N 3Å
517	S	60.4	Low	61.2	Low	47 Å²	47	89.6 Å²	89.6	33%	0.329	46%	0.459	S	S	.	.	H	α-helix	trans	-67	-39.4	175.7	52.3	0	0	0	0	112.5	L513 D514 C519 S520 D521	L513-S517 PolarHBondContact O-N 2.98Å; L513-S517 PolarHBondContact O-OG 3.27Å; D514-S517 WeakPolarHBondContact CA-OG 3.29Å; D514-S517 PolarHBondContact O-N 3.17Å; D514-S517 PolarHBondContact O-OG 3.12Å; S517-C519 PolarHBondContact O-N 2.85Å; S517-S520 WeakPolarHBondContact CA-OG 3.47Å; S517-S520 PolarHBondContact O-N 3.48Å; S517-S520 PolarHBondContact O-OG 2.94Å; S517-D521 PolarHBondContact O-N 2.91Å
518	D	58.9	Low	58.9	Low	111 Å²	111	96 Å²	96	59%	0.594	49%	0.489	S	S	*	.	H	α-helix	trans	-65.4	-29.9	175.3	-76.8	-11.6	0	0	0	112	D514 S522	D514-D518 PolarHBondContact O-N 2.78Å; D518-S522 PolarHBondContact O-N 3.06Å; D518-S522 PolarHBondContact O-OG 2.92Å
519	C	49.8	Very low	56.8	Low	76 Å²	76	99.4 Å²	99.4	51%	0.514	50%	0.503	S	S	.	.	H	α-helix	trans	-74.2	-36.2	173.4	-71.7	0	0	0	0	112.5	K515 L516 S517 S522 E523	K515-C519 PolarHBondContact O-N 3.07Å; K515-C519 PolarHBondContact O-SG 3.1Å; L516-C519 PolarHBondContact O-N 3.14Å; S517-C519 PolarHBondContact O-N 2.85Å; C519-S522 WeakPolarHBondContact CA-OG 3.48Å; C519-S522 PolarHBondContact O-N 3.05Å; C519-S522 PolarHBondContact O-OG 3.16Å; C519-E523 PolarHBondContact O-N 3.07Å
520	S	51.1	Low	54.9	Low	60 Å²	60	100.2 Å²	100.2	42%	0.42	51%	0.506	S	S	.	.	H	α-helix	trans	-69.4	-38.1	175.2	58.2	0	0	0	0	112.5	L516 S517 S522 E523 E524	L516-S520 PolarHBondContact O-N 3Å; S517-S520 WeakPolarHBondContact CA-OG 3.47Å; S517-S520 PolarHBondContact O-N 3.48Å; S517-S520 PolarHBondContact O-OG 2.94Å; S520-S522 PolarHBondContact O-N 2.79Å; S520-E523 PolarHBondContact O-N 2.68Å; S520-E524 PolarHBondContact O-N 2.67Å
521	D	51.3	Low	53.4	Low	95 Å²	95	105.2 Å²	105.2	51%	0.508	53%	0.531	S	S	.	.	H	α-helix	trans	-68.8	-24.5	178.8	-75.6	4.4	0	0	0	112.5	S517 K525	S517-D521 PolarHBondContact O-N 2.91Å; D521-K525 PolarHBondContact O-N 3.04Å
522	S	51.5	Low	52.3	Low	61 Å²	61	107.3 Å²	107.3	43%	0.427	55%	0.548	S	S	.	.	H	α-helix	trans	-83.7	-29.5	174.5	46.7	0	0	0	0	113.3	D518 C519 S520 M526	D518-S522 PolarHBondContact O-N 3.06Å; D518-S522 PolarHBondContact O-OG 2.92Å; C519-S522 WeakPolarHBondContact CA-OG 3.48Å; C519-S522 PolarHBondContact O-N 3.05Å; C519-S522 PolarHBondContact O-OG 3.16Å; S520-S522 PolarHBondContact O-N 2.79Å; S522-M526 WeakPolarHBondContact O-CG 3.2Å; S522-M526 PolarHBondContact O-N 3Å
523	E	50.2	Low	51.7	Low	140 Å²	140	105.8 Å²	105.8	65%	0.654	55%	0.554	S	S	*	*	H	α-helix	trans	-72	-36.4	169.9	-72.4	-172.3	160.5	0	0	112.3	C519 S520 M526 L527	C519-E523 PolarHBondContact O-N 3.07Å; S520-E523 PolarHBondContact O-N 2.68Å; E523-M526 PolarHBondContact O-N 2.84Å; E523-L527 PolarHBondContact O-N 2.87Å; E523-L527 VanDerWaalsContact O-N 3.16Å
524	E	49.3	Very low	50.7	Low	136 Å²	136	108 Å²	108	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-67.2	-38.4	172.7	-94	-173	164.3	0	0	112.5	S520 M526 L527 E528	S520-E524 PolarHBondContact O-N 2.67Å; E524-M526 VanDerWaalsContact C-N 3.31Å; E524-M526 PolarHBondContact O-N 2.87Å; E524-L527 PolarHBondContact O-N 3.09Å; E524-L527 VanDerWaalsContact O-N 3.13Å; E524-E528 PolarHBondContact O-N 2.88Å
525	K	42.9	Very low	49.7	Very low	151 Å²	151	114 Å²	114	66%	0.657	59%	0.593	S	S	*	*	H	α-helix	trans	-62.9	-34.7	173	-100.4	175.9	177.6	165.4	0	113.5	D521 E529	D521-K525 PolarHBondContact O-N 3.04Å; K525-E529 PolarHBondContact O-N 3.03Å; K525-E529 VanDerWaalsContact O-N 3.15Å
526	M	42.1	Very low	48.4	Very low	126 Å²	126	121.1 Å²	121.1	62%	0.621	62%	0.624	S	S	*	*	H	α-helix	trans	-68.7	-34.1	173.7	-76.2	-107.9	-62.1	0	0	112	S522 E523 E524 I530	S522-M526 WeakPolarHBondContact O-CG 3.2Å; S522-M526 PolarHBondContact O-N 3Å; E523-M526 PolarHBondContact O-N 2.84Å; E524-M526 VanDerWaalsContact C-N 3.31Å; E524-M526 PolarHBondContact O-N 2.87Å; M526-I530 VanDerWaalsContact O-CD1 3.32Å; M526-I530 WeakPolarHBondContact O-CD1 3.37Å; M526-I530 WeakPolarHBondContact O-CG1 3.39Å; M526-I530 PolarHBondContact O-N 3.28Å
527	L	43.7	Very low	47.9	Very low	112 Å²	112	123 Å²	123	59%	0.586	63%	0.633	S	S	*	*	H	α-helix	trans	-73.5	-35.6	175.7	-105.5	112.7	0	0	0	112.8	E523 E524 I530 I531	E523-L527 PolarHBondContact O-N 2.87Å; E523-L527 VanDerWaalsContact O-N 3.16Å; E524-L527 PolarHBondContact O-N 3.09Å; E524-L527 VanDerWaalsContact O-N 3.13Å; L527-I530 PolarHBondContact O-N 2.82Å; L527-I531 WeakPolarHBondContact O-CG1 3.49Å; L527-I531 PolarHBondContact O-N 3.44Å
528	E	45.8	Very low	47.2	Very low	138 Å²	138	127 Å²	127	65%	0.645	65%	0.65	S	S	*	*	H	α-helix	trans	-68.9	-37	174.5	-78.9	-169.6	150.2	0	0	112.7	E524 I530 I531 V532	E524-E528 PolarHBondContact O-N 2.88Å; E528-I530 VanDerWaalsContact C-N 3.33Å; E528-I530 PolarHBondContact O-N 2.81Å; E528-I531 PolarHBondContact O-N 3.06Å; E528-V532 WeakPolarHBondContact O-CG2 3.44Å; E528-V532 PolarHBondContact O-N 2.96Å
529	E	43.2	Very low	46.5	Very low	146 Å²	146	127.9 Å²	127.9	68%	0.682	65%	0.653	S	S	*	*	H	α-helix	trans	-68.6	-29.4	174.3	-80.2	-170.2	165.6	0	0	113	K525 V533	K525-E529 PolarHBondContact O-N 3.03Å; K525-E529 VanDerWaalsContact O-N 3.15Å; E529-V533 WeakPolarHBondContact O-CG2 2.97Å
530	I	46	Very low	46.4	Very low	120 Å²	120	130.9 Å²	130.9	62%	0.615	66%	0.661	S	S	*	*	H	α-helix	trans	-72.4	-34.6	175.6	-69.4	165.8	0	0	0	111.4	M526 L527 E528	M526-I530 VanDerWaalsContact O-CD1 3.32Å; M526-I530 WeakPolarHBondContact O-CD1 3.37Å; M526-I530 WeakPolarHBondContact O-CG1 3.39Å; M526-I530 PolarHBondContact O-N 3.28Å; L527-I530 PolarHBondContact O-N 2.82Å; E528-I530 VanDerWaalsContact C-N 3.33Å; E528-I530 PolarHBondContact O-N 2.81Å
531	I	45.8	Very low	46.1	Very low	113 Å²	113	135.4 Å²	135.4	58%	0.579	68%	0.676	S	S	*	*	H	α-helix	trans	-73.4	-31.5	179.4	-66.3	167.3	0	0	0	111.5	L527 E528 V533	L527-I531 WeakPolarHBondContact O-CG1 3.49Å; L527-I531 PolarHBondContact O-N 3.44Å; E528-I531 PolarHBondContact O-N 3.06Å; I531-V533 VanDerWaalsContact C-N 3.32Å; I531-V533 PolarHBondContact O-N 3.2Å
532	V	46.8	Very low	45.7	Very low	111 Å²	111	138.1 Å²	138.1	67%	0.673	69%	0.687	S	S	*	*	H	α-helix	trans	-76.5	-16.7	180	176.5	0	0	0	0	113.1	E528	E528-V532 WeakPolarHBondContact O-CG2 3.44Å; E528-V532 PolarHBondContact O-N 2.96Å
533	V	48	Very low	45.3	Very low	119 Å²	119	143.6 Å²	143.6	72%	0.721	71%	0.706	S	S	*	*	H	α-helix	trans	-85.2	-16.1	178.4	177.3	0	0	0	0	112.9	E529 I531	E529-V533 WeakPolarHBondContact O-CG2 2.97Å; I531-V533 VanDerWaalsContact C-N 3.32Å; I531-V533 PolarHBondContact O-N 3.2Å
534	D	45.8	Very low	44.9	Very low	152 Å²	152	143.8 Å²	143.8	81%	0.813	71%	0.71	S	S	*	*	S	Bend	trans	-95.5	2.3	-178.1	-138.8	9.5	0	0	0	114.1
535	E	45.9	Very low	44.6	Very low	180 Å²	180	144.5 Å²	144.5	84%	0.841	72%	0.716	S	S	*	*			trans	-117.7	30.4	176.5	-80.6	-161	154.6	0	0	114.8
536	K	38.8	Very low	44.7	Very low	266 Å²	266	143.9 Å²	143.9	100%	1.157	72%	0.721	S	S	*	*			trans	-127.3	0	172.2	-101.8	-175.9	-179.2	172.3	0	115.9

Retrieved 536 of 536 residues in 933.4 ms (Link to these results)

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