A0A087WVX5_HUMAN Loading...

Voltage-dependent L-type calcium channel subunit beta-2

Beta subunit of voltage-dependent calcium channels which contributes to the function of the calcium channel by increasing peak calcium current. Plays a role in shifting voltage dependencies of activation and inactivation of the channel. May modulate G protein inhibition. May contribute to beta-adrenergic augmentation of Ca(2+) influx in cardiomyocytes, thereby regulating increases in heart rate and contractile force. Involved in membrane targeting of the alpha-1 subunit CACNA1C.

AlphaFold DB , UniProt , Accession A0A087WVX5, Species HUMAN (Homo sapiens, Human), Gene CACNB2, Length 581 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	35.4	Very low	233 Å²	233	168.6 Å²	168.6	100%	1.148	85%	0.846	S	S	*	*				0	162.5	0	-74.8	169.1	165	0	0	108.8
2	Q	34.8	Very low	35.5	Very low	176 Å²	176	164.3 Å²	164.3	82%	0.822	83%	0.834	S	S	*	*			trans	4.6	144.3	153.4	-64	166	-26.7	0	0	119
3	C	33.6	Very low	35.5	Very low	119 Å²	119	170.6 Å²	170.6	80%	0.804	84%	0.841	S	S	*	*			cis	-162.2	168.7	0.1	-115.7	0	0	0	0	111.2
4	C	34.8	Very low	35.7	Very low	129 Å²	129	166.7 Å²	166.7	87%	0.872	83%	0.832	S	S	*	*			trans	-76.8	156.8	169.2	-62	0	0	0	0	112.4
5	G	35.6	Very low	36	Very low	77 Å²	77	163.5 Å²	163.5	79%	0.794	83%	0.831	S	S	*	*			trans	-157	86.1	174	0	0	0	0	0	113.3
6	L	35.3	Very low	36.4	Very low	157 Å²	157	167.4 Å²	167.4	82%	0.822	84%	0.835	S	S	*	*			trans	-77.4	159	159.9	-88.2	76.6	0	0	0	109.6
7	V	39.3	Very low	36.5	Very low	121 Å²	121	161.8 Å²	161.8	73%	0.733	83%	0.829	S	S	*	*				171.4	112.2	117	153.9	0	0	0	0	111.8
8	H	35.4	Very low	36.7	Very low	149 Å²	149	158.8 Å²	158.8	69%	0.69	83%	0.825	S	S	*	*			trans	53.6	162.1	138	-64.4	71	0	0	0	123.5
9	R	35.4	Very low	37	Very low	216 Å²	216	155.3 Å²	155.3	82%	0.815	82%	0.822	S	S	*	*			cis	174.9	114.5	-31.7	-178.8	-178.7	-166.3	-170.8	8.7	108.7
10	R	35.2	Very low	37.3	Very low	252 Å²	252	154.1 Å²	154.1	95%	0.951	82%	0.816	S	S	*	*			trans	-168	151.8	163.5	-104.9	173.5	-158.3	-162	5.6	110.7
11	R	35.3	Very low	37.6	Very low	226 Å²	226	151.9 Å²	151.9	85%	0.853	81%	0.813	S	S	*	*				-161.7	113	-63.8	174.6	179.2	-175.5	175.4	2.3	108
12	V	36.4	Very low	37.9	Very low	116 Å²	116	150.6 Å²	150.6	70%	0.703	80%	0.797	S	S	*	*			trans	58.9	117.3	156.1	178.8	0	0	0	0	118.5
13	R	34.8	Very low	38.6	Very low	247 Å²	247	148.2 Å²	148.2	93%	0.932	79%	0.794	S	S	*	*				-137.2	144.5	109.4	-97.2	-171.3	-176	-171.7	1.4	110.1
14	V	38.4	Very low	39.5	Very low	116 Å²	116	146.7 Å²	146.7	70%	0.703	79%	0.785	S	S	*	*			trans	-94.4	139.8	174	174.5	0	0	0	0	107.8	Y16	V14-Y16 HydrophobicContact CG1-CD2 4.08Å; V14-Y16 HydrophobicContact CG1-CE2 4.24Å
15	S	40.1	Very low	40.5	Very low	118 Å²	118	149.8 Å²	149.8	83%	0.825	78%	0.778	S	S	*	*			trans	-130	132.5	156	-168.1	0	0	0	0	107.6
16	Y	43.1	Very low	41.2	Very low	226 Å²	226	150.8 Å²	150.8	89%	0.886	77%	0.771	S	S	*	*			trans	-74.4	148.4	172.6	-88.8	-111.4	0	0	0	110	V14	V14-Y16 HydrophobicContact CG1-CD2 4.08Å; V14-Y16 HydrophobicContact CG1-CE2 4.24Å
17	G	38.5	Very low	41.8	Very low	72 Å²	72	146.5 Å²	146.5	74%	0.742	75%	0.754	S	S	*	*			trans	172.1	109.4	175.6	0	0	0	0	0	109.3	A19	G17-A19 PolarHBondContact O-N 2.78Å
18	S	39.9	Very low	42.5	Very low	108 Å²	108	146.4 Å²	146.4	76%	0.755	75%	0.75	S	S	*	*			trans	-62.9	131.7	-177.3	-101.6	0	0	0	0	111.9	D20	S18-D20 VanDerWaalsContact C-N 3.33Å; S18-D20 WeakPolarHBondContact CB-OD2 3.03Å; S18-D20 PolarHBondContact OG-OD2 2.9Å
19	A	42.3	Very low	43.3	Very low	93 Å²	93	143 Å²	143	77%	0.769	74%	0.743	S	S	*	*			trans	-101.5	36.9	170.7	0	0	0	0	0	111	G17 S21	G17-A19 PolarHBondContact O-N 2.78Å; A19-S21 PolarHBondContact O-N 2.7Å
20	D	41.9	Very low	44.1	Very low	131 Å²	131	137.8 Å²	137.8	70%	0.701	73%	0.731	S	S	*	*			trans	-79.9	63.1	179.8	-61.7	-67.1	0	0	0	110.7	S18 Y22	S18-D20 VanDerWaalsContact C-N 3.33Å; S18-D20 WeakPolarHBondContact CB-OD2 3.03Å; S18-D20 PolarHBondContact OG-OD2 2.9Å; D20-Y22 PolarHBondContact O-N 3.04Å
21	S	45.2	Very low	45	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	71%	0.707	S	S	*	*			trans	-71.3	76.6	169.5	-63.5	0	0	0	0	109.7	A19 T23	A19-S21 PolarHBondContact O-N 2.7Å; S21-T23 VanDerWaalsContact C-N 3.26Å; S21-T23 PolarHBondContact O-N 2.85Å
22	Y	41.3	Very low	46.1	Very low	206 Å²	206	121.3 Å²	121.3	81%	0.808	69%	0.686	S	S	*	*			trans	-67.1	85.4	176.5	-164.3	-87.8	0	0	0	109.3	D20 S24	D20-Y22 PolarHBondContact O-N 3.04Å; Y22-S24 VanDerWaalsContact C-N 3.26Å; Y22-S24 WeakPolarHBondContact CD1-OG 3.45Å; Y22-S24 PolarHBondContact O-N 2.71Å
23	T	49.3	Very low	47.2	Very low	125 Å²	125	120.4 Å²	120.4	77%	0.767	68%	0.676	S	S	*	*			trans	-66.8	91.3	166.2	53.5	0	0	0	0	107	S21 R25	S21-T23 VanDerWaalsContact C-N 3.26Å; S21-T23 PolarHBondContact O-N 2.85Å; T23-R25 PolarHBondContact O-N 2.92Å
24	S	53	Low	48.4	Very low	87 Å²	87	114.8 Å²	114.8	61%	0.608	66%	0.661	S	S	*	*			trans	-54.2	107.7	172.9	-61.7	0	0	0	0	108.5	Y22	Y22-S24 VanDerWaalsContact C-N 3.26Å; Y22-S24 WeakPolarHBondContact CD1-OG 3.45Å; Y22-S24 PolarHBondContact O-N 2.71Å
25	R	55.2	Low	49.5	Very low	194 Å²	194	115.6 Å²	115.6	73%	0.732	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-56.6	129.9	158.3	-69.3	174.7	67.9	178.4	-1.5	105.6	T23 S27 D28	T23-R25 PolarHBondContact O-N 2.92Å; R25-S27 PolarHBondContact O-N 3.17Å; R25-D28 IonicContact NH2-OD2 3.92Å
26	P	50.3	Low	51.2	Low	98 Å²	98	114.5 Å²	114.5	64%	0.636	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-56.7	128.7	161.5	26.9	-32.2	0	0	0	106.4	D28	P26-D28 PolarHBondContact O-N 3.07Å
27	S	48.4	Very low	52.9	Low	67 Å²	67	111.9 Å²	111.9	47%	0.469	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-65.1	129.3	178.4	-61.1	0	0	0	0	108.3	R25 S29 D30	R25-S27 PolarHBondContact O-N 3.17Å; S27-S29 WeakPolarHBondContact CB-OG 3.44Å; S27-S29 PolarHBondContact O-N 2.88Å; S27-D30 PolarHBondContact O-N 3.43Å
28	D	52.6	Low	55	Low	120 Å²	120	113.4 Å²	113.4	64%	0.642	62%	0.618	S	S	*	*	H	α-helix	trans	-57	-18.2	178.3	-63.9	-66.9	0	0	0	112.3	R25 P26 V31	R25-D28 IonicContact NH2-OD2 3.92Å; P26-D28 PolarHBondContact O-N 3.07Å; D28-V31 VanDerWaalsContact O-CG2 3.3Å; D28-V31 WeakPolarHBondContact O-CG2 3.3Å
29	S	52.4	Low	57.1	Low	78 Å²	78	110.2 Å²	110.2	55%	0.545	60%	0.598	S	S	.	*	H	α-helix	trans	-75.1	-28.6	172.4	59.3	0	0	0	0	115.6	S27 L33	S27-S29 WeakPolarHBondContact CB-OG 3.44Å; S27-S29 PolarHBondContact O-N 2.88Å; S29-L33 WeakPolarHBondContact O-CG 3.29Å
30	D	52.5	Low	59.3	Low	105 Å²	105	110.8 Å²	110.8	56%	0.561	59%	0.592	S	S	*	*	H	α-helix	trans	-78.5	-45.9	-178.9	-114.1	-28.3	0	0	0	110.2	S27 S32 L33 E34	S27-D30 PolarHBondContact O-N 3.43Å; D30-S32 VanDerWaalsContact C-N 3.26Å; D30-S32 PolarHBondContact O-N 3.23Å; D30-L33 PolarHBondContact O-N 3.37Å; D30-L33 VanDerWaalsContact O-N 3.08Å; D30-E34 PolarHBondContact O-N 2.96Å; D30-E34 VanDerWaalsContact O-N 3.07Å
31	V	54.9	Low	61.4	Low	76 Å²	76	113.3 Å²	113.3	46%	0.461	59%	0.592	S	S	.	*	H	α-helix	trans	-59.6	-37.1	176.1	-64.4	0	0	0	0	111.8	D28 L33 E34 E35	D28-V31 VanDerWaalsContact O-CG2 3.3Å; D28-V31 WeakPolarHBondContact O-CG2 3.3Å; V31-L33 VanDerWaalsContact C-N 3.34Å; V31-L33 PolarHBondContact O-N 3.48Å; V31-E34 PolarHBondContact O-N 3.42Å; V31-E35 VanDerWaalsContact O-CB 3.25Å; V31-E35 WeakPolarHBondContact O-CB 3.44Å; V31-E35 PolarHBondContact O-N 2.77Å
32	S	58	Low	63.5	Low	57 Å²	57	113.5 Å²	113.5	40%	0.399	58%	0.576	S	S	.	*	H	α-helix	trans	-63.8	-36.3	175.6	-172.2	0	0	0	0	112.9	D30 D36	D30-S32 VanDerWaalsContact C-N 3.26Å; D30-S32 PolarHBondContact O-N 3.23Å; S32-D36 WeakPolarHBondContact O-CB 3.48Å; S32-D36 PolarHBondContact O-N 3.04Å
33	L	58.5	Low	65.9	Low	97 Å²	97	107.1 Å²	107.1	51%	0.508	55%	0.553	S	S	.	*	H	α-helix	trans	-79	-27	179.7	-69.4	175.1	0	0	0	112.7	S29 D30 V31 R37	S29-L33 WeakPolarHBondContact O-CG 3.29Å; D30-L33 PolarHBondContact O-N 3.37Å; D30-L33 VanDerWaalsContact O-N 3.08Å; V31-L33 VanDerWaalsContact C-N 3.34Å; V31-L33 PolarHBondContact O-N 3.48Å; L33-R37 WeakPolarHBondContact O-CD 3.48Å; L33-R37 VanDerWaalsContact O-CG 3.22Å; L33-R37 WeakPolarHBondContact O-CG 3.49Å; L33-R37 PolarHBondContact O-N 3.29Å
34	E	61	Low	67.8	Low	129 Å²	129	103.8 Å²	103.8	60%	0.603	54%	0.538	S	S	*	.	H	α-helix	trans	-75.6	-40	168.7	-62.3	-130.6	112.3	0	0	111.4	D30 V31 R37 E38	D30-E34 PolarHBondContact O-N 2.96Å; D30-E34 VanDerWaalsContact O-N 3.07Å; V31-E34 PolarHBondContact O-N 3.42Å; E34-R37 PolarHBondContact O-N 2.87Å; E34-E38 PolarHBondContact O-N 3.16Å
35	E	61.9	Low	69.8	Low	133 Å²	133	103.1 Å²	103.1	62%	0.621	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-42.8	175.3	-174	169.5	-167.1	0	0	111.8	V31 R37 E38 A39	V31-E35 VanDerWaalsContact O-CB 3.25Å; V31-E35 WeakPolarHBondContact O-CB 3.44Å; V31-E35 PolarHBondContact O-N 2.77Å; E35-R37 VanDerWaalsContact C-N 3.34Å; E35-R37 PolarHBondContact O-N 3.36Å; E35-E38 PolarHBondContact O-N 3Å; E35-A39 WeakPolarHBondContact O-CB 3.43Å; E35-A39 PolarHBondContact O-N 3.49Å
36	D	74.2	Confident	71.6	Confident	95 Å²	95	100.5 Å²	100.5	51%	0.508	52%	0.516	S	S	.	.	H	α-helix	trans	-58.7	-42.9	172.1	-86	-21.7	0	0	0	112	S32 A39 V40	S32-D36 WeakPolarHBondContact O-CB 3.48Å; S32-D36 PolarHBondContact O-N 3.04Å; D36-A39 PolarHBondContact O-N 3.29Å; D36-V40 WeakPolarHBondContact O-CG2 3.32Å; D36-V40 PolarHBondContact O-N 3.17Å
37	R	80.4	Confident	73.7	Confident	170 Å²	170	101.3 Å²	101.3	64%	0.642	51%	0.511	S	S	*	.	H	α-helix	trans	-67.3	-40.5	178.2	-74.5	168	177.9	171.8	2	112.2	L33 E34 E35 R41	L33-R37 WeakPolarHBondContact O-CD 3.48Å; L33-R37 VanDerWaalsContact O-CG 3.22Å; L33-R37 WeakPolarHBondContact O-CG 3.49Å; L33-R37 PolarHBondContact O-N 3.29Å; E34-R37 PolarHBondContact O-N 2.87Å; E35-R37 VanDerWaalsContact C-N 3.34Å; E35-R37 PolarHBondContact O-N 3.36Å; R37-R41 PolarHBondContact O-N 3.41Å
38	E	81.8	Confident	75.9	Confident	104 Å²	104	98.2 Å²	98.2	49%	0.486	49%	0.489	S	S	.	.	H	α-helix	trans	-71.4	-36.2	176.4	-150.6	-160.5	134.7	0	0	111.2	E34 E35 R41 R42	E34-E38 PolarHBondContact O-N 3.16Å; E35-E38 PolarHBondContact O-N 3Å; E38-R41 PolarHBondContact O-N 2.84Å; E38-R42 VanDerWaalsContact O-CB 3.25Å; E38-R42 WeakPolarHBondContact O-CB 3.29Å; E38-R42 PolarHBondContact O-N 3.46Å; E38-R42 IonicContact OE1-CZ 2.75Å; E38-R42 IonicContact OE1-NE 3.24Å; E38-R42 IonicContact OE1-NH2 2.77Å; E38-R42 PolarHBondContact OE1-NH2 2.87Å; E38-R42 IonicContact OE2-NH2 2.78Å
39	A	84.6	Confident	77.9	Confident	41 Å²	41	95 Å²	95	34%	0.339	47%	0.471	S	S	.	.	H	α-helix	trans	-61.4	-45.1	172.8	0	0	0	0	0	111.7	E35 D36 R41 R42 E43	E35-A39 WeakPolarHBondContact O-CB 3.43Å; E35-A39 PolarHBondContact O-N 3.49Å; D36-A39 PolarHBondContact O-N 3.29Å; A39-R41 VanDerWaalsContact C-N 3.35Å; A39-R41 PolarHBondContact O-N 2.95Å; A39-R42 PolarHBondContact O-N 2.95Å; A39-E43 VanDerWaalsContact O-CB 3.26Å; A39-E43 WeakPolarHBondContact O-CB 3.2Å; A39-E43 PolarHBondContact O-N 2.75Å
40	V	88.3	Confident	80	Confident	105 Å²	105	94.3 Å²	94.3	64%	0.636	47%	0.469	S	S	*	.	H	α-helix	trans	-62	-39.9	173.6	168.9	0	0	0	0	111.8	D36 E43 A44	D36-V40 WeakPolarHBondContact O-CG2 3.32Å; D36-V40 PolarHBondContact O-N 3.17Å; V40-E43 PolarHBondContact O-N 3.4Å; V40-A44 WeakPolarHBondContact O-CB 3.49Å; V40-A44 PolarHBondContact O-N 3.21Å
41	R	86.1	Confident	82	Confident	185 Å²	185	92.1 Å²	92.1	70%	0.698	46%	0.456	S	S	*	.	H	α-helix	trans	-63.1	-48.2	174.7	-172.4	-173.9	-61.3	177.3	2.6	111.6	R37 E38 A39 E43 A44 E45	R37-R41 PolarHBondContact O-N 3.41Å; E38-R41 PolarHBondContact O-N 2.84Å; A39-R41 VanDerWaalsContact C-N 3.35Å; A39-R41 PolarHBondContact O-N 2.95Å; R41-E43 VanDerWaalsContact C-N 3.28Å; R41-E43 PolarHBondContact O-N 3.19Å; R41-A44 PolarHBondContact O-N 3.01Å; R41-E45 WeakPolarHBondContact O-CB 3.34Å; R41-E45 PolarHBondContact O-N 3.39Å
42	R	88.4	Confident	83.9	Confident	112 Å²	112	88.5 Å²	88.5	42%	0.423	43%	0.434	S	S	.	.	H	α-helix	trans	-66.9	-29	-179.3	-158.3	-176.4	-55.9	119	-7.2	112.3	E38 A39 R46	E38-R42 VanDerWaalsContact O-CB 3.25Å; E38-R42 WeakPolarHBondContact O-CB 3.29Å; E38-R42 PolarHBondContact O-N 3.46Å; E38-R42 IonicContact OE1-CZ 2.75Å; E38-R42 IonicContact OE1-NE 3.24Å; E38-R42 IonicContact OE1-NH2 2.77Å; E38-R42 PolarHBondContact OE1-NH2 2.87Å; E38-R42 IonicContact OE2-NH2 2.78Å; A39-R42 PolarHBondContact O-N 2.95Å; R42-R46 WeakPolarHBondContact O-CB 3.14Å; R42-R46 PolarHBondContact O-N 3.46Å
43	E	91.1	Very high	85.6	Confident	72 Å²	72	89.8 Å²	89.8	34%	0.336	43%	0.433	S	S	.	.	H	α-helix	trans	-68.3	-50.3	169.3	-177.7	58.1	-130.6	0	0	111.1	A39 V40 R41 E45 R46 Q47	A39-E43 VanDerWaalsContact O-CB 3.26Å; A39-E43 WeakPolarHBondContact O-CB 3.2Å; A39-E43 PolarHBondContact O-N 2.75Å; V40-E43 PolarHBondContact O-N 3.4Å; R41-E43 VanDerWaalsContact C-N 3.28Å; R41-E43 PolarHBondContact O-N 3.19Å; E43-E45 PolarHBondContact O-N 3.45Å; E43-R46 PolarHBondContact O-N 3.34Å; E43-R46 IonicContact OE1-CZ 2.74Å; E43-R46 IonicContact OE1-NH1 2.65Å; E43-R46 PolarHBondContact OE1-NH1 3.38Å; E43-R46 IonicContact OE2-CZ 2.7Å; E43-R46 IonicContact OE2-NH1 3.16Å; E43-R46 PolarHBondContact OE2-NH1 3.45Å; E43-R46 IonicContact OE2-NH2 3.82Å; E43-R46 PolarHBondContact OE2-NH2 2.93Å; E43-Q47 WeakPolarHBondContact O-CG 3.22Å; E43-Q47 PolarHBondContact O-N 3.24Å; E43-Q47 PolarHBondContact OE1-NE2 2.82Å
44	A	91	Very high	87.2	Confident	54 Å²	54	92 Å²	92	45%	0.446	44%	0.439	S	S	.	.	H	α-helix	trans	-61.4	-41	178.1	0	0	0	0	0	112.6	V40 R41 Q47 A48	V40-A44 WeakPolarHBondContact O-CB 3.49Å; V40-A44 PolarHBondContact O-N 3.21Å; R41-A44 PolarHBondContact O-N 3.01Å; A44-Q47 PolarHBondContact O-N 3.33Å; A44-A48 WeakPolarHBondContact O-CB 3.45Å; A44-A48 PolarHBondContact O-N 3.37Å
45	E	93.3	Very high	88.8	Confident	74 Å²	74	85.9 Å²	85.9	35%	0.346	41%	0.411	S	S	.	.	H	α-helix	trans	-59.1	-46.5	173.2	-176.3	-175.8	170.7	0	0	111.4	R41 E43 Q47 A48 Q49 V80	R41-E45 WeakPolarHBondContact O-CB 3.34Å; R41-E45 PolarHBondContact O-N 3.39Å; E43-E45 PolarHBondContact O-N 3.45Å; E45-Q47 VanDerWaalsContact C-N 3.32Å; E45-Q47 PolarHBondContact O-N 3.07Å; E45-A48 WeakPolarHBondContact O-CB 3.42Å; E45-A48 PolarHBondContact O-N 3.36Å; E45-Q49 PolarHBondContact O-N 3.36Å; E45-V80 HydrophobicContact CG-CG1 4.26Å; E45-V80 HydrophobicContact CG-CG2 4.31Å
46	R	94	Very high	90.2	Very high	138 Å²	138	81.3 Å²	81.3	52%	0.521	39%	0.388	S	S	.	.	H	α-helix	trans	-65.4	-35.5	178.2	-152.6	-169.5	-30.7	97.9	3	112.2	R42 E43 A50	R42-R46 WeakPolarHBondContact O-CB 3.14Å; R42-R46 PolarHBondContact O-N 3.46Å; E43-R46 PolarHBondContact O-N 3.34Å; E43-R46 IonicContact OE1-CZ 2.74Å; E43-R46 IonicContact OE1-NH1 2.65Å; E43-R46 PolarHBondContact OE1-NH1 3.38Å; E43-R46 IonicContact OE2-CZ 2.7Å; E43-R46 IonicContact OE2-NH1 3.16Å; E43-R46 PolarHBondContact OE2-NH1 3.45Å; E43-R46 IonicContact OE2-NH2 3.82Å; E43-R46 PolarHBondContact OE2-NH2 2.93Å; R46-A50 WeakPolarHBondContact O-CB 3.19Å; R46-A50 PolarHBondContact O-N 3.3Å
47	Q	94.1	Very high	91	Very high	115 Å²	115	82.1 Å²	82.1	54%	0.537	40%	0.397	S	S	.	.	H	α-helix	trans	-68.4	-40.4	173.7	-69.6	176.8	19.7	0	0	111.6	E43 A44 E45 A50 Q51	E43-Q47 WeakPolarHBondContact O-CG 3.22Å; E43-Q47 PolarHBondContact O-N 3.24Å; E43-Q47 PolarHBondContact OE1-NE2 2.82Å; A44-Q47 PolarHBondContact O-N 3.33Å; E45-Q47 VanDerWaalsContact C-N 3.32Å; E45-Q47 PolarHBondContact O-N 3.07Å; Q47-A50 PolarHBondContact O-N 3.44Å; Q47-Q51 PolarHBondContact O-N 3.05Å
48	A	95.2	Very high	91.6	Very high	2 Å²	2	76.6 Å²	76.6	2%	0.017	38%	0.378	C	S	.	.	H	α-helix	trans	-62.5	-44.3	173.9	0	0	0	0	0	111.7	A44 E45 Q51 L52 P79 V80 F99 F117	A44-A48 WeakPolarHBondContact O-CB 3.45Å; A44-A48 PolarHBondContact O-N 3.37Å; E45-A48 WeakPolarHBondContact O-CB 3.42Å; E45-A48 PolarHBondContact O-N 3.36Å; A48-Q51 PolarHBondContact O-N 2.9Å; A48-L52 WeakPolarHBondContact O-CB 3.29Å; A48-L52 PolarHBondContact O-N 3.36Å; A48-P79 HydrophobicContact CB-CB 3.81Å; A48-V80 HydrophobicContact CB-CG2 3.76Å; A48-F99 HydrophobicContact CB-CE2 3.95Å; A48-F99 HydrophobicContact CB-CZ 3.69Å; A48-F117 HydrophobicContact CB-CZ 4.1Å
49	Q	95.1	Very high	92.1	Very high	53 Å²	53	76.7 Å²	76.7	25%	0.248	39%	0.387	C	S	.	.	H	α-helix	trans	-63.5	-42.1	174.1	-171.9	61.8	27.8	0	0	111.9	E45 Q51 L52 E53 V80	E45-Q49 PolarHBondContact O-N 3.36Å; Q49-Q51 VanDerWaalsContact C-N 3.3Å; Q49-Q51 PolarHBondContact O-N 3.08Å; Q49-L52 WeakPolarHBondContact O-CB 3.16Å; Q49-L52 PolarHBondContact O-N 3.5Å; Q49-L52 VanDerWaalsContact O-N 3.15Å; Q49-E53 PolarHBondContact NE2-OE1 3.11Å; Q49-E53 PolarHBondContact O-N 3.31Å; Q49-V80 HydrophobicContact CB-CG2 4.03Å
50	A	94.9	Very high	92.7	Very high	63 Å²	63	75.7 Å²	75.7	52%	0.521	38%	0.377	S	S	.	.	H	α-helix	trans	-63.1	-35.6	176.6	0	0	0	0	0	112.5	R46 Q47 K54	R46-A50 WeakPolarHBondContact O-CB 3.19Å; R46-A50 PolarHBondContact O-N 3.3Å; Q47-A50 PolarHBondContact O-N 3.44Å; A50-K54 VanDerWaalsContact O-CB 3.29Å; A50-K54 WeakPolarHBondContact O-CB 3.3Å; A50-K54 PolarHBondContact O-N 3.24Å; A50-K54 VanDerWaalsContact O-N 3.07Å
51	Q	95.2	Very high	93	Very high	59 Å²	59	73.9 Å²	73.9	28%	0.276	37%	0.373	S	S	.	.	H	α-helix	trans	-70	-39.3	172.1	-172.1	168.6	-4.5	0	0	111.9	Q47 A48 Q49 K54 A55 E97 F99 I105	Q47-Q51 PolarHBondContact O-N 3.05Å; A48-Q51 PolarHBondContact O-N 2.9Å; Q49-Q51 VanDerWaalsContact C-N 3.3Å; Q49-Q51 PolarHBondContact O-N 3.08Å; Q51-K54 CarbonylContact O-C 3.53Å; Q51-K54 PolarHBondContact O-N 3.28Å; Q51-A55 WeakPolarHBondContact O-CB 3.26Å; Q51-A55 PolarHBondContact O-N 2.97Å; Q51-E97 VanDerWaalsContact NE2-CD 3.35Å; Q51-E97 PolarHBondContact NE2-OE2 3.49Å; Q51-E97 VanDerWaalsContact NE2-OE2 3.17Å; Q51-F99 HydrophobicContact CG-CD2 4.48Å; Q51-F99 VanDerWaalsContact OE1-CD2 3.31Å; Q51-I105 HydrophobicContact CB-CD1 4.49Å; Q51-I105 HydrophobicContact CG-CD1 3.92Å
52	L	94.4	Very high	93.5	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-61.9	-45.2	176.9	-172.8	61.8	0	0	0	112.2	A48 Q49 A55 K56 M83 I105 I115 F117	A48-L52 WeakPolarHBondContact O-CB 3.29Å; A48-L52 PolarHBondContact O-N 3.36Å; Q49-L52 WeakPolarHBondContact O-CB 3.16Å; Q49-L52 PolarHBondContact O-N 3.5Å; Q49-L52 VanDerWaalsContact O-N 3.15Å; L52-A55 WeakPolarHBondContact O-CB 3.32Å; L52-A55 PolarHBondContact O-N 2.73Å; L52-K56 PolarHBondContact O-N 3.43Å; L52-M83 HydrophobicContact CD2-CB 4.12Å; L52-M83 HydrophobicContact CD2-CE 3.69Å; L52-M83 HydrophobicContact CD2-CG 4.3Å; L52-I105 HydrophobicContact CD1-CG1 4.18Å; L52-I105 HydrophobicContact CD1-CG2 3.63Å; L52-I115 HydrophobicContact CD1-CB 4.39Å; L52-I115 HydrophobicContact CD1-CG1 4.12Å; L52-I115 HydrophobicContact CD1-CG2 3.75Å; L52-I115 HydrophobicContact CG-CG2 4Å; L52-F117 HydrophobicContact CB-CZ 4.4Å; L52-F117 HydrophobicContact CD2-CD2 4.49Å; L52-F117 HydrophobicContact CD2-CE2 3.91Å; L52-F117 HydrophobicContact CD2-CZ 4.46Å
53	E	93.1	Very high	94	Very high	84 Å²	84	63.4 Å²	63.4	39%	0.393	34%	0.337	S	S	.	.	H	α-helix	trans	-62.4	-45	172.2	-66.8	-54.4	134.7	0	0	111.6	Q49 A55 K56	Q49-E53 PolarHBondContact NE2-OE1 3.11Å; Q49-E53 PolarHBondContact O-N 3.31Å; E53-A55 PolarHBondContact O-N 2.92Å; E53-A55 VanDerWaalsContact O-N 3.16Å; E53-K56 WeakPolarHBondContact O-CB 3.13Å; E53-K56 PolarHBondContact O-N 3.46Å; E53-K56 WeakPolarHBondContact OE1-CE 3.35Å; E53-K56 IonicContact OE1-NZ 2.74Å; E53-K56 PolarHBondContact OE1-NZ 3.43Å; E53-K56 VanDerWaalsContact OE2-CD 3.31Å; E53-K56 WeakPolarHBondContact OE2-CD 3.42Å; E53-K56 WeakPolarHBondContact OE2-CE 3.42Å; E53-K56 IonicContact OE2-NZ 3.56Å; E53-K56 PolarHBondContact OE2-NZ 3.22Å
54	K	93.6	Very high	94.3	Very high	145 Å²	145	60 Å²	60	63%	0.63	32%	0.321	S	S	*	.	H	α-helix	trans	-61.1	-23.1	175.2	-174.1	176.8	-178.9	179.4	0	112.9	A50 Q51	A50-K54 VanDerWaalsContact O-CB 3.29Å; A50-K54 WeakPolarHBondContact O-CB 3.3Å; A50-K54 PolarHBondContact O-N 3.24Å; A50-K54 VanDerWaalsContact O-N 3.07Å; Q51-K54 CarbonylContact O-C 3.53Å; Q51-K54 PolarHBondContact O-N 3.28Å
55	A	94	Very high	94.5	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-81.6	-20.3	176.1	0	0	0	0	0	113.6	Q51 L52 E53 T57 K58 K96 E97 I105 I115	Q51-A55 WeakPolarHBondContact O-CB 3.26Å; Q51-A55 PolarHBondContact O-N 2.97Å; L52-A55 WeakPolarHBondContact O-CB 3.32Å; L52-A55 PolarHBondContact O-N 2.73Å; E53-A55 PolarHBondContact O-N 2.92Å; E53-A55 VanDerWaalsContact O-N 3.16Å; A55-T57 PolarHBondContact O-N 2.97Å; A55-K58 HydrophobicContact CB-CD 4.35Å; A55-K58 PolarHBondContact O-N 3.44Å; A55-K96 WeakPolarHBondContact O-CD 3.35Å; A55-K96 PolarHBondContact O-NZ 2.94Å; A55-E97 WeakPolarHBondContact CB-OE1 3.49Å; A55-I105 HydrophobicContact CB-CG2 3.43Å; A55-I105 VanDerWaalsContact CB-CG2 3.43Å; A55-I115 HydrophobicContact CB-CD1 3.55Å
56	K	91.3	Very high	94.7	Very high	36 Å²	36	55.7 Å²	55.7	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-53.6	-40.7	178.2	-70.5	-177.2	-176.8	173.2	0	112	L52 E53 K96 E114 I115	L52-K56 PolarHBondContact O-N 3.43Å; E53-K56 WeakPolarHBondContact O-CB 3.13Å; E53-K56 PolarHBondContact O-N 3.46Å; E53-K56 WeakPolarHBondContact OE1-CE 3.35Å; E53-K56 IonicContact OE1-NZ 2.74Å; E53-K56 PolarHBondContact OE1-NZ 3.43Å; E53-K56 VanDerWaalsContact OE2-CD 3.31Å; E53-K56 WeakPolarHBondContact OE2-CD 3.42Å; E53-K56 WeakPolarHBondContact OE2-CE 3.42Å; E53-K56 IonicContact OE2-NZ 3.56Å; E53-K56 PolarHBondContact OE2-NZ 3.22Å; K56-K96 PolarHBondContact O-NZ 3.32Å; K56-E114 WeakPolarHBondContact CE-OE2 3.32Å; K56-E114 IonicContact NZ-OE2 2.75Å; K56-E114 PolarHBondContact NZ-OE2 3.02Å; K56-I115 HydrophobicContact CD-CG2 4.2Å; K56-I115 HydrophobicContact CG-CB 4.45Å; K56-I115 HydrophobicContact CG-CG2 3.51Å
57	T	90.3	Very high	94.7	Very high	112 Å²	112	51.2 Å²	51.2	69%	0.687	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-5.7	-180	56.7	0	0	0	0	115.5	A55	A55-T57 PolarHBondContact O-N 2.97Å
58	K	93.2	Very high	94.7	Very high	55 Å²	55	48.5 Å²	48.5	24%	0.239	27%	0.267	C	S	.	.	S	Bend	trans	-69.7	150.9	176.1	-70.3	177.7	-172.7	166.3	0	111.2	A55 K96 E97	A55-K58 HydrophobicContact CB-CD 4.35Å; A55-K58 PolarHBondContact O-N 3.44Å; K58-K96 HydrophobicContact CB-CB 4.44Å; K58-K96 HydrophobicContact CB-CD 4.27Å; K58-K96 WeakPolarHBondContact O-CD 3.06Å; K58-K96 WeakPolarHBondContact O-CE 3.47Å; K58-K96 PolarHBondContact O-NZ 3.48Å; K58-E97 IonicContact NZ-OE1 2.67Å; K58-E97 PolarHBondContact NZ-OE1 3.18Å; K58-E97 IonicContact NZ-OE2 3.55Å; K58-E97 PolarHBondContact NZ-OE2 3.17Å
59	P	93.6	Very high	94.7	Very high	106 Å²	106	52.5 Å²	52.5	69%	0.688	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-64.2	166.2	167.6	30	-35.7	0	0	0	111.1
60	V	96.1	Very high	94.6	Very high	20 Å²	20	50.8 Å²	50.8	12%	0.121	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72.9	125.3	166.9	-179.7	0	0	0	0	108	F62 H94 L289	V60-F62 WeakPolarHBondContact CG1-O 3.47Å; V60-H94 HydrophobicContact CG1-CB 4Å; V60-H94 HydrophobicContact CG2-CB 3.92Å; V60-L289 HydrophobicContact CG2-CD1 4.16Å; V60-L289 HydrophobicContact CG2-CD2 4.44Å
61	A	95.9	Very high	94.5	Very high	67 Å²	67	52.3 Å²	52.3	55%	0.554	29%	0.293	S	S	*	.			trans	-81.8	-42.7	178.8	0	0	0	0	0	111.2	V95	A61-V95 PolarHBondContact N-O 2.93Å
62	F	96.5	Very high	94	Very high	71 Å²	71	51.2 Å²	51.2	31%	0.311	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	163.9	171.7	61.3	-85.3	0	0	0	110.1	V60 V64 V95 W104	V60-F62 WeakPolarHBondContact CG1-O 3.47Å; F62-V64 HydrophobicContact CD2-CG1 3.89Å; F62-V64 HydrophobicContact CE2-CG1 3.8Å; F62-V95 HydrophobicContact CD1-CB 4.28Å; F62-V95 HydrophobicContact CD1-CG1 4.43Å; F62-V95 HydrophobicContact CD2-CB 4.18Å; F62-V95 HydrophobicContact CD2-CG2 4.27Å; F62-V95 HydrophobicContact CE1-CB 3.94Å; F62-V95 HydrophobicContact CE1-CG1 3.7Å; F62-V95 HydrophobicContact CE2-CB 3.84Å; F62-V95 HydrophobicContact CE2-CG1 4.22Å; F62-V95 HydrophobicContact CE2-CG2 3.71Å; F62-V95 HydrophobicContact CG-CB 4.39Å; F62-V95 HydrophobicContact CZ-CB 3.71Å; F62-V95 HydrophobicContact CZ-CG1 3.58Å; F62-V95 HydrophobicContact CZ-CG2 3.92Å; F62-V95 PolarHBondContact N-O 3.11Å; F62-V95 PolarHBondContact O-N 2.83Å; F62-W104 HydrophobicContact CE2-CE3 4.39Å; F62-W104 HydrophobicContact CE2-CH2 4.04Å; F62-W104 AromaticContact CE2-CZ3 3.85Å; F62-W104 HydrophobicContact CE2-CZ3 3.85Å; F62-W104 HydrophobicContact CZ-CD2 4.41Å; F62-W104 HydrophobicContact CZ-CE3 4.15Å; F62-W104 AromaticContact CZ-CH2 3.97Å; F62-W104 HydrophobicContact CZ-CH2 3.97Å; F62-W104 HydrophobicContact CZ-CZ2 4.26Å; F62-W104 AromaticContact CZ-CZ3 3.93Å; F62-W104 HydrophobicContact CZ-CZ3 3.93Å
63	A	97.6	Very high	93.4	Very high	5 Å²	5	53.5 Å²	53.5	4%	0.041	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	153.3	170.8	0	0	0	0	0	111.5	L93 V199	A63-L93 VanDerWaalsContact CA-O 3.29Å; A63-L93 WeakPolarHBondContact CA-O 3.45Å; A63-V199 HydrophobicContact CB-CG2 4.01Å; A63-V199 PolarHBondContact O-N 3.3Å; A63-V199 VanDerWaalsContact O-N 3.07Å
64	V	97.4	Very high	92.1	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.006	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	150.4	172.6	-64.1	0	0	0	0	111.3	F62 F92 L93 Y196 D197 V198	F62-V64 HydrophobicContact CD2-CG1 3.89Å; F62-V64 HydrophobicContact CE2-CG1 3.8Å; V64-F92 WeakPolarHBondContact O-CA 3.36Å; V64-L93 HydrophobicContact CG2-CB 3.82Å; V64-L93 HydrophobicContact CG2-CD1 4.2Å; V64-L93 HydrophobicContact CG2-CG 4.34Å; V64-L93 PolarHBondContact N-O 3.21Å; V64-L93 PolarHBondContact O-N 2.89Å; V64-Y196 HydrophobicContact CB-CG 4.28Å; V64-Y196 HydrophobicContact CG1-CG 4.49Å; V64-Y196 HydrophobicContact CG2-CD1 3.95Å; V64-Y196 HydrophobicContact CG2-CG 4Å; V64-D197 CarbonylContact C-O 3.59Å; V64-D197 WeakPolarHBondContact CA-O 3.46Å; V64-D197 WeakPolarHBondContact CB-O 3.32Å; V64-V198 HydrophobicContact CG1-CG2 4.4Å
65	R	96.6	Very high	90.9	Very high	37 Å²	37	59 Å²	59	14%	0.14	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	135.2	160.2	-174.8	-170.5	64.4	-150.4	-8.8	109	D91 F92 Y196 D197 V199	R65-D91 CarbonylContact C-O 3.56Å; R65-D91 VanDerWaalsContact CA-O 3.28Å; R65-D91 WeakPolarHBondContact CA-O 3.37Å; R65-F92 HydrophobicContact CB-CD1 4.19Å; R65-F92 HydrophobicContact CB-CE1 3.97Å; R65-F92 HydrophobicContact CG-CD1 4.47Å; R65-F92 HydrophobicContact CG-CE1 4.1Å; R65-F92 HydrophobicContact CG-CZ 4.2Å; R65-Y196 CarbonylContact O-C 3.59Å; R65-Y196 WeakPolarHBondContact O-CA 3.48Å; R65-D197 IonicContact CZ-OD2 3.87Å; R65-D197 PolarHBondContact N-O 3.46Å; R65-D197 IonicContact NE-OD2 3.68Å; R65-D197 IonicContact NH2-OD2 2.67Å; R65-D197 PolarHBondContact NH2-OD2 3.47Å; R65-D197 PolarHBondContact O-N 3.03Å; R65-V199 HydrophobicContact CB-CG1 3.8Å
66	T	96.5	Very high	90.1	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	144.9	177.3	68.9	0	0	0	0	111.4	F87 E88 A89 K90 D91 L93 Y196	T66-F87 HydrophobicContact CG2-CD2 3.52Å; T66-F87 HydrophobicContact CG2-CE2 3.76Å; T66-F87 HydrophobicContact CG2-CG 4.02Å; T66-F87 HydrophobicContact CG2-CZ 4.44Å; T66-E88 PolarHBondContact OG1-O 2.94Å; T66-A89 WeakPolarHBondContact OG1-CA 3.48Å; T66-K90 VanDerWaalsContact O-CA 3.3Å; T66-K90 WeakPolarHBondContact O-CA 3.42Å; T66-K90 PolarHBondContact O-N 3.3Å; T66-K90 PolarHBondContact OG1-N 3.28Å; T66-D91 HydrophobicContact CG2-CB 4.15Å; T66-D91 PolarHBondContact N-O 3.26Å; T66-D91 PolarHBondContact OG1-N 2.75Å; T66-D91 PolarHBondContact OG1-O 2.94Å; T66-L93 HydrophobicContact CG2-CD1 3.84Å; T66-L93 HydrophobicContact CG2-CG 4.03Å; T66-Y196 HydrophobicContact CG2-CD1 4.17Å; T66-Y196 HydrophobicContact CG2-CE1 4.04Å
67	N	94.3	Very high	89.8	Confident	44 Å²	44	65 Å²	65	24%	0.235	38%	0.375	C	S	.	.	S	Bend	trans	-113.8	-6.3	170.8	-70.4	-41.7	0	0	0	112.4	T193 P194 P195 D197	N67-T193 HydrophobicContact CB-CG2 3.82Å; N67-P194 WeakPolarHBondContact CB-O 3.31Å; N67-P194 PolarHBondContact ND2-O 2.94Å; N67-P195 PolarHBondContact N-O 2.84Å; N67-D197 VanDerWaalsContact ND2-CG 3.3Å; N67-D197 PolarHBondContact ND2-OD2 3.4Å; N67-D197 PolarHBondContact OD1-OD2 2.9Å
68	V	94.1	Very high	89.9	Confident	58 Å²	58	60.7 Å²	60.7	35%	0.352	35%	0.348	S	S	.	.	S	Bend	trans	-130	157.4	174.2	-61.8	0	0	0	0	109	F87 L124 P195	V68-F87 WeakPolarHBondContact O-CE2 3.48Å; V68-L124 HydrophobicContact CG2-CD1 4.18Å; V68-P195 HydrophobicContact CG2-CB 3.7Å
69	S	94.3	Very high	89.8	Confident	86 Å²	86	59.3 Å²	59.3	60%	0.601	35%	0.345	S	S	*	.			trans	-89.4	156.6	166.4	52.6	0	0	0	0	111.3	F87	S69-F87 CarbonylContact C-O 3.45Å; S69-F87 VanDerWaalsContact CA-O 3.32Å; S69-F87 WeakPolarHBondContact CA-O 3.43Å; S69-F87 WeakPolarHBondContact CB-O 3.29Å
70	Y	94.1	Very high	89.7	Confident	18 Å²	18	54.8 Å²	54.8	7%	0.071	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-143	131.9	172.8	168.3	-111.1	0	0	0	109	A72 D76 I85 S86 F87 P119 L124 M127	Y70-A72 HydrophobicContact CE1-CB 4.21Å; Y70-A72 WeakPolarHBondContact OH-CA 3.19Å; Y70-D76 WeakPolarHBondContact CE2-OD2 3.41Å; Y70-D76 PolarHBondContact OH-OD2 3.42Å; Y70-I85 VanDerWaalsContact CD1-O 3.31Å; Y70-I85 WeakPolarHBondContact CD1-O 3.48Å; Y70-S86 CarbonylContact O-C 3.51Å; Y70-S86 VanDerWaalsContact O-CA 3.25Å; Y70-S86 WeakPolarHBondContact O-CA 3.48Å; Y70-S86 WeakPolarHBondContact O-CB 3.22Å; Y70-F87 VanDerWaalsContact CB-CZ 3.49Å; Y70-F87 HydrophobicContact CD1-CD1 4.33Å; Y70-F87 AromaticContact CD1-CE1 3.9Å; Y70-F87 HydrophobicContact CD1-CE1 3.9Å; Y70-F87 HydrophobicContact CD1-CZ 4.31Å; Y70-F87 HydrophobicContact CG-CE1 4.31Å; Y70-F87 HydrophobicContact CG-CZ 4.26Å; Y70-F87 PolarHBondContact N-O 3.45Å; Y70-F87 PolarHBondContact O-N 3Å; Y70-F87 VanDerWaalsContact O-O 3.06Å; Y70-P119 HydrophobicContact CD1-CG 3.65Å; Y70-P119 HydrophobicContact CD2-CG 4.25Å; Y70-P119 HydrophobicContact CE1-CG 3.78Å; Y70-P119 HydrophobicContact CE2-CG 4.39Å; Y70-P119 HydrophobicContact CG-CG 3.9Å; Y70-L124 HydrophobicContact CD2-CD2 4.31Å; Y70-L124 HydrophobicContact CG-CD2 4.43Å; Y70-M127 HydrophobicContact CD2-CE 3.96Å; Y70-M127 HydrophobicContact CE2-CE 3.77Å; Y70-M127 HydrophobicContact CE2-SD 4.35Å
71	S	91.8	Very high	89.3	Confident	94 Å²	94	58 Å²	58	66%	0.657	34%	0.337	S	S	*	.			trans	-117.9	119.2	172.8	179.2	0	0	0	0	108	A73	S71-A73 PolarHBondContact O-N 3.32Å
72	A	86.6	Confident	89	Confident	37 Å²	37	58.3 Å²	58.3	31%	0.306	35%	0.346	S	S	.	.			trans	-60.5	127.2	177.4	0	0	0	0	0	111.7	Y70 A84 S86	Y70-A72 HydrophobicContact CE1-CB 4.21Å; Y70-A72 WeakPolarHBondContact OH-CA 3.19Å; A72-A84 HydrophobicContact CB-CB 3.62Å; A72-S86 PolarHBondContact N-OG 3.29Å
73	A	80.9	Confident	88.9	Confident	48 Å²	48	57.7 Å²	57.7	40%	0.397	35%	0.345	S	S	.	.			trans	-118.6	156.7	173.8	0	0	0	0	0	110.9	S71 E75 D76	S71-A73 PolarHBondContact O-N 3.32Å; A73-E75 PolarHBondContact O-N 3.46Å; A73-E75 VanDerWaalsContact O-N 3.16Å; A73-D76 PolarHBondContact N-OD2 3.05Å; A73-D76 WeakPolarHBondContact O-CB 3.39Å; A73-D76 PolarHBondContact O-N 3.04Å; A73-D76 VanDerWaalsContact O-N 3.16Å
74	H	65.2	Low	88.7	Confident	189 Å²	189	58.3 Å²	58.3	88%	0.875	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-19.8	177.3	-65.7	-70.8	0	0	0	113.7	D76	H74-D76 VanDerWaalsContact C-N 3.34Å
75	E	69.4	Low	88.6	Confident	156 Å²	156	59.1 Å²	59.1	73%	0.729	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-8.4	178.6	-61.8	-71.7	131.2	0	0	113.7	A73 D77	A73-E75 PolarHBondContact O-N 3.46Å; A73-E75 VanDerWaalsContact O-N 3.16Å; E75-D77 VanDerWaalsContact C-N 3.27Å; E75-D77 PolarHBondContact O-N 3.13Å
76	D	77.3	Confident	88.6	Confident	25 Å²	25	60.1 Å²	60.1	13%	0.134	37%	0.366	C	S	.	.	S	Bend	trans	-78.9	-2.2	-166.9	-68.9	-19.7	0	0	0	114.6	Y70 A73 H74 V78 W103 K123	Y70-D76 WeakPolarHBondContact CE2-OD2 3.41Å; Y70-D76 PolarHBondContact OH-OD2 3.42Å; A73-D76 PolarHBondContact N-OD2 3.05Å; A73-D76 WeakPolarHBondContact O-CB 3.39Å; A73-D76 PolarHBondContact O-N 3.04Å; A73-D76 VanDerWaalsContact O-N 3.16Å; H74-D76 VanDerWaalsContact C-N 3.34Å; D76-V78 HydrophobicContact CB-CG2 4.14Å; D76-W103 HydrophobicContact CB-CH2 4.49Å; D76-W103 HydrophobicContact CB-CZ2 4.49Å; D76-K123 WeakPolarHBondContact O-CE 3.41Å; D76-K123 PolarHBondContact O-NZ 2.87Å
77	D	85.3	Confident	88.6	Confident	135 Å²	135	60.5 Å²	60.5	72%	0.722	37%	0.368	S	S	*	.			trans	53.2	62.6	-175.9	-165.7	38.3	0	0	0	112.1	E75 W103	E75-D77 VanDerWaalsContact C-N 3.27Å; E75-D77 PolarHBondContact O-N 3.13Å; D77-W103 PolarHBondContact O-NE1 3.04Å
78	V	90.8	Very high	88.6	Confident	23 Å²	23	65 Å²	65	14%	0.139	39%	0.388	C	S	.	.			trans	-82.4	134.6	179.6	-170.2	0	0	0	0	109.5	D76 V80 A84 W103 F117	D76-V78 HydrophobicContact CB-CG2 4.14Å; V78-V80 WeakPolarHBondContact CG1-O 3.31Å; V78-V80 PolarHBondContact O-N 2.69Å; V78-V80 VanDerWaalsContact O-N 3.1Å; V78-A84 HydrophobicContact CB-CB 4.4Å; V78-A84 HydrophobicContact CG1-CB 3.69Å; V78-A84 HydrophobicContact CG2-CB 3.75Å; V78-W103 HydrophobicContact CB-CH2 4.46Å; V78-W103 HydrophobicContact CB-CZ2 4.25Å; V78-W103 HydrophobicContact CG1-CH2 4.42Å; V78-W103 HydrophobicContact CG1-CZ2 4.49Å; V78-W103 HydrophobicContact CG2-CH2 3.87Å; V78-W103 HydrophobicContact CG2-CZ2 3.93Å; V78-F117 HydrophobicContact CG1-CB 4.19Å; V78-F117 HydrophobicContact CG1-CD2 4.12Å; V78-F117 HydrophobicContact CG1-CG 4.4Å
79	P	90.9	Very high	88.6	Confident	26 Å²	26	64.6 Å²	64.6	17%	0.169	39%	0.391	C	S	.	.	S	Bend	trans	-62.6	-22.3	-174.8	-24.4	35.6	0	0	0	115.2	A48 F99 W103 F117	A48-P79 HydrophobicContact CB-CB 3.81Å; P79-F99 HydrophobicContact CB-CD1 4.25Å; P79-F99 HydrophobicContact CB-CE1 3.53Å; P79-F99 HydrophobicContact CB-CZ 3.91Å; P79-F99 HydrophobicContact CG-CD1 3.79Å; P79-F99 HydrophobicContact CG-CE1 3.47Å; P79-F99 VanDerWaalsContact CG-CE1 3.47Å; P79-F99 HydrophobicContact CG-CZ 4.34Å; P79-W103 HydrophobicContact CG-CB 4.27Å; P79-W103 HydrophobicContact CG-CG 3.88Å; P79-F117 HydrophobicContact CB-CD1 4.32Å; P79-F117 HydrophobicContact CB-CE1 3.9Å; P79-F117 HydrophobicContact CB-CE2 4.27Å; P79-F117 HydrophobicContact CB-CZ 3.89Å; P79-F117 HydrophobicContact CG-CD1 3.9Å; P79-F117 HydrophobicContact CG-CE1 3.92Å; P79-F117 HydrophobicContact CG-CG 4.31Å; P79-F117 HydrophobicContact CG-CZ 4.37Å
80	V	91.6	Very high	88.6	Confident	10 Å²	10	67.4 Å²	67.4	6%	0.061	39%	0.392	C	S	.	.	S	Bend	trans	-133.6	122	162.7	-175.8	0	0	0	0	107.8	E45 A48 Q49 V78 G82 M83 F117	E45-V80 HydrophobicContact CG-CG1 4.26Å; E45-V80 HydrophobicContact CG-CG2 4.31Å; A48-V80 HydrophobicContact CB-CG2 3.76Å; Q49-V80 HydrophobicContact CB-CG2 4.03Å; V78-V80 WeakPolarHBondContact CG1-O 3.31Å; V78-V80 PolarHBondContact O-N 2.69Å; V78-V80 VanDerWaalsContact O-N 3.1Å; V80-G82 PolarHBondContact O-N 3.07Å; V80-M83 HydrophobicContact CB-CB 4.1Å; V80-M83 HydrophobicContact CB-CG 3.95Å; V80-M83 HydrophobicContact CG1-CB 4.39Å; V80-M83 HydrophobicContact CG1-CG 3.71Å; V80-M83 PolarHBondContact O-N 3.02Å; V80-F117 HydrophobicContact CB-CE2 3.92Å; V80-F117 HydrophobicContact CG2-CE2 3.78Å; V80-F117 HydrophobicContact CG2-CZ 4.19Å
81	P	89.4	Confident	88.7	Confident	89 Å²	89	68.9 Å²	68.9	58%	0.578	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	136.8	178.9	-27.4	35.9	0	0	0	112.8	M83	P81-M83 PolarHBondContact O-N 3.44Å
82	G	89.2	Confident	89	Confident	72 Å²	72	66.2 Å²	66.2	74%	0.742	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	-11.1	-179.9	0	0	0	0	0	115.9	V80	V80-G82 PolarHBondContact O-N 3.07Å
83	M	93.3	Very high	89.5	Confident	59 Å²	59	64.5 Å²	64.5	29%	0.291	36%	0.364	S	S	.	.			trans	-93.4	14.3	-178.7	-60.2	-57.1	-64.2	0	0	114.2	L52 V80 P81 G116 F117	L52-M83 HydrophobicContact CD2-CB 4.12Å; L52-M83 HydrophobicContact CD2-CE 3.69Å; L52-M83 HydrophobicContact CD2-CG 4.3Å; V80-M83 HydrophobicContact CB-CB 4.1Å; V80-M83 HydrophobicContact CB-CG 3.95Å; V80-M83 HydrophobicContact CG1-CB 4.39Å; V80-M83 HydrophobicContact CG1-CG 3.71Å; V80-M83 PolarHBondContact O-N 3.02Å; P81-M83 PolarHBondContact O-N 3.44Å; M83-G116 CarbonylContact O-C 3.44Å; M83-G116 VanDerWaalsContact O-CA 3.23Å; M83-G116 WeakPolarHBondContact O-CA 3.41Å; M83-F117 HydrophobicContact CB-CD2 3.99Å; M83-F117 HydrophobicContact CB-CE2 4.22Å; M83-F117 PolarHBondContact O-N 3.34Å
84	A	94.4	Very high	90.3	Very high	17 Å²	17	62.4 Å²	62.4	14%	0.14	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-82.5	142.9	173.3	0	0	0	0	0	111.7	A72 V78 W103 F117	A72-A84 HydrophobicContact CB-CB 3.62Å; V78-A84 HydrophobicContact CB-CB 4.4Å; V78-A84 HydrophobicContact CG1-CB 3.69Å; V78-A84 HydrophobicContact CG2-CB 3.75Å; A84-W103 HydrophobicContact CB-CH2 4.35Å; A84-W103 HydrophobicContact CB-CZ3 4.31Å; A84-F117 WeakPolarHBondContact CA-O 3.41Å
85	I	95.3	Very high	91.9	Very high	19 Å²	19	53.5 Å²	53.5	10%	0.097	30%	0.304	C	S	.	.			trans	-94.3	110.4	-179.8	-63.6	178.9	0	0	0	109.8	Y70 F87 L93 G106 L108 F117 I118	Y70-I85 VanDerWaalsContact CD1-O 3.31Å; Y70-I85 WeakPolarHBondContact CD1-O 3.48Å; I85-F87 WeakPolarHBondContact O-CD1 3.48Å; I85-L93 HydrophobicContact CG2-CD2 4.5Å; I85-G106 VanDerWaalsContact CD1-O 3.23Å; I85-G106 WeakPolarHBondContact CD1-O 3.5Å; I85-L108 HydrophobicContact CG2-CB 4.13Å; I85-F117 PolarHBondContact N-O 3.45Å; I85-I118 HydrophobicContact CB-CG1 4.31Å; I85-I118 HydrophobicContact CD1-CD1 4.45Å; I85-I118 HydrophobicContact CD1-CG1 4.04Å
86	S	95.3	Very high	93.1	Very high	57 Å²	57	47.1 Å²	47.1	40%	0.399	27%	0.274	S	S	.	.			trans	-70.9	145.2	162	-57.6	0	0	0	0	110.9	Y70 A72	Y70-S86 CarbonylContact O-C 3.51Å; Y70-S86 VanDerWaalsContact O-CA 3.25Å; Y70-S86 WeakPolarHBondContact O-CA 3.48Å; Y70-S86 WeakPolarHBondContact O-CB 3.22Å; A72-S86 PolarHBondContact N-OG 3.29Å
87	F	96.4	Very high	94	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.035	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-152.9	156.5	177.5	53.7	-103.7	0	0	0	111.4	T66 V68 S69 Y70 I85 D91 L93 I118 P119 Y196	T66-F87 HydrophobicContact CG2-CD2 3.52Å; T66-F87 HydrophobicContact CG2-CE2 3.76Å; T66-F87 HydrophobicContact CG2-CG 4.02Å; T66-F87 HydrophobicContact CG2-CZ 4.44Å; V68-F87 WeakPolarHBondContact O-CE2 3.48Å; S69-F87 CarbonylContact C-O 3.45Å; S69-F87 VanDerWaalsContact CA-O 3.32Å; S69-F87 WeakPolarHBondContact CA-O 3.43Å; S69-F87 WeakPolarHBondContact CB-O 3.29Å; Y70-F87 VanDerWaalsContact CB-CZ 3.49Å; Y70-F87 HydrophobicContact CD1-CD1 4.33Å; Y70-F87 AromaticContact CD1-CE1 3.9Å; Y70-F87 HydrophobicContact CD1-CE1 3.9Å; Y70-F87 HydrophobicContact CD1-CZ 4.31Å; Y70-F87 HydrophobicContact CG-CE1 4.31Å; Y70-F87 HydrophobicContact CG-CZ 4.26Å; Y70-F87 PolarHBondContact N-O 3.45Å; Y70-F87 PolarHBondContact O-N 3Å; Y70-F87 VanDerWaalsContact O-O 3.06Å; I85-F87 WeakPolarHBondContact O-CD1 3.48Å; F87-D91 WeakPolarHBondContact CA-OD2 3.18Å; F87-D91 HydrophobicContact CB-CB 4.13Å; F87-L93 HydrophobicContact CB-CD2 4.35Å; F87-L93 HydrophobicContact CD1-CD1 3.9Å; F87-L93 HydrophobicContact CD1-CD2 4.25Å; F87-L93 HydrophobicContact CE1-CD1 3.93Å; F87-L93 HydrophobicContact CG-CD1 4.42Å; F87-L93 HydrophobicContact CZ-CD1 4.48Å; F87-I118 HydrophobicContact CE1-CG2 4.4Å; F87-P119 HydrophobicContact CE1-CG 4.21Å; F87-P119 HydrophobicContact CZ-CG 4.32Å; F87-Y196 HydrophobicContact CE1-CE1 4.44Å; F87-Y196 HydrophobicContact CE2-CE1 4.19Å; F87-Y196 AromaticContact CZ-CE1 3.77Å; F87-Y196 HydrophobicContact CZ-CE1 3.77Å; F87-Y196 AromaticContact CZ-CZ 3.99Å; F87-Y196 VanDerWaalsContact CZ-OH 3.28Å; F87-Y196 WeakPolarHBondContact CZ-OH 3.49Å
88	E	96.1	Very high	94.6	Very high	138 Å²	138	47 Å²	47	65%	0.645	27%	0.267	S	S	*	.			trans	-95.3	179.9	174.1	-66.7	-176.6	-175.4	0	0	111.1	T66 D91	T66-E88 PolarHBondContact OG1-O 2.94Å; E88-D91 PolarHBondContact N-OD2 2.92Å
89	A	93.6	Very high	94.8	Very high	51 Å²	51	48.4 Å²	48.4	42%	0.421	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	141.7	173.9	0	0	0	0	0	110.4	T66 D91	T66-A89 WeakPolarHBondContact OG1-CA 3.48Å; A89-D91 VanDerWaalsContact C-N 3.29Å
90	K	93.8	Very high	95	Very high	145 Å²	145	50 Å²	50	63%	0.63	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	-0.3	-169.5	-44.2	167.3	-171	165.8	0	115.6	T66 F92	T66-K90 VanDerWaalsContact O-CA 3.3Å; T66-K90 WeakPolarHBondContact O-CA 3.42Å; T66-K90 PolarHBondContact O-N 3.3Å; T66-K90 PolarHBondContact OG1-N 3.28Å; K90-F92 WeakPolarHBondContact O-CE2 3.15Å
91	D	96.6	Very high	95.2	Very high	49 Å²	49	54.6 Å²	54.6	26%	0.262	30%	0.302	S	S	.	.			trans	-61.3	158.6	171.8	-97.9	-26.7	0	0	0	111.9	R65 T66 F87 E88 A89 L108	R65-D91 CarbonylContact C-O 3.56Å; R65-D91 VanDerWaalsContact CA-O 3.28Å; R65-D91 WeakPolarHBondContact CA-O 3.37Å; T66-D91 HydrophobicContact CG2-CB 4.15Å; T66-D91 PolarHBondContact N-O 3.26Å; T66-D91 PolarHBondContact OG1-N 2.75Å; T66-D91 PolarHBondContact OG1-O 2.94Å; F87-D91 WeakPolarHBondContact CA-OD2 3.18Å; F87-D91 HydrophobicContact CB-CB 4.13Å; E88-D91 PolarHBondContact N-OD2 2.92Å; A89-D91 VanDerWaalsContact C-N 3.29Å; D91-L108 HydrophobicContact CB-CD1 3.88Å
92	F	97.6	Very high	95.5	Very high	38 Å²	38	52.8 Å²	52.8	17%	0.167	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.4	179.8	-68.3	-88.3	0	0	0	111.1	V64 R65 K90 V109 V199 R203 A311	V64-F92 WeakPolarHBondContact O-CA 3.36Å; R65-F92 HydrophobicContact CB-CD1 4.19Å; R65-F92 HydrophobicContact CB-CE1 3.97Å; R65-F92 HydrophobicContact CG-CD1 4.47Å; R65-F92 HydrophobicContact CG-CE1 4.1Å; R65-F92 HydrophobicContact CG-CZ 4.2Å; K90-F92 WeakPolarHBondContact O-CE2 3.15Å; F92-V109 HydrophobicContact CB-CB 4.02Å; F92-V109 HydrophobicContact CB-CG2 4.11Å; F92-V109 WeakPolarHBondContact O-CB 3.07Å; F92-V109 WeakPolarHBondContact O-CG2 3.47Å; F92-V109 PolarHBondContact O-N 3.28Å; F92-V199 HydrophobicContact CD1-CG2 4.15Å; F92-V199 HydrophobicContact CE1-CG2 4.32Å; F92-R203 HydrophobicContact CD1-CG 4.27Å; F92-R203 HydrophobicContact CE1-CG 3.92Å; F92-R203 HydrophobicContact CZ-CG 4.21Å; F92-R203 VanDerWaalsContact CZ-NE 3.31Å; F92-A311 HydrophobicContact CE1-CB 3.67Å; F92-A311 HydrophobicContact CZ-CB 3.96Å
93	L	97.8	Very high	95.8	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.4	-179.8	-52	176.6	0	0	0	110.6	A63 V64 T66 I85 F87 R107 L108 I118 Y196	A63-L93 VanDerWaalsContact CA-O 3.29Å; A63-L93 WeakPolarHBondContact CA-O 3.45Å; V64-L93 HydrophobicContact CG2-CB 3.82Å; V64-L93 HydrophobicContact CG2-CD1 4.2Å; V64-L93 HydrophobicContact CG2-CG 4.34Å; V64-L93 PolarHBondContact N-O 3.21Å; V64-L93 PolarHBondContact O-N 2.89Å; T66-L93 HydrophobicContact CG2-CD1 3.84Å; T66-L93 HydrophobicContact CG2-CG 4.03Å; I85-L93 HydrophobicContact CG2-CD2 4.5Å; F87-L93 HydrophobicContact CB-CD2 4.35Å; F87-L93 HydrophobicContact CD1-CD1 3.9Å; F87-L93 HydrophobicContact CD1-CD2 4.25Å; F87-L93 HydrophobicContact CE1-CD1 3.93Å; F87-L93 HydrophobicContact CG-CD1 4.42Å; F87-L93 HydrophobicContact CZ-CD1 4.48Å; L93-R107 WeakPolarHBondContact CA-O 3.5Å; L93-L108 HydrophobicContact CD2-CB 4.27Å; L93-L108 HydrophobicContact CD2-CD1 3.78Å; L93-I118 HydrophobicContact CB-CD1 4.13Å; L93-I118 HydrophobicContact CD1-CD1 4.2Å; L93-I118 HydrophobicContact CD1-CG1 4.46Å; L93-I118 HydrophobicContact CD1-CG2 3.78Å; L93-Y196 HydrophobicContact CD1-CE1 3.96Å
94	H	97.6	Very high	96	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.019	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	109.1	169.1	-80.2	175.8	0	0	0	109.4	V60 G106 R107 V109 S201	V60-H94 HydrophobicContact CG1-CB 4Å; V60-H94 HydrophobicContact CG2-CB 3.92Å; H94-G106 CarbonylContact O-C 3.47Å; H94-G106 WeakPolarHBondContact O-CA 3.48Å; H94-R107 HydrophobicContact CB-CG 4Å; H94-R107 PolarHBondContact N-O 3.04Å; H94-R107 PolarHBondContact O-N 2.93Å; H94-V109 HydrophobicContact CB-CG2 4.25Å; H94-V109 VanDerWaalsContact CD2-CG2 3.46Å; H94-V109 WeakPolarHBondContact CD2-CG2 3.41Å; H94-S201 PolarHBondContact NE2-O 3.42Å
95	V	97.8	Very high	96.2	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.4	177.5	-175.3	0	0	0	0	109.6	A61 F62 W104 I118	A61-V95 PolarHBondContact N-O 2.93Å; F62-V95 HydrophobicContact CD1-CB 4.28Å; F62-V95 HydrophobicContact CD1-CG1 4.43Å; F62-V95 HydrophobicContact CD2-CB 4.18Å; F62-V95 HydrophobicContact CD2-CG2 4.27Å; F62-V95 HydrophobicContact CE1-CB 3.94Å; F62-V95 HydrophobicContact CE1-CG1 3.7Å; F62-V95 HydrophobicContact CE2-CB 3.84Å; F62-V95 HydrophobicContact CE2-CG1 4.22Å; F62-V95 HydrophobicContact CE2-CG2 3.71Å; F62-V95 HydrophobicContact CG-CB 4.39Å; F62-V95 HydrophobicContact CZ-CB 3.71Å; F62-V95 HydrophobicContact CZ-CG1 3.58Å; F62-V95 HydrophobicContact CZ-CG2 3.92Å; F62-V95 PolarHBondContact N-O 3.11Å; F62-V95 PolarHBondContact O-N 2.83Å; V95-W104 HydrophobicContact CG1-CB 4.03Å; V95-W104 HydrophobicContact CG1-CD2 4.32Å; V95-W104 HydrophobicContact CG1-CE3 4.19Å; V95-W104 HydrophobicContact CG1-CG 4.31Å; V95-W104 HydrophobicContact CG2-CE3 3.73Å; V95-W104 HydrophobicContact CG2-CZ3 4.15Å; V95-I118 HydrophobicContact CG2-CD1 4.42Å
96	K	95.9	Very high	96.3	Very high	23 Å²	23	46.8 Å²	46.8	10%	0.1	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	-37.2	180	-64.1	-159.7	176.2	-159.2	0	112.9	A55 K56 K58 I105 I115	A55-K96 WeakPolarHBondContact O-CD 3.35Å; A55-K96 PolarHBondContact O-NZ 2.94Å; K56-K96 PolarHBondContact O-NZ 3.32Å; K58-K96 HydrophobicContact CB-CB 4.44Å; K58-K96 HydrophobicContact CB-CD 4.27Å; K58-K96 WeakPolarHBondContact O-CD 3.06Å; K58-K96 WeakPolarHBondContact O-CE 3.47Å; K58-K96 PolarHBondContact O-NZ 3.48Å; K96-I105 PolarHBondContact N-O 2.86Å; K96-I115 HydrophobicContact CD-CD1 3.85Å; K96-I115 HydrophobicContact CG-CD1 4.49Å
97	E	95.9	Very high	96.3	Very high	38 Å²	38	44.4 Å²	44.4	18%	0.178	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	165.5	172	67.1	-173.7	140	0	0	112.8	Q51 A55 K58 I105	Q51-E97 VanDerWaalsContact NE2-CD 3.35Å; Q51-E97 PolarHBondContact NE2-OE2 3.49Å; Q51-E97 VanDerWaalsContact NE2-OE2 3.17Å; A55-E97 WeakPolarHBondContact CB-OE1 3.49Å; K58-E97 IonicContact NZ-OE1 2.67Å; K58-E97 PolarHBondContact NZ-OE1 3.18Å; K58-E97 IonicContact NZ-OE2 3.55Å; K58-E97 PolarHBondContact NZ-OE2 3.17Å; E97-I105 HydrophobicContact CG-CB 3.98Å; E97-I105 HydrophobicContact CG-CD1 4.28Å; E97-I105 PolarHBondContact N-O 3.48Å; E97-I105 PolarHBondContact O-N 2.92Å
98	K	96.5	Very high	96.3	Very high	119 Å²	119	44.8 Å²	44.8	52%	0.517	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	126.4	164.9	179.5	-179.7	176.9	-174.9	0	108.4	N100 N101	K98-N100 WeakPolarHBondContact CE-O 3.17Å; K98-N100 WeakPolarHBondContact CG-O 3.16Å; K98-N101 WeakPolarHBondContact CE-OD1 3.18Å; K98-N101 PolarHBondContact NZ-OD1 2.82Å
99	F	95.9	Very high	96.3	Very high	53 Å²	53	39.3 Å²	39.3	23%	0.232	20%	0.195	C	C	.	.			trans	-84.3	-57.4	174.5	174.4	-103.9	0	0	0	110.4	A48 Q51 P79 W103 I105 F117	A48-F99 HydrophobicContact CB-CE2 3.95Å; A48-F99 HydrophobicContact CB-CZ 3.69Å; Q51-F99 HydrophobicContact CG-CD2 4.48Å; Q51-F99 VanDerWaalsContact OE1-CD2 3.31Å; P79-F99 HydrophobicContact CB-CD1 4.25Å; P79-F99 HydrophobicContact CB-CE1 3.53Å; P79-F99 HydrophobicContact CB-CZ 3.91Å; P79-F99 HydrophobicContact CG-CD1 3.79Å; P79-F99 HydrophobicContact CG-CE1 3.47Å; P79-F99 VanDerWaalsContact CG-CE1 3.47Å; P79-F99 HydrophobicContact CG-CZ 4.34Å; F99-W103 HydrophobicContact CB-CB 4.49Å; F99-W103 WeakPolarHBondContact CB-O 3.21Å; F99-W103 HydrophobicContact CD1-CB 4.21Å; F99-W103 PolarHBondContact N-O 3.49Å; F99-I105 HydrophobicContact CB-CD1 3.9Å; F99-I105 HydrophobicContact CB-CG1 4.02Å; F99-I105 HydrophobicContact CD2-CD1 3.86Å; F99-I105 HydrophobicContact CG-CD1 4.24Å; F99-F117 HydrophobicContact CB-CE1 4.33Å; F99-F117 HydrophobicContact CD1-CE1 4.09Å; F99-F117 HydrophobicContact CD2-CE1 4.07Å; F99-F117 HydrophobicContact CE1-CE1 4.44Å; F99-F117 HydrophobicContact CE2-CE1 4.42Å; F99-F117 HydrophobicContact CG-CD1 4.48Å; F99-F117 AromaticContact CG-CE1 3.89Å; F99-F117 HydrophobicContact CG-CE1 3.89Å
100	N	95.1	Very high	96.3	Very high	60 Å²	60	42 Å²	42	32%	0.321	20%	0.197	S	C	.	.	S	Bend	trans	-143.7	-161.9	173	69.8	15.1	0	0	0	110	K98 D102 W103	K98-N100 WeakPolarHBondContact CE-O 3.17Å; K98-N100 WeakPolarHBondContact CG-O 3.16Å; N100-D102 VanDerWaalsContact C-N 3.34Å; N100-D102 PolarHBondContact OD1-N 2.92Å; N100-W103 PolarHBondContact N-O 3.16Å; N100-W103 PolarHBondContact OD1-N 3.03Å
101	N	95.3	Very high	96	Very high	105 Å²	105	39.9 Å²	39.9	56%	0.561	19%	0.19	S	C	*	.	S	Bend	trans	-71.5	-27.8	-179.7	-74.1	-24.6	0	0	0	113.6	K98 S120	K98-N101 WeakPolarHBondContact CE-OD1 3.18Å; K98-N101 PolarHBondContact NZ-OD1 2.82Å; N101-S120 VanDerWaalsContact O-CB 3.3Å; N101-S120 WeakPolarHBondContact O-CB 3.31Å; N101-S120 PolarHBondContact O-OG 3.32Å
102	D	95.2	Very high	95.5	Very high	51 Å²	51	41.6 Å²	41.6	27%	0.273	22%	0.219	S	C	.	.	S	Bend	trans	-97.8	-20.8	-176.1	-69.6	-72.3	0	0	0	113.5	N100 P119 S120 K123	N100-D102 VanDerWaalsContact C-N 3.34Å; N100-D102 PolarHBondContact OD1-N 2.92Å; D102-P119 CarbonylContact O-C 3.41Å; D102-P119 WeakPolarHBondContact O-CA 3.47Å; D102-S120 PolarHBondContact O-N 3.13Å; D102-K123 HydrophobicContact CB-CB 3.98Å; D102-K123 HydrophobicContact CB-CD 4.02Å; D102-K123 HydrophobicContact CB-CG 4.24Å; D102-K123 WeakPolarHBondContact O-CB 3.32Å
103	W	96.6	Very high	95.1	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	136.7	-173.4	-63	105.3	0	0	0	112.8	D76 D77 V78 P79 A84 F99 N100 F117 P119	D76-W103 HydrophobicContact CB-CH2 4.49Å; D76-W103 HydrophobicContact CB-CZ2 4.49Å; D77-W103 PolarHBondContact O-NE1 3.04Å; V78-W103 HydrophobicContact CB-CH2 4.46Å; V78-W103 HydrophobicContact CB-CZ2 4.25Å; V78-W103 HydrophobicContact CG1-CH2 4.42Å; V78-W103 HydrophobicContact CG1-CZ2 4.49Å; V78-W103 HydrophobicContact CG2-CH2 3.87Å; V78-W103 HydrophobicContact CG2-CZ2 3.93Å; P79-W103 HydrophobicContact CG-CB 4.27Å; P79-W103 HydrophobicContact CG-CG 3.88Å; A84-W103 HydrophobicContact CB-CH2 4.35Å; A84-W103 HydrophobicContact CB-CZ3 4.31Å; F99-W103 HydrophobicContact CB-CB 4.49Å; F99-W103 WeakPolarHBondContact CB-O 3.21Å; F99-W103 HydrophobicContact CD1-CB 4.21Å; F99-W103 PolarHBondContact N-O 3.49Å; N100-W103 PolarHBondContact N-O 3.16Å; N100-W103 PolarHBondContact OD1-N 3.03Å; W103-F117 HydrophobicContact CB-CD1 4.26Å; W103-F117 HydrophobicContact CD2-CB 4.29Å; W103-F117 HydrophobicContact CE3-CB 3.69Å; W103-F117 HydrophobicContact CZ3-CB 4.14Å; W103-P119 HydrophobicContact CE3-CB 4.27Å; W103-P119 HydrophobicContact CH2-CB 4.47Å; W103-P119 HydrophobicContact CZ3-CB 3.95Å; W103-P119 HydrophobicContact CZ3-CG 4.42Å
104	W	97.9	Very high	94.8	Very high	37 Å²	37	47.1 Å²	47.1	14%	0.14	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	159.5	165.7	-61.3	-15.5	0	0	0	109.6	F62 V95 F117 I118 P121 Y196	F62-W104 HydrophobicContact CE2-CE3 4.39Å; F62-W104 HydrophobicContact CE2-CH2 4.04Å; F62-W104 AromaticContact CE2-CZ3 3.85Å; F62-W104 HydrophobicContact CE2-CZ3 3.85Å; F62-W104 HydrophobicContact CZ-CD2 4.41Å; F62-W104 HydrophobicContact CZ-CE3 4.15Å; F62-W104 AromaticContact CZ-CH2 3.97Å; F62-W104 HydrophobicContact CZ-CH2 3.97Å; F62-W104 HydrophobicContact CZ-CZ2 4.26Å; F62-W104 AromaticContact CZ-CZ3 3.93Å; F62-W104 HydrophobicContact CZ-CZ3 3.93Å; V95-W104 HydrophobicContact CG1-CB 4.03Å; V95-W104 HydrophobicContact CG1-CD2 4.32Å; V95-W104 HydrophobicContact CG1-CE3 4.19Å; V95-W104 HydrophobicContact CG1-CG 4.31Å; V95-W104 HydrophobicContact CG2-CE3 3.73Å; V95-W104 HydrophobicContact CG2-CZ3 4.15Å; W104-F117 CarbonylContact O-C 3.6Å; W104-F117 WeakPolarHBondContact O-CA 3.47Å; W104-I118 HydrophobicContact CB-CB 4.33Å; W104-I118 HydrophobicContact CE3-CG2 4.39Å; W104-I118 PolarHBondContact N-O 2.64Å; W104-I118 PolarHBondContact O-N 2.74Å; W104-P121 HydrophobicContact CH2-CG 3.99Å; W104-P121 VanDerWaalsContact CZ2-CD 3.46Å; W104-P121 HydrophobicContact CZ2-CG 4.13Å; W104-Y196 HydrophobicContact CE3-CE2 4.25Å; W104-Y196 AromaticContact CH2-CD2 3.85Å; W104-Y196 HydrophobicContact CH2-CD2 3.85Å; W104-Y196 HydrophobicContact CH2-CE2 4.19Å; W104-Y196 AromaticContact CZ3-CD2 3.58Å; W104-Y196 HydrophobicContact CZ3-CD2 3.58Å; W104-Y196 AromaticContact CZ3-CE2 3.69Å; W104-Y196 HydrophobicContact CZ3-CE2 3.69Å
105	I	97.7	Very high	94.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.8	170.5	-71.7	163.4	0	0	0	108.5	Q51 L52 A55 K96 E97 F99 I115 F117	Q51-I105 HydrophobicContact CB-CD1 4.49Å; Q51-I105 HydrophobicContact CG-CD1 3.92Å; L52-I105 HydrophobicContact CD1-CG1 4.18Å; L52-I105 HydrophobicContact CD1-CG2 3.63Å; A55-I105 HydrophobicContact CB-CG2 3.43Å; A55-I105 VanDerWaalsContact CB-CG2 3.43Å; K96-I105 PolarHBondContact N-O 2.86Å; E97-I105 HydrophobicContact CG-CB 3.98Å; E97-I105 HydrophobicContact CG-CD1 4.28Å; E97-I105 PolarHBondContact N-O 3.48Å; E97-I105 PolarHBondContact O-N 2.92Å; F99-I105 HydrophobicContact CB-CD1 3.9Å; F99-I105 HydrophobicContact CB-CG1 4.02Å; F99-I105 HydrophobicContact CD2-CD1 3.86Å; F99-I105 HydrophobicContact CG-CD1 4.24Å; I105-I115 HydrophobicContact CG2-CD1 3.59Å; I105-I115 HydrophobicContact CG2-CG1 3.84Å; I105-F117 HydrophobicContact CD1-CE1 3.94Å; I105-F117 HydrophobicContact CG1-CD1 3.88Å; I105-F117 HydrophobicContact CG1-CE1 3.69Å; I105-F117 HydrophobicContact CG1-CZ 4.5Å
106	G	96.9	Very high	94.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	-166.1	-176.4	0	0	0	0	0	112	I85 H94 I115 G116	I85-G106 VanDerWaalsContact CD1-O 3.23Å; I85-G106 WeakPolarHBondContact CD1-O 3.5Å; H94-G106 CarbonylContact O-C 3.47Å; H94-G106 WeakPolarHBondContact O-CA 3.48Å; G106-I115 CarbonylContact O-C 3.56Å; G106-I115 WeakPolarHBondContact O-CA 3.43Å; G106-I115 WeakPolarHBondContact O-CG1 3.49Å; G106-G116 PolarHBondContact N-O 3.47Å; G106-G116 VanDerWaalsContact N-O 3.08Å; G106-G116 PolarHBondContact O-N 3.06Å; G106-G116 VanDerWaalsContact O-O 3.1Å
107	R	96	Very high	94.7	Very high	7 Å²	7	46.4 Å²	46.4	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	152.9	178.4	61.9	178.3	-68.3	-88.7	-2.6	113	L93 H94 K110 C113 E114 A384	L93-R107 WeakPolarHBondContact CA-O 3.5Å; H94-R107 HydrophobicContact CB-CG 4Å; H94-R107 PolarHBondContact N-O 3.04Å; H94-R107 PolarHBondContact O-N 2.93Å; R107-K110 PolarHBondContact NH2-O 3.09Å; R107-C113 PolarHBondContact NE-O 2.87Å; R107-C113 PolarHBondContact NH2-O 3.23Å; R107-C113 VanDerWaalsContact NH2-O 3.13Å; R107-E114 VanDerWaalsContact CB-O 3.22Å; R107-E114 WeakPolarHBondContact CB-O 3.33Å; R107-A384 PolarHBondContact NH1-O 3.43Å; R107-A384 PolarHBondContact NH2-O 3.49Å
108	L	96.6	Very high	94.7	Very high	16 Å²	16	44.6 Å²	44.6	8%	0.084	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	135.2	164.4	-177.5	64.6	0	0	0	109.5	I85 D91 L93 K110 C113	I85-L108 HydrophobicContact CG2-CB 4.13Å; D91-L108 HydrophobicContact CB-CD1 3.88Å; L93-L108 HydrophobicContact CD2-CB 4.27Å; L93-L108 HydrophobicContact CD2-CD1 3.78Å; L108-K110 HydrophobicContact CD2-CB 4.18Å; L108-K110 HydrophobicContact CD2-CD 4Å; L108-K110 HydrophobicContact CG-CB 4.03Å; L108-K110 PolarHBondContact O-N 3.27Å; L108-C113 HydrophobicContact CB-CB 4.08Å
109	V	96.1	Very high	94.7	Very high	23 Å²	23	38.9 Å²	38.9	14%	0.139	21%	0.213	C	C	.	.	S	Bend	trans	-81	72.9	179.9	-176.2	0	0	0	0	109.7	F92 H94 Y381 T385	F92-V109 HydrophobicContact CB-CB 4.02Å; F92-V109 HydrophobicContact CB-CG2 4.11Å; F92-V109 WeakPolarHBondContact O-CB 3.07Å; F92-V109 WeakPolarHBondContact O-CG2 3.47Å; F92-V109 PolarHBondContact O-N 3.28Å; H94-V109 HydrophobicContact CB-CG2 4.25Å; H94-V109 VanDerWaalsContact CD2-CG2 3.46Å; H94-V109 WeakPolarHBondContact CD2-CG2 3.41Å; V109-Y381 HydrophobicContact CG1-CE2 4.21Å; V109-T385 HydrophobicContact CG1-CG2 3.48Å; V109-T385 VanDerWaalsContact CG1-CG2 3.48Å
110	K	92.7	Very high	94.8	Very high	107 Å²	107	36.5 Å²	36.5	47%	0.465	20%	0.203	S	C	.	.	S	Bend	trans	-147.4	146.8	-176.8	-174.3	171.3	-176	171.8	0	109.6	R107 L108 C113	R107-K110 PolarHBondContact NH2-O 3.09Å; L108-K110 HydrophobicContact CD2-CB 4.18Å; L108-K110 HydrophobicContact CD2-CD 4Å; L108-K110 HydrophobicContact CG-CB 4.03Å; L108-K110 PolarHBondContact O-N 3.27Å; K110-C113 HydrophobicContact CB-CB 4.25Å; K110-C113 PolarHBondContact O-N 3.31Å
111	E	88.4	Confident	94.8	Very high	102 Å²	102	36 Å²	36	48%	0.477	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	143.7	174.5	-67.2	-167.3	-173.4	0	0	110.8	C113 K383 A384	E111-C113 PolarHBondContact O-N 2.8Å; E111-C113 VanDerWaalsContact O-N 3.08Å; E111-K383 HydrophobicContact CG-CB 3.98Å; E111-K383 VanDerWaalsContact OE1-CB 3.29Å; E111-K383 WeakPolarHBondContact OE1-CB 3.34Å; E111-K383 WeakPolarHBondContact OE1-CD 3.33Å; E111-A384 HydrophobicContact CG-CB 4.25Å
112	G	85	Confident	94.7	Very high	84 Å²	84	35 Å²	35	87%	0.866	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.1	-14.8	-176.6	0	0	0	0	0	116	E114	G112-E114 PolarHBondContact O-N 3.47Å
113	C	90.6	Very high	94.6	Very high	37 Å²	37	33.8 Å²	33.8	25%	0.25	19%	0.193	C	C	.	.			trans	-79.1	109.5	179	-67.5	0	0	0	0	112.1	R107 L108 K110 E111	R107-C113 PolarHBondContact NE-O 2.87Å; R107-C113 PolarHBondContact NH2-O 3.23Å; R107-C113 VanDerWaalsContact NH2-O 3.13Å; L108-C113 HydrophobicContact CB-CB 4.08Å; K110-C113 HydrophobicContact CB-CB 4.25Å; K110-C113 PolarHBondContact O-N 3.31Å; E111-C113 PolarHBondContact O-N 2.8Å; E111-C113 VanDerWaalsContact O-N 3.08Å
114	E	91.8	Very high	94.4	Very high	119 Å²	119	34.6 Å²	34.6	56%	0.556	20%	0.197	S	C	*	.			trans	-71.8	-177.6	173.2	-78.7	-146.7	-145.6	0	0	113.4	K56 R107 G112	K56-E114 WeakPolarHBondContact CE-OE2 3.32Å; K56-E114 IonicContact NZ-OE2 2.75Å; K56-E114 PolarHBondContact NZ-OE2 3.02Å; R107-E114 VanDerWaalsContact CB-O 3.22Å; R107-E114 WeakPolarHBondContact CB-O 3.33Å; G112-E114 PolarHBondContact O-N 3.47Å
115	I	94.6	Very high	94	Very high	10 Å²	10	35.7 Å²	35.7	5%	0.051	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	145.1	175.6	-155.8	174.4	0	0	0	110.9	L52 A55 K56 K96 I105 G106	L52-I115 HydrophobicContact CD1-CB 4.39Å; L52-I115 HydrophobicContact CD1-CG1 4.12Å; L52-I115 HydrophobicContact CD1-CG2 3.75Å; L52-I115 HydrophobicContact CG-CG2 4Å; A55-I115 HydrophobicContact CB-CD1 3.55Å; K56-I115 HydrophobicContact CD-CG2 4.2Å; K56-I115 HydrophobicContact CG-CB 4.45Å; K56-I115 HydrophobicContact CG-CG2 3.51Å; K96-I115 HydrophobicContact CD-CD1 3.85Å; K96-I115 HydrophobicContact CG-CD1 4.49Å; I105-I115 HydrophobicContact CG2-CD1 3.59Å; I105-I115 HydrophobicContact CG2-CG1 3.84Å; G106-I115 CarbonylContact O-C 3.56Å; G106-I115 WeakPolarHBondContact O-CA 3.43Å; G106-I115 WeakPolarHBondContact O-CG1 3.49Å
116	G	95.8	Very high	93.7	Very high	2 Å²	2	39 Å²	39	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	-172.9	-178.3	0	0	0	0	0	112.1	M83 G106	M83-G116 CarbonylContact O-C 3.44Å; M83-G116 VanDerWaalsContact O-CA 3.23Å; M83-G116 WeakPolarHBondContact O-CA 3.41Å; G106-G116 PolarHBondContact N-O 3.47Å; G106-G116 VanDerWaalsContact N-O 3.08Å; G106-G116 PolarHBondContact O-N 3.06Å; G106-G116 VanDerWaalsContact O-O 3.1Å
117	F	97.3	Very high	93.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	127.7	178.9	-64.1	-79.8	0	0	0	111.2	A48 L52 V78 P79 V80 M83 A84 I85 F99 W103 W104 I105	A48-F117 HydrophobicContact CB-CZ 4.1Å; L52-F117 HydrophobicContact CB-CZ 4.4Å; L52-F117 HydrophobicContact CD2-CD2 4.49Å; L52-F117 HydrophobicContact CD2-CE2 3.91Å; L52-F117 HydrophobicContact CD2-CZ 4.46Å; V78-F117 HydrophobicContact CG1-CB 4.19Å; V78-F117 HydrophobicContact CG1-CD2 4.12Å; V78-F117 HydrophobicContact CG1-CG 4.4Å; P79-F117 HydrophobicContact CB-CD1 4.32Å; P79-F117 HydrophobicContact CB-CE1 3.9Å; P79-F117 HydrophobicContact CB-CE2 4.27Å; P79-F117 HydrophobicContact CB-CZ 3.89Å; P79-F117 HydrophobicContact CG-CD1 3.9Å; P79-F117 HydrophobicContact CG-CE1 3.92Å; P79-F117 HydrophobicContact CG-CG 4.31Å; P79-F117 HydrophobicContact CG-CZ 4.37Å; V80-F117 HydrophobicContact CB-CE2 3.92Å; V80-F117 HydrophobicContact CG2-CE2 3.78Å; V80-F117 HydrophobicContact CG2-CZ 4.19Å; M83-F117 HydrophobicContact CB-CD2 3.99Å; M83-F117 HydrophobicContact CB-CE2 4.22Å; M83-F117 PolarHBondContact O-N 3.34Å; A84-F117 WeakPolarHBondContact CA-O 3.41Å; I85-F117 PolarHBondContact N-O 3.45Å; F99-F117 HydrophobicContact CB-CE1 4.33Å; F99-F117 HydrophobicContact CD1-CE1 4.09Å; F99-F117 HydrophobicContact CD2-CE1 4.07Å; F99-F117 HydrophobicContact CE1-CE1 4.44Å; F99-F117 HydrophobicContact CE2-CE1 4.42Å; F99-F117 HydrophobicContact CG-CD1 4.48Å; F99-F117 AromaticContact CG-CE1 3.89Å; F99-F117 HydrophobicContact CG-CE1 3.89Å; W103-F117 HydrophobicContact CB-CD1 4.26Å; W103-F117 HydrophobicContact CD2-CB 4.29Å; W103-F117 HydrophobicContact CE3-CB 3.69Å; W103-F117 HydrophobicContact CZ3-CB 4.14Å; W104-F117 CarbonylContact O-C 3.6Å; W104-F117 WeakPolarHBondContact O-CA 3.47Å; I105-F117 HydrophobicContact CD1-CE1 3.94Å; I105-F117 HydrophobicContact CG1-CD1 3.88Å; I105-F117 HydrophobicContact CG1-CE1 3.69Å; I105-F117 HydrophobicContact CG1-CZ 4.5Å
118	I	97.7	Very high	93	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.5	177.1	-64.6	166.6	0	0	0	107.3	I85 F87 L93 V95 W104 S120 Y196	I85-I118 HydrophobicContact CB-CG1 4.31Å; I85-I118 HydrophobicContact CD1-CD1 4.45Å; I85-I118 HydrophobicContact CD1-CG1 4.04Å; F87-I118 HydrophobicContact CE1-CG2 4.4Å; L93-I118 HydrophobicContact CB-CD1 4.13Å; L93-I118 HydrophobicContact CD1-CD1 4.2Å; L93-I118 HydrophobicContact CD1-CG1 4.46Å; L93-I118 HydrophobicContact CD1-CG2 3.78Å; V95-I118 HydrophobicContact CG2-CD1 4.42Å; W104-I118 HydrophobicContact CB-CB 4.33Å; W104-I118 HydrophobicContact CE3-CG2 4.39Å; W104-I118 PolarHBondContact N-O 2.64Å; W104-I118 PolarHBondContact O-N 2.74Å; I118-S120 PolarHBondContact O-N 3.26Å; I118-Y196 WeakPolarHBondContact CG2-OH 3.5Å
119	P	96.6	Very high	92.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	135.8	177.6	28.4	-35.6	0	0	0	110.3	Y70 F87 D102 W103 K123 L124 M127 Y196	Y70-P119 HydrophobicContact CD1-CG 3.65Å; Y70-P119 HydrophobicContact CD2-CG 4.25Å; Y70-P119 HydrophobicContact CE1-CG 3.78Å; Y70-P119 HydrophobicContact CE2-CG 4.39Å; Y70-P119 HydrophobicContact CG-CG 3.9Å; F87-P119 HydrophobicContact CE1-CG 4.21Å; F87-P119 HydrophobicContact CZ-CG 4.32Å; D102-P119 CarbonylContact O-C 3.41Å; D102-P119 WeakPolarHBondContact O-CA 3.47Å; W103-P119 HydrophobicContact CE3-CB 4.27Å; W103-P119 HydrophobicContact CH2-CB 4.47Å; W103-P119 HydrophobicContact CZ3-CB 3.95Å; W103-P119 HydrophobicContact CZ3-CG 4.42Å; P119-K123 HydrophobicContact CB-CB 4.1Å; P119-K123 HydrophobicContact CB-CG 3.79Å; P119-L124 HydrophobicContact CB-CD2 4.14Å; P119-L124 HydrophobicContact CB-CG 4.12Å; P119-L124 HydrophobicContact CG-CD2 3.79Å; P119-L124 HydrophobicContact CG-CG 4.1Å; P119-M127 HydrophobicContact CB-CE 4.31Å; P119-Y196 WeakPolarHBondContact O-CE2 3.36Å; P119-Y196 PolarHBondContact O-OH 2.91Å
120	S	96.6	Very high	92.1	Very high	3 Å²	3	52 Å²	52	2%	0.021	28%	0.278	C	S	.	.			trans	-70.4	164.7	176.6	87.4	0	0	0	0	111.1	N101 D102 I118 V122 K123 L124	N101-S120 VanDerWaalsContact O-CB 3.3Å; N101-S120 WeakPolarHBondContact O-CB 3.31Å; N101-S120 PolarHBondContact O-OG 3.32Å; D102-S120 PolarHBondContact O-N 3.13Å; I118-S120 PolarHBondContact O-N 3.26Å; S120-V122 PolarHBondContact O-N 3.32Å; S120-V122 VanDerWaalsContact O-N 3.13Å; S120-V122 PolarHBondContact OG-N 3.39Å; S120-K123 PolarHBondContact O-N 3.16Å; S120-K123 VanDerWaalsContact O-N 3.11Å; S120-K123 PolarHBondContact OG-N 3.42Å; S120-L124 PolarHBondContact O-N 3.38Å
121	P	94.9	Very high	91.8	Very high	49 Å²	49	53.6 Å²	53.6	32%	0.318	29%	0.287	S	S	.	.	H	α-helix	trans	-53.1	-32.2	171	-27.3	35.2	0	0	0	113.7	W104 E125 P195 Y196	W104-P121 HydrophobicContact CH2-CG 3.99Å; W104-P121 VanDerWaalsContact CZ2-CD 3.46Å; W104-P121 HydrophobicContact CZ2-CG 4.13Å; P121-E125 PolarHBondContact O-N 2.8Å; P121-E125 VanDerWaalsContact O-N 3.1Å; P121-P195 HydrophobicContact CB-CG 3.94Å; P121-P195 HydrophobicContact CG-CG 4.45Å; P121-Y196 HydrophobicContact CG-CD2 3.87Å; P121-Y196 HydrophobicContact CG-CE2 4.25Å
122	V	93.2	Very high	91.7	Very high	84 Å²	84	52 Å²	52	51%	0.509	28%	0.28	S	S	.	.	H	α-helix	trans	-72.5	-44	178.7	-177.7	0	0	0	0	110.6	S120 E125 N126	S120-V122 PolarHBondContact O-N 3.32Å; S120-V122 VanDerWaalsContact O-N 3.13Å; S120-V122 PolarHBondContact OG-N 3.39Å; V122-E125 PolarHBondContact O-N 2.94Å; V122-N126 WeakPolarHBondContact O-CB 3.43Å; V122-N126 PolarHBondContact O-N 3.32Å; V122-N126 PolarHBondContact O-ND2 3.32Å
123	K	92.9	Very high	91.7	Very high	26 Å²	26	53.4 Å²	53.4	11%	0.113	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-43.7	175.3	-179	61.6	162.9	-162.6	0	111.6	D76 D102 P119 S120 N126 M127	D76-K123 WeakPolarHBondContact O-CE 3.41Å; D76-K123 PolarHBondContact O-NZ 2.87Å; D102-K123 HydrophobicContact CB-CB 3.98Å; D102-K123 HydrophobicContact CB-CD 4.02Å; D102-K123 HydrophobicContact CB-CG 4.24Å; D102-K123 WeakPolarHBondContact O-CB 3.32Å; P119-K123 HydrophobicContact CB-CB 4.1Å; P119-K123 HydrophobicContact CB-CG 3.79Å; S120-K123 PolarHBondContact O-N 3.16Å; S120-K123 VanDerWaalsContact O-N 3.11Å; S120-K123 PolarHBondContact OG-N 3.42Å; K123-N126 PolarHBondContact O-N 2.9Å; K123-M127 HydrophobicContact CD-CG 4.35Å; K123-M127 HydrophobicContact CD-SD 4.24Å; K123-M127 HydrophobicContact CG-CE 4.05Å; K123-M127 HydrophobicContact CG-SD 4.27Å; K123-M127 WeakPolarHBondContact O-CB 3.35Å; K123-M127 VanDerWaalsContact O-CG 3.29Å; K123-M127 WeakPolarHBondContact O-CG 3.09Å; K123-M127 PolarHBondContact O-N 2.99Å
124	L	92.4	Very high	91.3	Very high	20 Å²	20	59 Å²	59	11%	0.105	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-45.7	176.4	-71.7	174.2	0	0	0	112.2	V68 Y70 P119 S120 M127 R128 P195 Y196	V68-L124 HydrophobicContact CG2-CD1 4.18Å; Y70-L124 HydrophobicContact CD2-CD2 4.31Å; Y70-L124 HydrophobicContact CG-CD2 4.43Å; P119-L124 HydrophobicContact CB-CD2 4.14Å; P119-L124 HydrophobicContact CB-CG 4.12Å; P119-L124 HydrophobicContact CG-CD2 3.79Å; P119-L124 HydrophobicContact CG-CG 4.1Å; S120-L124 PolarHBondContact O-N 3.38Å; L124-M127 HydrophobicContact CD2-CE 3.8Å; L124-M127 PolarHBondContact O-N 3.38Å; L124-R128 WeakPolarHBondContact O-CB 3.27Å; L124-R128 PolarHBondContact O-N 3.33Å; L124-P195 HydrophobicContact CD1-CB 3.51Å; L124-P195 HydrophobicContact CD1-CG 3.99Å; L124-Y196 HydrophobicContact CD1-CE1 4.24Å; L124-Y196 HydrophobicContact CD1-CE2 4.09Å
125	E	90.4	Very high	90.7	Very high	60 Å²	60	56 Å²	56	28%	0.28	28%	0.275	S	S	.	.	H	α-helix	trans	-67.5	-39.6	177.2	179.9	56.9	-165.5	0	0	112.2	P121 V122 M127 R128 L129	P121-E125 PolarHBondContact O-N 2.8Å; P121-E125 VanDerWaalsContact O-N 3.1Å; V122-E125 PolarHBondContact O-N 2.94Å; E125-M127 PolarHBondContact O-N 2.96Å; E125-R128 WeakPolarHBondContact O-CB 3.47Å; E125-R128 PolarHBondContact O-N 2.83Å; E125-R128 IonicContact OE1-CZ 3.44Å; E125-R128 IonicContact OE1-NE 3.3Å; E125-R128 PolarHBondContact OE1-NE 2.87Å; E125-R128 IonicContact OE1-NH2 2.69Å; E125-R128 PolarHBondContact OE1-NH2 3.4Å; E125-R128 WeakPolarHBondContact OE2-CD 3.19Å; E125-R128 IonicContact OE2-CZ 3.88Å; E125-R128 IonicContact OE2-NE 3.74Å; E125-R128 PolarHBondContact OE2-NE 3.38Å; E125-R128 IonicContact OE2-NH2 2.7Å; E125-L129 HydrophobicContact CG-CD1 4.16Å; E125-L129 WeakPolarHBondContact O-CB 3.26Å; E125-L129 WeakPolarHBondContact O-CG 3.29Å; E125-L129 PolarHBondContact O-N 2.89Å
126	N	91.1	Very high	89.9	Confident	69 Å²	69	61.4 Å²	61.4	37%	0.369	30%	0.298	S	S	.	.	H	α-helix	trans	-58.4	-45.5	172.9	-76.3	-23.1	0	0	0	111.7	V122 K123 L129 Q130	V122-N126 WeakPolarHBondContact O-CB 3.43Å; V122-N126 PolarHBondContact O-N 3.32Å; V122-N126 PolarHBondContact O-ND2 3.32Å; K123-N126 PolarHBondContact O-N 2.9Å; N126-L129 PolarHBondContact O-N 2.67Å; N126-Q130 WeakPolarHBondContact O-CG 3.46Å; N126-Q130 PolarHBondContact O-N 2.75Å
127	M	88.8	Confident	88.4	Confident	39 Å²	39	67 Å²	67	19%	0.192	32%	0.324	C	S	.	.	H	α-helix	trans	-66.9	-38.8	176.8	-68.9	-175.9	-51.2	0	0	112	Y70 P119 K123 L124 E125 L129 Q130 H131	Y70-M127 HydrophobicContact CD2-CE 3.96Å; Y70-M127 HydrophobicContact CE2-CE 3.77Å; Y70-M127 HydrophobicContact CE2-SD 4.35Å; P119-M127 HydrophobicContact CB-CE 4.31Å; K123-M127 HydrophobicContact CD-CG 4.35Å; K123-M127 HydrophobicContact CD-SD 4.24Å; K123-M127 HydrophobicContact CG-CE 4.05Å; K123-M127 HydrophobicContact CG-SD 4.27Å; K123-M127 WeakPolarHBondContact O-CB 3.35Å; K123-M127 VanDerWaalsContact O-CG 3.29Å; K123-M127 WeakPolarHBondContact O-CG 3.09Å; K123-M127 PolarHBondContact O-N 2.99Å; L124-M127 HydrophobicContact CD2-CE 3.8Å; L124-M127 PolarHBondContact O-N 3.38Å; E125-M127 PolarHBondContact O-N 2.96Å; M127-L129 PolarHBondContact O-N 2.82Å; M127-Q130 PolarHBondContact O-N 3.46Å; M127-H131 WeakPolarHBondContact O-CB 3.27Å; M127-H131 PolarHBondContact O-N 2.67Å
128	R	88.7	Confident	86.5	Confident	116 Å²	116	69.6 Å²	69.6	44%	0.438	35%	0.35	S	S	.	.	H	α-helix	trans	-58.9	-47.2	174	-165.2	-162.7	66.7	67.4	2.2	111.3	L124 E125 H131 E132	L124-R128 WeakPolarHBondContact O-CB 3.27Å; L124-R128 PolarHBondContact O-N 3.33Å; E125-R128 WeakPolarHBondContact O-CB 3.47Å; E125-R128 PolarHBondContact O-N 2.83Å; E125-R128 IonicContact OE1-CZ 3.44Å; E125-R128 IonicContact OE1-NE 3.3Å; E125-R128 PolarHBondContact OE1-NE 2.87Å; E125-R128 IonicContact OE1-NH2 2.69Å; E125-R128 PolarHBondContact OE1-NH2 3.4Å; E125-R128 WeakPolarHBondContact OE2-CD 3.19Å; E125-R128 IonicContact OE2-CZ 3.88Å; E125-R128 IonicContact OE2-NE 3.74Å; E125-R128 PolarHBondContact OE2-NE 3.38Å; E125-R128 IonicContact OE2-NH2 2.7Å; R128-H131 PolarHBondContact O-N 2.87Å; R128-E132 IonicContact CZ-OE2 2.77Å; R128-E132 IonicContact NH1-OE2 3.11Å; R128-E132 PolarHBondContact NH1-OE2 2.96Å; R128-E132 IonicContact NH2-OE2 3.95Å; R128-E132 WeakPolarHBondContact O-CB 3.5Å; R128-E132 PolarHBondContact O-N 2.89Å
129	L	88.4	Confident	84.5	Confident	66 Å²	66	78 Å²	78	35%	0.346	39%	0.387	S	S	.	.	H	α-helix	trans	-64.6	-42.1	177.3	-71.9	168.2	0	0	0	112.2	E125 N126 M127 E132 Q133	E125-L129 HydrophobicContact CG-CD1 4.16Å; E125-L129 WeakPolarHBondContact O-CB 3.26Å; E125-L129 WeakPolarHBondContact O-CG 3.29Å; E125-L129 PolarHBondContact O-N 2.89Å; N126-L129 PolarHBondContact O-N 2.67Å; M127-L129 PolarHBondContact O-N 2.82Å; L129-E132 PolarHBondContact O-N 3.04Å; L129-Q133 WeakPolarHBondContact O-CG 3.17Å; L129-Q133 PolarHBondContact O-N 3.08Å
130	Q	86.7	Confident	82.3	Confident	100 Å²	100	86 Å²	86	47%	0.467	42%	0.422	S	S	.	.	H	α-helix	trans	-63.3	-42.7	175.1	-73.7	-178.3	31.8	0	0	112.2	N126 M127 Q133 R134	N126-Q130 WeakPolarHBondContact O-CG 3.46Å; N126-Q130 PolarHBondContact O-N 2.75Å; M127-Q130 PolarHBondContact O-N 3.46Å; Q130-Q133 PolarHBondContact O-N 2.93Å; Q130-R134 WeakPolarHBondContact O-CG 3.47Å; Q130-R134 PolarHBondContact O-N 2.84Å
131	H	85.3	Confident	79.9	Confident	139 Å²	139	95 Å²	95	64%	0.644	46%	0.457	S	S	*	.	H	α-helix	trans	-62.7	-42.9	175.5	-169.8	96.6	0	0	0	111.3	M127 R128 Q133 R134 A135	M127-H131 WeakPolarHBondContact O-CB 3.27Å; M127-H131 PolarHBondContact O-N 2.67Å; R128-H131 PolarHBondContact O-N 2.87Å; H131-Q133 VanDerWaalsContact C-N 3.32Å; H131-Q133 PolarHBondContact O-N 3.24Å; H131-R134 PolarHBondContact O-N 2.9Å; H131-A135 WeakPolarHBondContact O-CB 3.46Å; H131-A135 PolarHBondContact O-N 3.24Å
132	E	87.1	Confident	77.4	Confident	70 Å²	70	98.4 Å²	98.4	33%	0.327	48%	0.482	S	S	.	.	H	α-helix	trans	-62.6	-36.7	176.1	-161.4	-172.4	143.4	0	0	112.4	R128 L129 K136	R128-E132 IonicContact CZ-OE2 2.77Å; R128-E132 IonicContact NH1-OE2 3.11Å; R128-E132 PolarHBondContact NH1-OE2 2.96Å; R128-E132 IonicContact NH2-OE2 3.95Å; R128-E132 WeakPolarHBondContact O-CB 3.5Å; R128-E132 PolarHBondContact O-N 2.89Å; L129-E132 PolarHBondContact O-N 3.04Å; E132-K136 WeakPolarHBondContact O-CD 3.27Å; E132-K136 VanDerWaalsContact O-CG 3.28Å; E132-K136 WeakPolarHBondContact O-CG 3.31Å; E132-K136 PolarHBondContact O-N 3.04Å; E132-K136 VanDerWaalsContact O-N 3.16Å; E132-K136 WeakPolarHBondContact OE1-CE 3.3Å; E132-K136 IonicContact OE1-NZ 2.6Å; E132-K136 PolarHBondContact OE1-NZ 3.41Å
133	Q	85	Confident	75.3	Confident	112 Å²	112	99 Å²	99	52%	0.523	49%	0.489	S	S	.	.	H	α-helix	trans	-68.1	-47.4	173.1	-71.8	176.4	22.2	0	0	112.2	L129 Q130 H131 A135 K136 Q137	L129-Q133 WeakPolarHBondContact O-CG 3.17Å; L129-Q133 PolarHBondContact O-N 3.08Å; Q130-Q133 PolarHBondContact O-N 2.93Å; H131-Q133 VanDerWaalsContact C-N 3.32Å; H131-Q133 PolarHBondContact O-N 3.24Å; Q133-A135 VanDerWaalsContact C-N 3.31Å; Q133-A135 PolarHBondContact O-N 3.18Å; Q133-K136 PolarHBondContact O-N 2.92Å; Q133-K136 VanDerWaalsContact O-N 3.12Å; Q133-Q137 WeakPolarHBondContact O-CG 3.49Å; Q133-Q137 PolarHBondContact O-N 3.11Å
134	R	81.8	Confident	73.3	Confident	154 Å²	154	107.9 Å²	107.9	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-58.1	-43.1	176	-70.7	177.8	-174.7	-167.6	2.7	111	Q130 H131 K136 Q137 G138	Q130-R134 WeakPolarHBondContact O-CG 3.47Å; Q130-R134 PolarHBondContact O-N 2.84Å; H131-R134 PolarHBondContact O-N 2.9Å; R134-K136 VanDerWaalsContact C-N 3.32Å; R134-K136 PolarHBondContact O-N 3.29Å; R134-Q137 PolarHBondContact O-N 3.2Å; R134-G138 PolarHBondContact O-N 3.24Å
135	A	79.8	Confident	70.6	Confident	56 Å²	56	112.8 Å²	112.8	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-64.8	-30.2	176.4	0	0	0	0	0	114	H131 Q133	H131-A135 WeakPolarHBondContact O-CB 3.46Å; H131-A135 PolarHBondContact O-N 3.24Å; Q133-A135 VanDerWaalsContact C-N 3.31Å; Q133-A135 PolarHBondContact O-N 3.18Å
136	K	77.9	Confident	68.2	Low	125 Å²	125	113.9 Å²	113.9	54%	0.543	59%	0.591	S	S	.	*	H	α-helix	trans	-76.4	-41.3	173.4	-73	167.1	-174	171.6	0	112	E132 Q133 R134	E132-K136 WeakPolarHBondContact O-CD 3.27Å; E132-K136 VanDerWaalsContact O-CG 3.28Å; E132-K136 WeakPolarHBondContact O-CG 3.31Å; E132-K136 PolarHBondContact O-N 3.04Å; E132-K136 VanDerWaalsContact O-N 3.16Å; E132-K136 WeakPolarHBondContact OE1-CE 3.3Å; E132-K136 IonicContact OE1-NZ 2.6Å; E132-K136 PolarHBondContact OE1-NZ 3.41Å; Q133-K136 PolarHBondContact O-N 2.92Å; Q133-K136 VanDerWaalsContact O-N 3.12Å; R134-K136 VanDerWaalsContact C-N 3.32Å; R134-K136 PolarHBondContact O-N 3.29Å
137	Q	63.8	Low	65.5	Low	119 Å²	119	114 Å²	114	56%	0.556	61%	0.609	S	S	*	*	H	α-helix	trans	-68.2	-34.6	178.1	-69.7	178.6	7.1	0	0	112.8	Q133 R134 K139 F140	Q133-Q137 WeakPolarHBondContact O-CG 3.49Å; Q133-Q137 PolarHBondContact O-N 3.11Å; R134-Q137 PolarHBondContact O-N 3.2Å; Q137-K139 PolarHBondContact O-N 3.29Å; Q137-F140 PolarHBondContact O-N 2.86Å
138	G	58.3	Low	63.1	Low	54 Å²	54	120 Å²	120	56%	0.557	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-16	178.9	0	0	0	0	0	115.4	R134	R134-G138 PolarHBondContact O-N 3.24Å
139	K	55.3	Low	60.5	Low	177 Å²	177	120.6 Å²	120.6	77%	0.77	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-9.4	176.6	-65	-172.4	178.6	-177.2	0	114.8	Q137	Q137-K139 PolarHBondContact O-N 3.29Å
140	F	50.3	Low	58.3	Low	167 Å²	167	122.9 Å²	122.9	73%	0.732	69%	0.685	S	S	*	*	S	Bend	trans	-108.8	-3.3	-173.4	-76.7	-80.4	0	0	0	115.8	Q137	Q137-F140 PolarHBondContact O-N 2.86Å
141	Y	45.1	Very low	55.9	Low	194 Å²	194	123.3 Å²	123.3	76%	0.761	70%	0.699	S	S	*	*			trans	-111.7	0.6	-174.6	-73.5	-81.1	0	0	0	115.8	S143	Y141-S143 PolarHBondContact O-N 3.3Å
142	S	44	Very low	53.7	Low	120 Å²	120	121.8 Å²	121.8	84%	0.839	70%	0.704	S	S	*	*	S	Bend	trans	-78.4	40.2	178.4	-172.7	0	0	0	0	113.9
143	S	48.1	Very low	51.3	Low	95 Å²	95	126.5 Å²	126.5	66%	0.664	73%	0.731	S	S	*	*			trans	-154.1	35.8	-169.4	57.9	0	0	0	0	116	Y141	Y141-S143 PolarHBondContact O-N 3.3Å
144	K	50.7	Low	48.9	Very low	213 Å²	213	124.8 Å²	124.8	93%	0.926	74%	0.743	S	S	*	*			trans	-151.9	50.2	173	-121	161.3	-168.6	176.7	0	118.6
145	S	36.2	Very low	46.6	Very low	124 Å²	124	125 Å²	125	87%	0.867	76%	0.756	S	S	*	*			trans	-159.6	141.5	154.2	52.9	0	0	0	0	109.4
146	G	40	Very low	44.6	Very low	83 Å²	83	129.5 Å²	129.5	86%	0.856	77%	0.771	S	S	*	*			cis	131.4	69.8	2.7	0	0	0	0	0	111.6
147	G	34.6	Very low	42.6	Very low	72 Å²	72	129.5 Å²	129.5	74%	0.742	78%	0.781	S	S	*	*			trans	-170.1	139.1	-179.5	0	0	0	0	0	112.6
148	N	38.7	Very low	41.9	Very low	164 Å²	164	129.4 Å²	129.4	88%	0.877	79%	0.79	S	S	*	*			trans	-84.7	148.6	-172.4	-64	6.1	0	0	0	112.5
149	S	33.4	Very low	40.6	Very low	129 Å²	129	132.5 Å²	132.5	90%	0.902	80%	0.804	S	S	*	*			trans	-154.7	153.3	150.5	-80.9	0	0	0	0	109.9
150	S	41.5	Very low	39.9	Very low	113 Å²	113	129.3 Å²	129.3	79%	0.79	80%	0.804	S	S	*	*			trans	-121.1	164.8	-164	55.8	0	0	0	0	113.7
151	S	37.1	Very low	39.3	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	81%	0.811	S	S	*	*			trans	106.3	102.7	155	87.7	0	0	0	0	119.4
152	S	38.8	Very low	38.7	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	81%	0.813	S	S	*	*				70.3	137.7	120.1	-139.4	0	0	0	0	122.9
153	L	37.3	Very low	38.1	Very low	169 Å²	169	132.3 Å²	132.3	89%	0.885	82%	0.815	S	S	*	*			trans	75.2	126.6	156.3	-70.5	154.1	0	0	0	120.3
154	G	34.3	Very low	37.4	Very low	76 Å²	76	132.6 Å²	132.6	78%	0.784	81%	0.813	S	S	*	*			trans	84.5	143	166.9	0	0	0	0	0	115.7
155	D	32.6	Very low	37	Very low	159 Å²	159	128.4 Å²	128.4	85%	0.85	81%	0.807	S	S	*	*			cis	-154.2	179	-17.3	-151	-21.2	0	0	0	109.6
156	I	38.4	Very low	37.1	Very low	150 Å²	150	128.7 Å²	128.7	77%	0.769	81%	0.806	S	S	*	*			trans	-90.5	147.8	-164.5	-56.5	172.5	0	0	0	113.3
157	V	35.6	Very low	36.6	Very low	126 Å²	126	129.8 Å²	129.8	76%	0.764	80%	0.8	S	S	*	*			trans	136.4	123.1	147.6	170.5	0	0	0	0	111.7
158	P	50.6	Low	36.8	Very low	116 Å²	116	132 Å²	132	75%	0.753	81%	0.805	S	S	*	*			trans	-93.3	155.8	177.7	36.7	-34.4	0	0	0	113.2
159	S	30	Very low	36.3	Very low	120 Å²	120	128 Å²	128	84%	0.839	80%	0.802	S	S	*	*			trans	-147.8	111.4	156.6	-138.1	0	0	0	0	113.3
160	S	40.3	Very low	36	Very low	110 Å²	110	126.5 Å²	126.5	77%	0.769	80%	0.797	S	S	*	*			trans	-76.4	130.2	173.4	-54.3	0	0	0	0	111
161	R	38.3	Very low	35.3	Very low	236 Å²	236	130.4 Å²	130.4	89%	0.891	80%	0.8	S	S	*	*			trans	-156.3	105	150.7	-113.6	151.2	-119.3	-103.7	3.2	112.7
162	K	33	Very low	35.1	Very low	183 Å²	183	130.9 Å²	130.9	80%	0.796	80%	0.804	S	S	*	*			trans	-75.4	112.3	172.9	170.8	176.8	176.9	-73.7	0	109.2	T164	K162-T164 PolarHBondContact O-N 3.04Å
163	S	30.2	Very low	34.7	Very low	125 Å²	125	130.2 Å²	130.2	87%	0.874	80%	0.804	S	S	*	*			trans	-72.3	119.1	178.1	-59.1	0	0	0	0	111.7
164	T	34.8	Very low	34.5	Very low	101 Å²	101	128.7 Å²	128.7	62%	0.62	80%	0.797	S	S	*	*			trans	-109.8	143.8	166.1	43.5	0	0	0	0	109.8	K162	K162-T164 PolarHBondContact O-N 3.04Å
165	P	40.8	Very low	34.7	Very low	125 Å²	125	134.8 Å²	134.8	81%	0.812	81%	0.805	S	S	*	*			trans	-76.6	143.1	-177.7	31.8	-35.1	0	0	0	111.9
166	P	37.9	Very low	34.9	Very low	129 Å²	129	133.6 Å²	133.6	84%	0.838	79%	0.794	S	S	*	*			trans	-87.8	153.7	167.1	34.9	-32.4	0	0	0	111.6
167	S	31	Very low	35.1	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	78%	0.781	S	S	*	*			trans	-115.8	141.1	170.8	-175.8	0	0	0	0	110.9
168	S	38.5	Very low	34.9	Very low	120 Å²	120	133 Å²	133	84%	0.839	78%	0.783	S	S	*	*			trans	42.9	102.8	148.1	-45.1	0	0	0	0	118.6
169	G	27.1	Very low	34.3	Very low	80 Å²	80	135.3 Å²	135.3	83%	0.825	78%	0.777	S	S	*	*			trans	-137.7	13.2	-173.4	0	0	0	0	0	118.5
170	A	28.3	Very low	34.8	Very low	96 Å²	96	134.3 Å²	134.3	79%	0.793	76%	0.757	S	S	*	*			trans	70.4	156.6	168.3	0	0	0	0	0	121
171	K	27.2	Very low	35	Very low	196 Å²	196	134.1 Å²	134.1	85%	0.852	75%	0.751	S	S	*	*			trans	86.3	101.5	164	-57.5	-170.3	-179.9	-178	0	120.2
172	S	31.4	Very low	35.2	Very low	119 Å²	119	125.5 Å²	125.5	83%	0.832	73%	0.731	S	S	*	*			trans	55.7	98.4	136.4	60.6	0	0	0	0	120.6
173	A	30.8	Very low	35.6	Very low	92 Å²	92	118.8 Å²	118.8	76%	0.76	71%	0.714	S	S	*	*			trans	-154.2	132.9	140.1	0	0	0	0	0	111
174	D	34.4	Very low	36.3	Very low	137 Å²	137	117.6 Å²	117.6	73%	0.733	70%	0.697	S	S	*	*			trans	43.4	103.7	151	-50.8	-28.2	0	0	0	121.6	Q176	D174-Q176 PolarHBondContact O-N 3.46Å
175	E	36.8	Very low	36.3	Very low	204 Å²	204	120.4 Å²	120.4	95%	0.953	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	43.9	166.8	-160.1	175.4	115	0	0	112.6
176	Q	37.8	Very low	35.9	Very low	134 Å²	134	123.8 Å²	123.8	63%	0.626	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.9	9.8	-172.4	-144.8	175	31.3	0	0	116.2	D174 W179 K180	D174-Q176 PolarHBondContact O-N 3.46Å; Q176-W179 PolarHBondContact O-NE1 3.32Å; Q176-K180 WeakPolarHBondContact O-CE 3.17Å
177	D	42.7	Very low	35.6	Very low	92 Å²	92	127.4 Å²	127.4	49%	0.492	70%	0.695	S	S	.	*	S	Bend	trans	-112.8	-14.6	172.9	-85.5	-45.6	0	0	0	115	W179 K180 T181	D177-W179 VanDerWaalsContact C-N 3.26Å; D177-W179 PolarHBondContact O-N 3.1Å; D177-K180 PolarHBondContact O-N 2.95Å; D177-K180 WeakPolarHBondContact OD1-CD 3.46Å; D177-K180 WeakPolarHBondContact OD1-CE 3.24Å; D177-K180 IonicContact OD1-NZ 3.7Å; D177-K180 PolarHBondContact OD1-NZ 2.99Å; D177-T181 PolarHBondContact O-N 2.97Å
178	Q	31.6	Very low	35.7	Very low	173 Å²	173	129.2 Å²	129.2	81%	0.808	69%	0.689	S	S	*	*	H	α-helix	trans	-62.9	-32.5	-178.6	-158.7	171.1	106.3	0	0	112.6	K180 A182	Q178-K180 VanDerWaalsContact C-N 3.33Å; Q178-K180 PolarHBondContact O-N 3.22Å; Q178-A182 VanDerWaalsContact O-CB 3.29Å; Q178-A182 WeakPolarHBondContact O-CB 3.46Å; Q178-A182 PolarHBondContact O-N 3.12Å
179	W	37.4	Very low	35.3	Very low	164 Å²	164	127.6 Å²	127.6	62%	0.621	68%	0.675	S	S	*	*	H	α-helix	trans	-73.2	-18.7	175	67.5	-92.1	0	0	0	114.1	Q176 D177 G183	Q176-W179 PolarHBondContact O-NE1 3.32Å; D177-W179 VanDerWaalsContact C-N 3.26Å; D177-W179 PolarHBondContact O-N 3.1Å; W179-G183 WeakPolarHBondContact O-CA 3.45Å; W179-G183 PolarHBondContact O-N 3.47Å
180	K	39.6	Very low	36	Very low	99 Å²	99	129.5 Å²	129.5	43%	0.43	67%	0.67	S	S	.	*	H	α-helix	trans	-80.1	-43.7	177.3	-59.4	-177.3	-156.7	151.5	0	110.8	Q176 D177 Q178 G183 L184	Q176-K180 WeakPolarHBondContact O-CE 3.17Å; D177-K180 PolarHBondContact O-N 2.95Å; D177-K180 WeakPolarHBondContact OD1-CD 3.46Å; D177-K180 WeakPolarHBondContact OD1-CE 3.24Å; D177-K180 IonicContact OD1-NZ 3.7Å; D177-K180 PolarHBondContact OD1-NZ 2.99Å; Q178-K180 VanDerWaalsContact C-N 3.33Å; Q178-K180 PolarHBondContact O-N 3.22Å; K180-G183 PolarHBondContact O-N 3.35Å; K180-L184 PolarHBondContact O-N 2.76Å
181	T	46	Very low	36.8	Very low	105 Å²	105	132.6 Å²	132.6	64%	0.644	67%	0.668	S	S	*	*	H	α-helix	trans	-66.2	-41.6	171.9	-54.3	0	0	0	0	111.2	D177 L184 F185	D177-T181 PolarHBondContact O-N 2.97Å; T181-L184 PolarHBondContact O-N 3.26Å; T181-F185 WeakPolarHBondContact O-CB 3.44Å; T181-F185 PolarHBondContact O-N 3.31Å
182	A	42.5	Very low	38.7	Very low	55 Å²	55	129.7 Å²	129.7	46%	0.455	66%	0.657	S	S	.	*	H	α-helix	trans	-64.3	-38.7	172.4	0	0	0	0	0	112.4	Q178 L184 F185 W186	Q178-A182 VanDerWaalsContact O-CB 3.29Å; Q178-A182 WeakPolarHBondContact O-CB 3.46Å; Q178-A182 PolarHBondContact O-N 3.12Å; A182-L184 VanDerWaalsContact C-N 3.33Å; A182-L184 PolarHBondContact O-N 2.79Å; A182-F185 PolarHBondContact O-N 3.4Å; A182-W186 VanDerWaalsContact O-CB 3.28Å; A182-W186 WeakPolarHBondContact O-CB 3.46Å; A182-W186 PolarHBondContact O-N 2.91Å
183	G	41.8	Very low	40.9	Very low	43 Å²	43	127.6 Å²	127.6	44%	0.443	64%	0.64	S	S	.	*	H	α-helix	trans	-66.2	-31.4	175.7	0	0	0	0	0	113.7	W179 K180 R187	W179-G183 WeakPolarHBondContact O-CA 3.45Å; W179-G183 PolarHBondContact O-N 3.47Å; K180-G183 PolarHBondContact O-N 3.35Å; G183-R187 PolarHBondContact O-N 2.68Å
184	L	44.6	Very low	43.8	Very low	99 Å²	99	126.1 Å²	126.1	52%	0.518	62%	0.622	S	S	.	*	H	α-helix	trans	-74.3	-45.6	170.4	-131.1	71.7	0	0	0	111.4	K180 T181 A182 W186 R187 F188	K180-L184 PolarHBondContact O-N 2.76Å; T181-L184 PolarHBondContact O-N 3.26Å; A182-L184 VanDerWaalsContact C-N 3.33Å; A182-L184 PolarHBondContact O-N 2.79Å; L184-W186 PolarHBondContact O-N 3.24Å; L184-R187 CarbonylContact O-C 3.39Å; L184-R187 WeakPolarHBondContact O-CA 3.37Å; L184-R187 PolarHBondContact O-N 3.48Å; L184-F188 HydrophobicContact CG-CE2 4.34Å; L184-F188 WeakPolarHBondContact O-CD2 3.18Å; L184-F188 PolarHBondContact O-N 3.22Å; L184-F188 VanDerWaalsContact O-N 3.12Å
185	F	34.5	Very low	46.5	Very low	160 Å²	160	120.5 Å²	120.5	70%	0.702	59%	0.594	S	S	*	*	H	α-helix	trans	-65.4	-36.6	-179.9	-169.8	-106.8	0	0	0	112.8	T181 A182 R187 F188 T189	T181-F185 WeakPolarHBondContact O-CB 3.44Å; T181-F185 PolarHBondContact O-N 3.31Å; A182-F185 PolarHBondContact O-N 3.4Å; F185-R187 VanDerWaalsContact C-N 3.27Å; F185-R187 PolarHBondContact O-N 3.17Å; F185-F188 CarbonylContact O-C 3.31Å; F185-F188 VanDerWaalsContact O-C 3.31Å; F185-F188 VanDerWaalsContact O-CA 3.3Å; F185-F188 WeakPolarHBondContact O-CA 3.44Å; F185-F188 WeakPolarHBondContact O-CB 3.37Å; F185-F188 PolarHBondContact O-N 2.86Å; F185-T189 PolarHBondContact O-N 2.88Å
186	W	31.2	Very low	49.4	Very low	196 Å²	196	111.5 Å²	111.5	74%	0.742	55%	0.551	S	S	*	*	H	α-helix	trans	-68.3	-27.7	171.7	-160.6	-105.8	0	0	0	112	A182 L184 F188 T189	A182-W186 VanDerWaalsContact O-CB 3.28Å; A182-W186 WeakPolarHBondContact O-CB 3.46Å; A182-W186 PolarHBondContact O-N 2.91Å; L184-W186 PolarHBondContact O-N 3.24Å; W186-F188 PolarHBondContact O-N 3.47Å; W186-T189 HydrophobicContact CD2-CG2 4.4Å; W186-T189 HydrophobicContact CE3-CG2 4.31Å; W186-T189 PolarHBondContact O-N 3.07Å; W186-T189 PolarHBondContact O-OG1 3.33Å
187	R	32	Very low	52	Low	206 Å²	206	105.8 Å²	105.8	78%	0.777	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	2.1	167.5	-157.9	157.3	71	174.4	3.9	113.5	G183 L184 F185	G183-R187 PolarHBondContact O-N 2.68Å; L184-R187 CarbonylContact O-C 3.39Å; L184-R187 WeakPolarHBondContact O-CA 3.37Å; L184-R187 PolarHBondContact O-N 3.48Å; F185-R187 VanDerWaalsContact C-N 3.27Å; F185-R187 PolarHBondContact O-N 3.17Å
188	F	33.8	Very low	54.5	Low	143 Å²	143	105.4 Å²	105.4	63%	0.627	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	18.6	163.7	-69.8	-66.1	0	0	0	112.9	L184 F185 W186 T190	L184-F188 HydrophobicContact CG-CE2 4.34Å; L184-F188 WeakPolarHBondContact O-CD2 3.18Å; L184-F188 PolarHBondContact O-N 3.22Å; L184-F188 VanDerWaalsContact O-N 3.12Å; F185-F188 CarbonylContact O-C 3.31Å; F185-F188 VanDerWaalsContact O-C 3.31Å; F185-F188 VanDerWaalsContact O-CA 3.3Å; F185-F188 WeakPolarHBondContact O-CA 3.44Å; F185-F188 WeakPolarHBondContact O-CB 3.37Å; F185-F188 PolarHBondContact O-N 2.86Å; W186-F188 PolarHBondContact O-N 3.47Å; F188-T190 PolarHBondContact O-N 2.86Å
189	T	30.5	Very low	57.6	Low	87 Å²	87	97.3 Å²	97.3	53%	0.534	49%	0.488	S	S	.	.	S	Bend	trans	-64.1	93.4	143.4	61.6	0	0	0	0	106.5	F185 W186 E191	F185-T189 PolarHBondContact O-N 2.88Å; W186-T189 HydrophobicContact CD2-CG2 4.4Å; W186-T189 HydrophobicContact CE3-CG2 4.31Å; W186-T189 PolarHBondContact O-N 3.07Å; W186-T189 PolarHBondContact O-OG1 3.33Å; T189-E191 VanDerWaalsContact C-N 3.32Å; T189-E191 PolarHBondContact O-N 3Å
190	T	41.1	Very low	60.5	Low	119 Å²	119	89.7 Å²	89.7	73%	0.73	46%	0.459	S	S	*	.			trans	-65	95.5	176.3	50.1	0	0	0	0	108	F188 H192	F188-T190 PolarHBondContact O-N 2.86Å; T190-H192 VanDerWaalsContact C-N 3.27Å; T190-H192 PolarHBondContact O-N 2.89Å
191	E	45.1	Very low	63.2	Low	161 Å²	161	85.6 Å²	85.6	75%	0.752	44%	0.443	S	S	*	.			trans	-59.1	96.9	168.3	-175.8	171.4	-152.4	0	0	106.4	T189 T193	T189-E191 VanDerWaalsContact C-N 3.32Å; T189-E191 PolarHBondContact O-N 3Å; E191-T193 PolarHBondContact O-N 2.75Å; E191-T193 PolarHBondContact O-OG1 3.31Å
192	H	66.9	Low	65.6	Low	135 Å²	135	80.6 Å²	80.6	63%	0.625	41%	0.413	S	S	*	.			trans	-66.6	83.4	-174	178.3	-70.6	0	0	0	108.3	T190 P194	T190-H192 VanDerWaalsContact C-N 3.27Å; T190-H192 PolarHBondContact O-N 2.89Å; H192-P194 WeakPolarHBondContact O-CD 3.41Å
193	T	78.4	Confident	68.2	Low	76 Å²	76	79.3 Å²	79.3	47%	0.466	40%	0.396	S	S	.	.			trans	-64.4	116.1	-177.1	-62.9	0	0	0	0	106.5	N67 E191	N67-T193 HydrophobicContact CB-CG2 3.82Å; E191-T193 PolarHBondContact O-N 2.75Å; E191-T193 PolarHBondContact O-OG1 3.31Å
194	P	90.3	Very high	70.9	Confident	60 Å²	60	77.2 Å²	77.2	39%	0.39	38%	0.375	S	S	.	.			trans	-61.2	144.5	-177.9	27	-34.5	0	0	0	108.8	N67 H192 Y196	N67-P194 WeakPolarHBondContact CB-O 3.31Å; N67-P194 PolarHBondContact ND2-O 2.94Å; H192-P194 WeakPolarHBondContact O-CD 3.41Å; P194-Y196 PolarHBondContact O-N 3.48Å
195	P	92.9	Very high	73.5	Confident	20 Å²	20	72.7 Å²	72.7	13%	0.13	35%	0.351	C	S	.	.	S	Bend	trans	-59.9	-20.3	-177.7	23	-33.2	0	0	0	112.9	N67 V68 P121 L124	N67-P195 PolarHBondContact N-O 2.84Å; V68-P195 HydrophobicContact CG2-CB 3.7Å; P121-P195 HydrophobicContact CB-CG 3.94Å; P121-P195 HydrophobicContact CG-CG 4.45Å; L124-P195 HydrophobicContact CD1-CB 3.51Å; L124-P195 HydrophobicContact CD1-CG 3.99Å
196	Y	95.9	Very high	76.5	Confident	15 Å²	15	65 Å²	65	6%	0.059	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.6	176.5	-58.5	-43.1	0	0	0	110.5	V64 R65 T66 F87 L93 W104 I118 P119 P121 L124 P194	V64-Y196 HydrophobicContact CB-CG 4.28Å; V64-Y196 HydrophobicContact CG1-CG 4.49Å; V64-Y196 HydrophobicContact CG2-CD1 3.95Å; V64-Y196 HydrophobicContact CG2-CG 4Å; R65-Y196 CarbonylContact O-C 3.59Å; R65-Y196 WeakPolarHBondContact O-CA 3.48Å; T66-Y196 HydrophobicContact CG2-CD1 4.17Å; T66-Y196 HydrophobicContact CG2-CE1 4.04Å; F87-Y196 HydrophobicContact CE1-CE1 4.44Å; F87-Y196 HydrophobicContact CE2-CE1 4.19Å; F87-Y196 AromaticContact CZ-CE1 3.77Å; F87-Y196 HydrophobicContact CZ-CE1 3.77Å; F87-Y196 AromaticContact CZ-CZ 3.99Å; F87-Y196 VanDerWaalsContact CZ-OH 3.28Å; F87-Y196 WeakPolarHBondContact CZ-OH 3.49Å; L93-Y196 HydrophobicContact CD1-CE1 3.96Å; W104-Y196 HydrophobicContact CE3-CE2 4.25Å; W104-Y196 AromaticContact CH2-CD2 3.85Å; W104-Y196 HydrophobicContact CH2-CD2 3.85Å; W104-Y196 HydrophobicContact CH2-CE2 4.19Å; W104-Y196 AromaticContact CZ3-CD2 3.58Å; W104-Y196 HydrophobicContact CZ3-CD2 3.58Å; W104-Y196 AromaticContact CZ3-CE2 3.69Å; W104-Y196 HydrophobicContact CZ3-CE2 3.69Å; I118-Y196 WeakPolarHBondContact CG2-OH 3.5Å; P119-Y196 WeakPolarHBondContact O-CE2 3.36Å; P119-Y196 PolarHBondContact O-OH 2.91Å; P121-Y196 HydrophobicContact CG-CD2 3.87Å; P121-Y196 HydrophobicContact CG-CE2 4.25Å; L124-Y196 HydrophobicContact CD1-CE1 4.24Å; L124-Y196 HydrophobicContact CD1-CE2 4.09Å; P194-Y196 PolarHBondContact O-N 3.48Å
197	D	94.1	Very high	79.6	Confident	14 Å²	14	55.8 Å²	55.8	8%	0.075	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	135.7	159.1	-75.9	-52.2	0	0	0	108.5	V64 R65 N67 R251	V64-D197 CarbonylContact C-O 3.59Å; V64-D197 WeakPolarHBondContact CA-O 3.46Å; V64-D197 WeakPolarHBondContact CB-O 3.32Å; R65-D197 IonicContact CZ-OD2 3.87Å; R65-D197 PolarHBondContact N-O 3.46Å; R65-D197 IonicContact NE-OD2 3.68Å; R65-D197 IonicContact NH2-OD2 2.67Å; R65-D197 PolarHBondContact NH2-OD2 3.47Å; R65-D197 PolarHBondContact O-N 3.03Å; N67-D197 VanDerWaalsContact ND2-CG 3.3Å; N67-D197 PolarHBondContact ND2-OD2 3.4Å; N67-D197 PolarHBondContact OD1-OD2 2.9Å; D197-R251 VanDerWaalsContact OD1-CD 3.28Å; D197-R251 WeakPolarHBondContact OD1-CD 3.17Å; D197-R251 IonicContact OD1-CZ 3.62Å; D197-R251 IonicContact OD1-NE 3.74Å; D197-R251 PolarHBondContact OD1-NE 3.47Å; D197-R251 IonicContact OD2-CZ 2.74Å; D197-R251 IonicContact OD2-NE 3.65Å; D197-R251 PolarHBondContact OD2-NE 3.08Å; D197-R251 IonicContact OD2-NH2 3.37Å
198	V	95.2	Very high	82.7	Confident	84 Å²	84	46 Å²	46	51%	0.509	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	132.7	171.6	-179.4	0	0	0	0	109.7	V64 F283	V64-V198 HydrophobicContact CG1-CG2 4.4Å; V198-F283 HydrophobicContact CG1-CE1 4.25Å
199	V	96.7	Very high	85.7	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	161.3	-174	-55.3	0	0	0	0	111.5	A63 R65 F92 S309 A311	A63-V199 HydrophobicContact CB-CG2 4.01Å; A63-V199 PolarHBondContact O-N 3.3Å; A63-V199 VanDerWaalsContact O-N 3.07Å; R65-V199 HydrophobicContact CB-CG1 3.8Å; F92-V199 HydrophobicContact CD1-CG2 4.15Å; F92-V199 HydrophobicContact CE1-CG2 4.32Å; V199-S309 WeakPolarHBondContact CA-O 3.47Å; V199-S309 WeakPolarHBondContact CG1-O 3.28Å; V199-A311 HydrophobicContact CB-CB 4.23Å; V199-A311 HydrophobicContact CG1-CB 3.78Å
200	P	97.1	Very high	88.8	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.019	19%	0.192	C	C	.	.			trans	-58.3	141	173.7	-23.7	34.5	0	0	0	112.1	M202 F283 A286 S309 L310	P200-M202 WeakPolarHBondContact CB-O 3.47Å; P200-M202 PolarHBondContact O-N 3.01Å; P200-F283 HydrophobicContact CB-CD1 4.49Å; P200-F283 HydrophobicContact CG-CD1 4.29Å; P200-F283 HydrophobicContact CG-CD2 3.87Å; P200-F283 HydrophobicContact CG-CE1 4.16Å; P200-F283 HydrophobicContact CG-CE2 3.73Å; P200-F283 HydrophobicContact CG-CG 4.16Å; P200-F283 HydrophobicContact CG-CZ 3.89Å; P200-A286 HydrophobicContact CB-CB 3.6Å; P200-S309 WeakPolarHBondContact CD-O 3.49Å; P200-L310 WeakPolarHBondContact CD-O 3.34Å; P200-L310 HydrophobicContact CG-CD2 4.08Å
201	S	96	Very high	91.4	Very high	13 Å²	13	29.6 Å²	29.6	9%	0.091	16%	0.157	C	C	.	.	S	Bend	trans	-62.1	-26.8	-176.6	-57.8	0	0	0	0	114.1	H94	H94-S201 PolarHBondContact NE2-O 3.42Å
202	M	97.4	Very high	93.8	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-117.7	126.9	164.2	-64	-65.4	-75.6	0	0	108.2	P200 P204 A286 L289 Q290 L291 Y381 W382 T385	P200-M202 WeakPolarHBondContact CB-O 3.47Å; P200-M202 PolarHBondContact O-N 3.01Å; M202-P204 WeakPolarHBondContact O-CD 3.36Å; M202-A286 HydrophobicContact CB-CB 4.23Å; M202-A286 WeakPolarHBondContact O-CB 3.39Å; M202-L289 WeakPolarHBondContact CE-O 3.28Å; M202-L289 VanDerWaalsContact CG-CA 3.46Å; M202-L289 HydrophobicContact CG-CB 4.29Å; M202-L289 HydrophobicContact CG-CD2 4.02Å; M202-L289 HydrophobicContact SD-CB 4.3Å; M202-L289 HydrophobicContact SD-CD2 4.01Å; M202-Q290 WeakPolarHBondContact CB-O 3.45Å; M202-Q290 WeakPolarHBondContact CG-O 3.3Å; M202-L291 HydrophobicContact CE-CD2 3.92Å; M202-Y381 HydrophobicContact CE-CD1 4.34Å; M202-Y381 HydrophobicContact CE-CE1 3.79Å; M202-Y381 HydrophobicContact SD-CE1 4.43Å; M202-W382 HydrophobicContact CE-CE3 4.27Å; M202-W382 HydrophobicContact CE-CZ3 4.42Å; M202-T385 HydrophobicContact CE-CG2 4.09Å; M202-T385 HydrophobicContact SD-CG2 3.57Å; M202-T385 VanDerWaalsContact SD-CG2 3.57Å
203	R	97.5	Very high	95.2	Very high	28 Å²	28	18.6 Å²	18.6	11%	0.106	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-64.4	124	178.4	-65.2	174.6	67	-162.4	0.7	109.1	F92 V205 A311 P312 I313 D359 Y381	F92-R203 HydrophobicContact CD1-CG 4.27Å; F92-R203 HydrophobicContact CE1-CG 3.92Å; F92-R203 HydrophobicContact CZ-CG 4.21Å; F92-R203 VanDerWaalsContact CZ-NE 3.31Å; R203-V205 PolarHBondContact O-N 3.28Å; R203-A311 WeakPolarHBondContact CG-O 3.1Å; R203-A311 PolarHBondContact NE-O 3.41Å; R203-P312 PolarHBondContact NH2-O 3.02Å; R203-I313 HydrophobicContact CB-CD1 3.93Å; R203-I313 HydrophobicContact CB-CG1 3.76Å; R203-D359 IonicContact CZ-OD1 2.7Å; R203-D359 IonicContact CZ-OD2 2.95Å; R203-D359 IonicContact NH1-OD1 3.26Å; R203-D359 PolarHBondContact NH1-OD1 3.41Å; R203-D359 IonicContact NH2-OD1 2.73Å; R203-D359 PolarHBondContact NH2-OD1 3.37Å; R203-D359 IonicContact NH2-OD2 3.17Å; R203-D359 PolarHBondContact NH2-OD2 3.25Å; R203-Y381 WeakPolarHBondContact CG-OH 3.48Å; R203-Y381 PolarHBondContact N-OH 2.75Å
204	P	97.7	Very high	96	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-68.6	131.7	178	24.8	-31.1	0	0	0	111	M202 I282 V292 L294 L310 P312 I313	M202-P204 WeakPolarHBondContact O-CD 3.36Å; P204-I282 HydrophobicContact CB-CG2 4.14Å; P204-I282 HydrophobicContact CG-CG2 4.07Å; P204-V292 CarbonylContact C-O 3.59Å; P204-V292 WeakPolarHBondContact CA-O 3.49Å; P204-V292 HydrophobicContact CB-CB 4.43Å; P204-V292 HydrophobicContact CB-CG1 4.26Å; P204-L294 HydrophobicContact CB-CD1 3.72Å; P204-L294 HydrophobicContact CB-CD2 4.32Å; P204-L294 HydrophobicContact CB-CG 3.83Å; P204-L294 HydrophobicContact CG-CD1 4.25Å; P204-L310 WeakPolarHBondContact CD-O 3.29Å; P204-L310 HydrophobicContact CG-CB 4.19Å; P204-P312 HydrophobicContact CG-CB 4.2Å; P204-P312 CarbonylContact O-C 3.54Å; P204-P312 WeakPolarHBondContact O-CA 3.1Å; P204-P312 WeakPolarHBondContact O-CB 3.42Å; P204-I313 PolarHBondContact O-N 2.94Å
205	V	98.3	Very high	96.3	Very high	3 Å²	3	17 Å²	17	2%	0.018	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	133.1	177.3	-170.7	0	0	0	0	110	R203 V292 V293 L294 I313 V315 L378	R203-V205 PolarHBondContact O-N 3.28Å; V205-V292 PolarHBondContact N-O 3.34Å; V205-V293 HydrophobicContact CB-CB 4.49Å; V205-V293 HydrophobicContact CB-CG1 4.38Å; V205-V293 HydrophobicContact CB-CG2 4.04Å; V205-V293 HydrophobicContact CG2-CG2 4.17Å; V205-L294 PolarHBondContact O-N 2.73Å; V205-I313 WeakPolarHBondContact CA-O 3.29Å; V205-I313 HydrophobicContact CG1-CG2 4.35Å; V205-I313 HydrophobicContact CG2-CB 4.32Å; V205-I313 HydrophobicContact CG2-CD1 4.3Å; V205-V315 HydrophobicContact CG1-CG2 3.68Å; V205-L378 HydrophobicContact CG2-CD2 3.79Å
206	V	97.8	Very high	96.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	120.1	-179.9	-176.1	0	0	0	0	110.2	V208 L294 I299 L305 P312 I313 I314 V315	V206-V208 HydrophobicContact CG1-CG1 4.46Å; V206-L294 HydrophobicContact CG2-CB 4.31Å; V206-L294 HydrophobicContact CG2-CD1 4.17Å; V206-L294 HydrophobicContact CG2-CG 4.49Å; V206-I299 HydrophobicContact CG1-CB 4.38Å; V206-I299 HydrophobicContact CG1-CG2 4Å; V206-L305 HydrophobicContact CG1-CD1 4.26Å; V206-L305 HydrophobicContact CG2-CD1 4.01Å; V206-P312 HydrophobicContact CG2-CB 3.77Å; V206-I313 PolarHBondContact N-O 3.35Å; V206-I314 HydrophobicContact CB-CD1 4.2Å; V206-V315 PolarHBondContact O-N 2.89Å
207	L	97.7	Very high	96.5	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.01	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.1	173.3	-76.2	166.6	0	0	0	111.5	K213 Q222 L225 F226 V315 V317	L207-K213 WeakPolarHBondContact O-CE 3.48Å; L207-K213 PolarHBondContact O-NZ 3.03Å; L207-K213 VanDerWaalsContact O-NZ 3.08Å; L207-Q222 HydrophobicContact CB-CG 4.11Å; L207-Q222 HydrophobicContact CD1-CB 4.2Å; L207-Q222 HydrophobicContact CD1-CG 4.39Å; L207-Q222 PolarHBondContact O-NE2 3.37Å; L207-L225 HydrophobicContact CD1-CB 3.93Å; L207-L225 HydrophobicContact CD1-CD1 4.27Å; L207-L225 HydrophobicContact CD2-CD1 3.83Å; L207-F226 HydrophobicContact CB-CZ 4.43Å; L207-F226 HydrophobicContact CD1-CD1 3.94Å; L207-F226 HydrophobicContact CD1-CD2 4.46Å; L207-F226 HydrophobicContact CD1-CE1 3.66Å; L207-F226 HydrophobicContact CD1-CE2 4.22Å; L207-F226 HydrophobicContact CD1-CG 4.33Å; L207-F226 HydrophobicContact CD1-CZ 3.82Å; L207-F226 HydrophobicContact CG-CE1 4.41Å; L207-V315 WeakPolarHBondContact CA-O 3.38Å; L207-V315 HydrophobicContact CD2-CB 3.79Å; L207-V315 HydrophobicContact CD2-CG1 3.56Å; L207-V317 HydrophobicContact CD2-CG2 3.81Å
208	V	97.3	Very high	96.6	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	153.1	171.7	-62.1	0	0	0	0	111	V206 I299 I314 V315 Y316 V317 L350 F358	V206-V208 HydrophobicContact CG1-CG1 4.46Å; V208-I299 HydrophobicContact CG1-CG2 4.17Å; V208-I314 HydrophobicContact CG1-CG2 4.43Å; V208-I314 HydrophobicContact CG2-CG2 3.62Å; V208-V315 PolarHBondContact N-O 3.02Å; V208-Y316 HydrophobicContact CG2-CD2 4.48Å; V208-Y316 WeakPolarHBondContact O-CA 3.42Å; V208-V317 PolarHBondContact O-N 2.7Å; V208-L350 HydrophobicContact CG2-CD2 4.41Å; V208-F358 HydrophobicContact CG2-CD1 4.46Å; V208-F358 HydrophobicContact CG2-CE1 4.13Å
209	G	95.8	Very high	96.6	Very high	1 Å²	1	17 Å²	17	1%	0.01	10%	0.099	C	C	.	.			trans	75	175.9	-176.8	0	0	0	0	0	114.1	S211 Q222 V317	G209-S211 VanDerWaalsContact C-N 3.31Å; G209-Q222 PolarHBondContact O-NE2 2.67Å; G209-V317 CarbonylContact C-O 3.52Å
210	P	95.9	Very high	96.6	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.019	12%	0.123	C	C	.	.	S	Bend	cis	-78.2	-7.7	5.3	32.2	-36.9	0	0	0	114.9	M221 V317 I319 A347	P210-M221 HydrophobicContact CG-CE 4.21Å; P210-M221 HydrophobicContact CG-SD 3.83Å; P210-V317 WeakPolarHBondContact CA-O 3.44Å; P210-V317 WeakPolarHBondContact CB-O 3.31Å; P210-I319 HydrophobicContact CB-CB 4.28Å; P210-I319 HydrophobicContact CB-CD1 3.71Å; P210-I319 HydrophobicContact CB-CG1 3.75Å; P210-I319 HydrophobicContact CG-CD1 3.61Å; P210-I319 HydrophobicContact CG-CG1 4.09Å; P210-A347 WeakPolarHBondContact O-CB 3.42Å
211	S	96.3	Very high	96.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.007	14%	0.137	C	C	.	.	S	Bend	trans	-143.1	-160.3	176.9	-177.4	0	0	0	0	109	G209 T218 Q343	G209-S211 VanDerWaalsContact C-N 3.31Å; S211-T218 WeakPolarHBondContact CB-OG1 3.44Å; S211-Q343 WeakPolarHBondContact OG-CA 3.38Å; S211-Q343 WeakPolarHBondContact OG-CB 3.34Å; S211-Q343 PolarHBondContact OG-O 2.88Å
212	L	95.7	Very high	96.7	Very high	44 Å²	44	24.4 Å²	24.4	23%	0.23	13%	0.134	C	C	.	.			trans	-65.6	142.5	170.4	-65	177.9	0	0	0	111.8	Y215 T218 N300 V342 A346	L212-Y215 HydrophobicContact CB-CD2 3.71Å; L212-Y215 HydrophobicContact CB-CE2 3.76Å; L212-Y215 HydrophobicContact CD1-CE2 3.91Å; L212-Y215 HydrophobicContact CG-CE2 4.46Å; L212-T218 WeakPolarHBondContact O-CB 3.18Å; L212-T218 PolarHBondContact O-OG1 2.87Å; L212-N300 VanDerWaalsContact CA-OD1 3.27Å; L212-N300 WeakPolarHBondContact CA-OD1 3.34Å; L212-N300 HydrophobicContact CD2-CB 4.08Å; L212-V342 HydrophobicContact CD1-CG2 3.91Å; L212-A346 HydrophobicContact CD1-CB 4.21Å; L212-A346 HydrophobicContact CD2-CB 3.54Å; L212-A346 HydrophobicContact CG-CB 3.43Å; L212-A346 VanDerWaalsContact CG-CB 3.43Å
213	K	95.4	Very high	96.6	Very high	20 Å²	20	30.1 Å²	30.1	9%	0.087	16%	0.159	C	C	.	.	S	Bend	trans	-68.2	162.8	163.4	-58.7	-168.1	-178.9	-157.5	0	111.4	L207 Y215 T218 D219 A296 I299 N300	L207-K213 WeakPolarHBondContact O-CE 3.48Å; L207-K213 PolarHBondContact O-NZ 3.03Å; L207-K213 VanDerWaalsContact O-NZ 3.08Å; K213-Y215 VanDerWaalsContact C-N 3.31Å; K213-T218 HydrophobicContact CG-CG2 4.16Å; K213-D219 WeakPolarHBondContact CA-OD1 3.37Å; K213-A296 VanDerWaalsContact CD-O 3.32Å; K213-A296 WeakPolarHBondContact CD-O 3.49Å; K213-A296 WeakPolarHBondContact CE-O 3.36Å; K213-A296 PolarHBondContact NZ-O 3.32Å; K213-I299 WeakPolarHBondContact CE-O 3.33Å; K213-N300 PolarHBondContact N-OD1 2.92Å
214	G	94.6	Very high	96.6	Very high	61 Å²	61	30.3 Å²	30.3	63%	0.629	17%	0.166	S	C	*	.	S	Bend	trans	78	19.3	-173	0	0	0	0	0	112.9	D219	G214-D219 WeakPolarHBondContact CA-OD2 3.47Å; G214-D219 PolarHBondContact N-OD1 2.94Å; G214-D219 PolarHBondContact N-OD2 2.74Å
215	Y	96.5	Very high	96.6	Very high	42 Å²	42	30.6 Å²	30.6	17%	0.165	17%	0.168	C	C	.	.	S	Bend	trans	-136	135	175.2	-65.3	-75.8	0	0	0	109.8	L212 K213 V217 T218 D219 H339 Q343	L212-Y215 HydrophobicContact CB-CD2 3.71Å; L212-Y215 HydrophobicContact CB-CE2 3.76Å; L212-Y215 HydrophobicContact CD1-CE2 3.91Å; L212-Y215 HydrophobicContact CG-CE2 4.46Å; K213-Y215 VanDerWaalsContact C-N 3.31Å; Y215-V217 PolarHBondContact O-N 3.5Å; Y215-T218 PolarHBondContact O-N 2.74Å; Y215-D219 PolarHBondContact N-OD2 2.94Å; Y215-D219 VanDerWaalsContact O-CG 3.25Å; Y215-D219 PolarHBondContact O-N 2.86Å; Y215-H339 HydrophobicContact CD1-CB 4.24Å; Y215-H339 HydrophobicContact CE1-CB 3.4Å; Y215-H339 VanDerWaalsContact CE1-CB 3.4Å; Y215-H339 AromaticContact CE1-CG 3.64Å; Y215-Q343 HydrophobicContact CD1-CG 4.31Å; Y215-Q343 HydrophobicContact CD2-CG 3.84Å; Y215-Q343 HydrophobicContact CE1-CG 4.48Å; Y215-Q343 HydrophobicContact CE2-CG 4.04Å; Y215-Q343 HydrophobicContact CG-CG 3.95Å; Y215-Q343 VanDerWaalsContact CG-NE2 3.25Å
216	E	96.4	Very high	96.6	Very high	58 Å²	58	31.5 Å²	31.5	27%	0.271	17%	0.172	S	C	.	.	H	α-helix	trans	-51	-34.9	-167.4	-69.2	166.8	-125.9	0	0	115	M220 R332 Q336	E216-M220 WeakPolarHBondContact O-CB 3.2Å; E216-M220 WeakPolarHBondContact O-CG 3.36Å; E216-M220 PolarHBondContact O-N 2.99Å; E216-R332 HydrophobicContact CB-CG 4.33Å; E216-R332 IonicContact OE2-CZ 3.04Å; E216-R332 IonicContact OE2-NE 3.65Å; E216-R332 PolarHBondContact OE2-NE 2.79Å; E216-R332 IonicContact OE2-NH2 3.22Å; E216-R332 PolarHBondContact OE2-NH2 2.82Å; E216-Q336 HydrophobicContact CB-CG 4.33Å; E216-Q336 HydrophobicContact CG-CG 4.33Å; E216-Q336 VanDerWaalsContact OE1-CG 3.32Å; E216-Q336 WeakPolarHBondContact OE1-CG 3.49Å; E216-Q336 PolarHBondContact OE1-NE2 3.14Å
217	V	96.5	Very high	96.6	Very high	11 Å²	11	34.5 Å²	34.5	7%	0.067	19%	0.188	C	C	.	.	H	α-helix	trans	-67.8	-50.3	-179.9	-178.8	0	0	0	0	111.2	Y215 M221 L325 L328 I329 R332	Y215-V217 PolarHBondContact O-N 3.5Å; V217-M221 HydrophobicContact CG1-SD 4.16Å; V217-M221 VanDerWaalsContact O-CG 3.26Å; V217-M221 WeakPolarHBondContact O-CG 3.31Å; V217-M221 PolarHBondContact O-N 3.14Å; V217-L325 HydrophobicContact CG1-CD1 4.13Å; V217-L328 HydrophobicContact CG1-CB 4.13Å; V217-L328 HydrophobicContact CG2-CB 4.36Å; V217-I329 HydrophobicContact CG2-CG1 4.01Å; V217-R332 HydrophobicContact CG2-CG 3.81Å
218	T	96.6	Very high	96.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-49.1	178.3	-51.7	0	0	0	0	110.5	S211 L212 K213 Y215 M220 M221 Q222	S211-T218 WeakPolarHBondContact CB-OG1 3.44Å; L212-T218 WeakPolarHBondContact O-CB 3.18Å; L212-T218 PolarHBondContact O-OG1 2.87Å; K213-T218 HydrophobicContact CG-CG2 4.16Å; Y215-T218 PolarHBondContact O-N 2.74Å; T218-M220 PolarHBondContact O-N 3.13Å; T218-M221 PolarHBondContact O-N 3.41Å; T218-Q222 HydrophobicContact CG2-CG 4.41Å; T218-Q222 WeakPolarHBondContact O-CG 3.46Å; T218-Q222 PolarHBondContact O-N 3.19Å
219	D	96.3	Very high	96.6	Very high	63 Å²	63	37.5 Å²	37.5	34%	0.337	20%	0.201	S	C	.	.	H	α-helix	trans	-67.9	-38.4	-170.9	-55.9	-13.6	0	0	0	111.2	K213 G214 Y215 K223	K213-D219 WeakPolarHBondContact CA-OD1 3.37Å; G214-D219 WeakPolarHBondContact CA-OD2 3.47Å; G214-D219 PolarHBondContact N-OD1 2.94Å; G214-D219 PolarHBondContact N-OD2 2.74Å; Y215-D219 PolarHBondContact N-OD2 2.94Å; Y215-D219 VanDerWaalsContact O-CG 3.25Å; Y215-D219 PolarHBondContact O-N 2.86Å; D219-K223 VanDerWaalsContact O-CB 3.22Å; D219-K223 WeakPolarHBondContact O-CB 3.48Å; D219-K223 PolarHBondContact O-N 3.06Å
220	M	96.2	Very high	96.6	Very high	106 Å²	106	42.8 Å²	42.8	52%	0.522	22%	0.224	S	C	.	.	H	α-helix	trans	-68.3	-39.4	174.8	-72.1	-177.7	64.8	0	0	112.7	E216 T218 K223 A224 R332	E216-M220 WeakPolarHBondContact O-CB 3.2Å; E216-M220 WeakPolarHBondContact O-CG 3.36Å; E216-M220 PolarHBondContact O-N 2.99Å; T218-M220 PolarHBondContact O-N 3.13Å; M220-K223 PolarHBondContact O-N 3.36Å; M220-A224 PolarHBondContact O-N 3.3Å; M220-A224 VanDerWaalsContact O-N 3.07Å; M220-R332 VanDerWaalsContact SD-CZ 3.58Å; M220-R332 PolarHBondContact SD-NH1 3.32Å
221	M	96.6	Very high	96.6	Very high	64 Å²	64	48 Å²	48	32%	0.315	25%	0.247	S	C	.	.	H	α-helix	trans	-67.2	-44.6	178	-71.3	177.5	72.5	0	0	111.5	P210 V217 T218 A224 L225 V317 I319	P210-M221 HydrophobicContact CG-CE 4.21Å; P210-M221 HydrophobicContact CG-SD 3.83Å; V217-M221 HydrophobicContact CG1-SD 4.16Å; V217-M221 VanDerWaalsContact O-CG 3.26Å; V217-M221 WeakPolarHBondContact O-CG 3.31Å; V217-M221 PolarHBondContact O-N 3.14Å; T218-M221 PolarHBondContact O-N 3.41Å; M221-A224 PolarHBondContact O-N 3.48Å; M221-L225 PolarHBondContact O-N 3.16Å; M221-V317 HydrophobicContact CE-CG1 3.9Å; M221-I319 HydrophobicContact CE-CD1 4.15Å; M221-I319 HydrophobicContact CE-CG1 4.23Å; M221-I319 HydrophobicContact SD-CD1 4.07Å
222	Q	97.4	Very high	96.6	Very high	5 Å²	5	54.5 Å²	54.5	2%	0.023	27%	0.272	C	S	.	.	H	α-helix	trans	-67.2	-38.8	175.5	-65.9	-166.2	6.5	0	0	112.1	L207 G209 T218 A224 L225 F226	L207-Q222 HydrophobicContact CB-CG 4.11Å; L207-Q222 HydrophobicContact CD1-CB 4.2Å; L207-Q222 HydrophobicContact CD1-CG 4.39Å; L207-Q222 PolarHBondContact O-NE2 3.37Å; G209-Q222 PolarHBondContact O-NE2 2.67Å; T218-Q222 HydrophobicContact CG2-CG 4.41Å; T218-Q222 WeakPolarHBondContact O-CG 3.46Å; T218-Q222 PolarHBondContact O-N 3.19Å; Q222-A224 VanDerWaalsContact C-N 3.3Å; Q222-A224 PolarHBondContact O-N 2.7Å; Q222-L225 PolarHBondContact O-N 3.18Å; Q222-F226 HydrophobicContact CB-CE2 4.21Å; Q222-F226 WeakPolarHBondContact O-CD2 3.42Å; Q222-F226 WeakPolarHBondContact O-CG 3.36Å; Q222-F226 PolarHBondContact O-N 2.78Å
223	K	96.9	Very high	96.6	Very high	121 Å²	121	52.4 Å²	52.4	53%	0.526	26%	0.261	S	S	.	.	H	α-helix	trans	-59.2	-40.5	174.6	-166.8	-156.3	166.9	-65	0	111.7	D219 M220 F226 D227	D219-K223 VanDerWaalsContact O-CB 3.22Å; D219-K223 WeakPolarHBondContact O-CB 3.48Å; D219-K223 PolarHBondContact O-N 3.06Å; M220-K223 PolarHBondContact O-N 3.36Å; K223-F226 PolarHBondContact O-N 3.46Å; K223-D227 IonicContact NZ-OD2 3.56Å; K223-D227 PolarHBondContact NZ-OD2 3.31Å; K223-D227 WeakPolarHBondContact O-CB 3.22Å; K223-D227 PolarHBondContact O-N 3.5Å
224	A	97.6	Very high	96.6	Very high	31 Å²	31	59 Å²	59	26%	0.256	29%	0.292	S	S	.	.	H	α-helix	trans	-61	-44.8	177.8	0	0	0	0	0	111.8	M220 M221 Q222 D227 F228 L367	M220-A224 PolarHBondContact O-N 3.3Å; M220-A224 VanDerWaalsContact O-N 3.07Å; M221-A224 PolarHBondContact O-N 3.48Å; Q222-A224 VanDerWaalsContact C-N 3.3Å; Q222-A224 PolarHBondContact O-N 2.7Å; A224-D227 PolarHBondContact O-N 3.39Å; A224-F228 PolarHBondContact O-N 3.05Å; A224-L367 HydrophobicContact CB-CD1 3.84Å; A224-L367 HydrophobicContact CB-CD2 3.9Å
225	L	97.9	Very high	96.5	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-43.4	175.3	-65.7	168.4	0	0	0	112.1	L207 M221 Q222 D227 F228 L229 V317 L362 L367 L374	L207-L225 HydrophobicContact CD1-CB 3.93Å; L207-L225 HydrophobicContact CD1-CD1 4.27Å; L207-L225 HydrophobicContact CD2-CD1 3.83Å; M221-L225 PolarHBondContact O-N 3.16Å; Q222-L225 PolarHBondContact O-N 3.18Å; L225-D227 VanDerWaalsContact C-N 3.35Å; L225-D227 PolarHBondContact O-N 3.14Å; L225-F228 PolarHBondContact O-N 3.11Å; L225-L229 WeakPolarHBondContact O-CB 3.44Å; L225-L229 VanDerWaalsContact O-CG 3.31Å; L225-L229 WeakPolarHBondContact O-CG 3.34Å; L225-L229 PolarHBondContact O-N 3.33Å; L225-V317 HydrophobicContact CD1-CG2 3.52Å; L225-L362 HydrophobicContact CD1-CD1 4.22Å; L225-L362 HydrophobicContact CD2-CD1 4.34Å; L225-L367 HydrophobicContact CD2-CD1 4.16Å; L225-L374 HydrophobicContact CD2-CD2 4.44Å
226	F	97.3	Very high	96.5	Very high	22 Å²	22	60.2 Å²	60.2	10%	0.096	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-40.2	174.9	-70.3	-49.8	0	0	0	112.6	L207 Q222 K223 L229 K230 V293 D295	L207-F226 HydrophobicContact CB-CZ 4.43Å; L207-F226 HydrophobicContact CD1-CD1 3.94Å; L207-F226 HydrophobicContact CD1-CD2 4.46Å; L207-F226 HydrophobicContact CD1-CE1 3.66Å; L207-F226 HydrophobicContact CD1-CE2 4.22Å; L207-F226 HydrophobicContact CD1-CG 4.33Å; L207-F226 HydrophobicContact CD1-CZ 3.82Å; L207-F226 HydrophobicContact CG-CE1 4.41Å; Q222-F226 HydrophobicContact CB-CE2 4.21Å; Q222-F226 WeakPolarHBondContact O-CD2 3.42Å; Q222-F226 WeakPolarHBondContact O-CG 3.36Å; Q222-F226 PolarHBondContact O-N 2.78Å; K223-F226 PolarHBondContact O-N 3.46Å; F226-L229 PolarHBondContact O-N 2.75Å; F226-K230 WeakPolarHBondContact O-CB 3.48Å; F226-K230 PolarHBondContact O-N 3Å; F226-V293 HydrophobicContact CD1-CG1 3.81Å; F226-V293 HydrophobicContact CE1-CG1 3.57Å; F226-D295 HydrophobicContact CE2-CB 3.96Å; F226-D295 WeakPolarHBondContact CE2-OD1 3.25Å; F226-D295 HydrophobicContact CZ-CB 3.89Å
227	D	97.2	Very high	96.5	Very high	64 Å²	64	58.7 Å²	58.7	34%	0.342	29%	0.291	S	S	.	.	H	α-helix	trans	-67.5	-40.9	178.9	-136	-7.1	0	0	0	111.3	K223 A224 L225 H231	K223-D227 IonicContact NZ-OD2 3.56Å; K223-D227 PolarHBondContact NZ-OD2 3.31Å; K223-D227 WeakPolarHBondContact O-CB 3.22Å; K223-D227 PolarHBondContact O-N 3.5Å; A224-D227 PolarHBondContact O-N 3.39Å; L225-D227 VanDerWaalsContact C-N 3.35Å; L225-D227 PolarHBondContact O-N 3.14Å; D227-H231 PolarHBondContact O-N 3.13Å; D227-H231 PolarHBondContact O-ND1 3.24Å; D227-H231 IonicContact OD1-CE1 2.71Å; D227-H231 PolarHBondContact OD1-CE1 2.78Å; D227-H231 IonicContact OD1-ND1 3.64Å
228	F	97.4	Very high	96.5	Very high	63 Å²	63	59.6 Å²	59.6	28%	0.276	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-52.1	171.8	167.7	-98.1	0	0	0	111.6	A224 L225 K230 H231 R232 C371 A375	A224-F228 PolarHBondContact O-N 3.05Å; L225-F228 PolarHBondContact O-N 3.11Å; F228-K230 VanDerWaalsContact C-N 3.28Å; F228-K230 PolarHBondContact O-N 3.47Å; F228-H231 PolarHBondContact O-N 3.49Å; F228-R232 HydrophobicContact CE1-CB 4.08Å; F228-R232 HydrophobicContact CE1-CG 4.12Å; F228-R232 HydrophobicContact CE2-CB 4.13Å; F228-R232 HydrophobicContact CE2-CG 4.31Å; F228-R232 HydrophobicContact CZ-CB 3.89Å; F228-R232 HydrophobicContact CZ-CG 3.74Å; F228-R232 WeakPolarHBondContact O-CB 3.34Å; F228-R232 PolarHBondContact O-N 2.77Å; F228-C371 HydrophobicContact CD1-CB 3.61Å; F228-C371 HydrophobicContact CD2-CB 3.78Å; F228-C371 HydrophobicContact CE1-CB 3.6Å; F228-C371 WeakPolarHBondContact CE1-O 3.36Å; F228-C371 HydrophobicContact CE2-CB 3.76Å; F228-C371 HydrophobicContact CG-CB 3.7Å; F228-C371 VanDerWaalsContact CG-SG 3.51Å; F228-C371 HydrophobicContact CZ-CB 3.67Å; F228-C371 WeakPolarHBondContact CZ-O 3.47Å; F228-A375 HydrophobicContact CE1-CB 4.02Å; F228-A375 HydrophobicContact CZ-CB 4Å
229	L	97.3	Very high	96.4	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-57.6	-40.8	-179	-74	178	0	0	0	112.3	L225 F226 H231 R232 F233 I237 L374 L378	L225-L229 WeakPolarHBondContact O-CB 3.44Å; L225-L229 VanDerWaalsContact O-CG 3.31Å; L225-L229 WeakPolarHBondContact O-CG 3.34Å; L225-L229 PolarHBondContact O-N 3.33Å; F226-L229 PolarHBondContact O-N 2.75Å; L229-H231 VanDerWaalsContact C-N 3.33Å; L229-H231 PolarHBondContact O-N 2.75Å; L229-R232 PolarHBondContact O-N 2.83Å; L229-F233 HydrophobicContact CD2-CD2 3.89Å; L229-F233 HydrophobicContact CD2-CE2 3.75Å; L229-F233 PolarHBondContact O-N 2.92Å; L229-I237 HydrophobicContact CB-CD1 3.86Å; L229-L374 HydrophobicContact CD1-CD2 4.06Å; L229-L374 HydrophobicContact CD2-CD2 4.1Å; L229-L374 HydrophobicContact CD2-CG 4.23Å; L229-L374 HydrophobicContact CG-CD2 4.25Å; L229-L378 HydrophobicContact CD2-CD1 3.58Å
230	K	96.1	Very high	96.4	Very high	113 Å²	113	60.7 Å²	60.7	49%	0.491	30%	0.303	S	S	.	.	H	α-helix	trans	-55.4	-46.1	178.2	-173.2	-165.5	169	-148	0	112.3	F226 F228 E234 I239	F226-K230 WeakPolarHBondContact O-CB 3.48Å; F226-K230 PolarHBondContact O-N 3Å; F228-K230 VanDerWaalsContact C-N 3.28Å; F228-K230 PolarHBondContact O-N 3.47Å; K230-E234 PolarHBondContact O-N 2.87Å; K230-I239 HydrophobicContact CB-CD1 3.72Å; K230-I239 HydrophobicContact CG-CD1 4.3Å
231	H	96.1	Very high	96.3	Very high	112 Å²	112	62.2 Å²	62.2	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-83.3	-36.8	-178.4	-59.8	99	0	0	0	111.9	D227 F228 L229 F233	D227-H231 PolarHBondContact O-N 3.13Å; D227-H231 PolarHBondContact O-ND1 3.24Å; D227-H231 IonicContact OD1-CE1 2.71Å; D227-H231 PolarHBondContact OD1-CE1 2.78Å; D227-H231 IonicContact OD1-ND1 3.64Å; F228-H231 PolarHBondContact O-N 3.49Å; L229-H231 VanDerWaalsContact C-N 3.33Å; L229-H231 PolarHBondContact O-N 2.75Å; H231-F233 PolarHBondContact O-N 3.18Å
232	R	96.4	Very high	96.2	Very high	138 Å²	138	59.2 Å²	59.2	52%	0.521	29%	0.288	S	S	.	.	H	α-helix	trans	-67.5	-33.1	-179.4	-177.7	56.6	171.4	169.9	-4.5	113.2	F228 L229 A375	F228-R232 HydrophobicContact CE1-CB 4.08Å; F228-R232 HydrophobicContact CE1-CG 4.12Å; F228-R232 HydrophobicContact CE2-CB 4.13Å; F228-R232 HydrophobicContact CE2-CG 4.31Å; F228-R232 HydrophobicContact CZ-CB 3.89Å; F228-R232 HydrophobicContact CZ-CG 3.74Å; F228-R232 WeakPolarHBondContact O-CB 3.34Å; F228-R232 PolarHBondContact O-N 2.77Å; L229-R232 PolarHBondContact O-N 2.83Å; R232-A375 HydrophobicContact CG-CB 4.32Å
233	F	96.6	Very high	95.8	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	26	-178.2	-64.3	-86.2	0	0	0	113.1	L229 H231 G235 R236 I237 L291 A375 L378 E379	L229-F233 HydrophobicContact CD2-CD2 3.89Å; L229-F233 HydrophobicContact CD2-CE2 3.75Å; L229-F233 PolarHBondContact O-N 2.92Å; H231-F233 PolarHBondContact O-N 3.18Å; F233-G235 PolarHBondContact O-N 3.13Å; F233-R236 CarbonylContact O-C 3.53Å; F233-R236 WeakPolarHBondContact O-CA 3.41Å; F233-R236 PolarHBondContact O-N 2.98Å; F233-I237 HydrophobicContact CB-CB 3.78Å; F233-I237 HydrophobicContact CB-CD1 4.15Å; F233-I237 HydrophobicContact CB-CG1 4.5Å; F233-I237 HydrophobicContact CB-CG2 4.04Å; F233-I237 WeakPolarHBondContact O-CB 3.36Å; F233-I237 WeakPolarHBondContact O-CG2 3.36Å; F233-I237 PolarHBondContact O-N 3.19Å; F233-I237 VanDerWaalsContact O-N 3.07Å; F233-L291 HydrophobicContact CB-CD1 4.23Å; F233-L291 HydrophobicContact CD1-CD1 3.47Å; F233-L291 VanDerWaalsContact CD1-CD1 3.47Å; F233-L291 HydrophobicContact CE1-CD1 3.89Å; F233-L291 HydrophobicContact CG-CD1 3.84Å; F233-A375 HydrophobicContact CE2-CB 4.27Å; F233-A375 HydrophobicContact CZ-CB 4.24Å; F233-L378 HydrophobicContact CE1-CB 4.25Å; F233-L378 HydrophobicContact CE2-CB 4.29Å; F233-L378 HydrophobicContact CE2-CD1 4.28Å; F233-L378 HydrophobicContact CZ-CB 3.72Å; F233-E379 HydrophobicContact CE1-CG 3.88Å; F233-E379 HydrophobicContact CZ-CG 4.1Å
234	E	94.6	Very high	95.5	Very high	157 Å²	157	57.6 Å²	57.6	73%	0.734	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	136.1	178.7	-173.2	165.6	-149.5	0	0	111.9	K230 R236	K230-E234 PolarHBondContact O-N 2.87Å; E234-R236 PolarHBondContact O-N 3.27Å; E234-R236 VanDerWaalsContact O-N 3.13Å
235	G	92.8	Very high	95.1	Very high	64 Å²	64	58 Å²	58	66%	0.66	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	-15.1	-173.2	0	0	0	0	0	116	F233 Q290	F233-G235 PolarHBondContact O-N 3.13Å; G235-Q290 PolarHBondContact O-NE2 2.64Å
236	R	95.6	Very high	94.8	Very high	65 Å²	65	57.7 Å²	57.7	25%	0.245	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-7.8	176.5	-66	-172.4	-69.5	154.9	-1.6	114.2	F233 E234 Q290 L291 E379 W382	F233-R236 CarbonylContact O-C 3.53Å; F233-R236 WeakPolarHBondContact O-CA 3.41Å; F233-R236 PolarHBondContact O-N 2.98Å; E234-R236 PolarHBondContact O-N 3.27Å; E234-R236 VanDerWaalsContact O-N 3.13Å; R236-Q290 WeakPolarHBondContact O-CB 3.37Å; R236-L291 PolarHBondContact O-N 2.93Å; R236-E379 IonicContact CZ-OE1 2.77Å; R236-E379 IonicContact CZ-OE2 3.17Å; R236-E379 IonicContact NH1-OE1 3.92Å; R236-E379 PolarHBondContact NH1-OE1 3Å; R236-E379 IonicContact NH1-OE2 3.41Å; R236-E379 PolarHBondContact NH1-OE2 2.81Å; R236-E379 IonicContact NH2-OE1 3.38Å; R236-E379 PolarHBondContact NH2-OE1 2.88Å; R236-E379 IonicContact NH2-OE2 3.88Å; R236-W382 HydrophobicContact CB-CH2 3.9Å; R236-W382 HydrophobicContact CB-CZ2 4.36Å; R236-W382 HydrophobicContact CB-CZ3 4.06Å; R236-W382 HydrophobicContact CG-CH2 3.91Å; R236-W382 HydrophobicContact CG-CZ2 3.91Å
237	I	96.4	Very high	94.5	Very high	27 Å²	27	57.6 Å²	57.6	14%	0.138	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	142.6	-172.5	-163.2	171.6	0	0	0	113	L229 F233 I239 L291 V293	L229-I237 HydrophobicContact CB-CD1 3.86Å; F233-I237 HydrophobicContact CB-CB 3.78Å; F233-I237 HydrophobicContact CB-CD1 4.15Å; F233-I237 HydrophobicContact CB-CG1 4.5Å; F233-I237 HydrophobicContact CB-CG2 4.04Å; F233-I237 WeakPolarHBondContact O-CB 3.36Å; F233-I237 WeakPolarHBondContact O-CG2 3.36Å; F233-I237 PolarHBondContact O-N 3.19Å; F233-I237 VanDerWaalsContact O-N 3.07Å; I237-I239 HydrophobicContact CD1-CD1 4.08Å; I237-I239 HydrophobicContact CD1-CG1 3.85Å; I237-I239 HydrophobicContact CG1-CG1 3.96Å; I237-L291 CarbonylContact C-O 3.56Å; I237-L291 WeakPolarHBondContact CA-O 3.46Å; I237-L291 HydrophobicContact CB-CB 4.41Å; I237-L291 HydrophobicContact CG1-CB 4.15Å; I237-V293 HydrophobicContact CD1-CG2 3.77Å; I237-V293 HydrophobicContact CG1-CG2 3.93Å
238	S	96.2	Very high	94	Very high	29 Å²	29	57 Å²	57	20%	0.203	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	102.1	169	-171.2	0	0	0	0	109.2	L291 V293	S238-L291 PolarHBondContact N-O 3.19Å; S238-V293 PolarHBondContact O-N 2.75Å
239	I	95.9	Very high	93.2	Very high	62 Å²	62	54 Å²	54	32%	0.318	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.5	174.7	-50	-176	0	0	0	108.2	K230 I237 V293	K230-I239 HydrophobicContact CB-CD1 3.72Å; K230-I239 HydrophobicContact CG-CD1 4.3Å; I237-I239 HydrophobicContact CD1-CD1 4.08Å; I237-I239 HydrophobicContact CD1-CG1 3.85Å; I237-I239 HydrophobicContact CG1-CG1 3.96Å; I239-V293 WeakPolarHBondContact CA-O 3.1Å; I239-V293 HydrophobicContact CG1-CB 4.19Å; I239-V293 HydrophobicContact CG2-CB 4.44Å; I239-V293 HydrophobicContact CG2-CG1 4.44Å
240	T	95.6	Very high	92.5	Very high	24 Å²	24	58.2 Å²	58.2	15%	0.147	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138.2	-179.4	-171.4	0	0	0	0	111.6	R281 L285 V293 L294 D295	T240-R281 PolarHBondContact OG1-NH1 2.88Å; T240-R281 PolarHBondContact OG1-NH2 3.18Å; T240-L285 HydrophobicContact CG2-CD1 3.99Å; T240-V293 PolarHBondContact N-O 2.88Å; T240-L294 HydrophobicContact CG2-CD2 3.56Å; T240-L294 WeakPolarHBondContact O-CA 3.47Å; T240-D295 PolarHBondContact O-N 3.37Å
241	R	95.1	Very high	91.4	Very high	139 Å²	139	56.7 Å²	56.7	53%	0.525	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	138.8	175	-166.7	167.9	-174	-108.7	-7.3	110.1	R281 D295 D297	R241-R281 PolarHBondContact O-NH2 2.68Å; R241-D295 CarbonylContact C-O 3.57Å; R241-D295 WeakPolarHBondContact CA-O 3.45Å; R241-D295 HydrophobicContact CB-CB 4.37Å; R241-D295 HydrophobicContact CG-CB 4.32Å; R241-D295 WeakPolarHBondContact CG-O 3.45Å; R241-D295 IonicContact NE-OD2 3.96Å; R241-D297 IonicContact CZ-OD1 3.43Å; R241-D297 IonicContact CZ-OD2 3.69Å; R241-D297 IonicContact NE-OD1 2.75Å; R241-D297 IonicContact NH2-OD1 2.69Å; R241-D297 PolarHBondContact NH2-OD1 3.23Å; R241-D297 IonicContact NH2-OD2 3.72Å; R241-D297 PolarHBondContact NH2-OD2 3.31Å
242	V	94.1	Very high	89.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	106.2	-177.8	179.8	0	0	0	0	108.4	I246 L294 D295 A296 D297	V242-I246 HydrophobicContact CG1-CD1 4.29Å; V242-I246 HydrophobicContact CG1-CG1 4.32Å; V242-I246 HydrophobicContact CG1-CG2 3.74Å; V242-L294 HydrophobicContact CG2-CB 4.28Å; V242-L294 HydrophobicContact CG2-CD2 4.1Å; V242-D295 PolarHBondContact N-O 2.98Å; V242-A296 HydrophobicContact CB-CB 4.16Å; V242-A296 WeakPolarHBondContact O-CA 3.32Å; V242-D297 PolarHBondContact O-N 3.15Å
243	T	89.1	Confident	88.1	Confident	88 Å²	88	49.3 Å²	49.3	54%	0.54	26%	0.262	S	S	.	.			trans	-93.5	-17.6	-179.8	52	0	0	0	0	113.3
244	A	90.5	Very high	86.5	Confident	4 Å²	4	50.9 Å²	50.9	3%	0.033	27%	0.27	C	S	.	.	S	Bend	trans	-77.9	145	175.6	0	0	0	0	0	111.1	I246 S270 E274 V275 E278	A244-I246 VanDerWaalsContact C-N 3.31Å; A244-I246 PolarHBondContact O-N 3.43Å; A244-S270 WeakPolarHBondContact CA-OG 3.36Å; A244-E274 HydrophobicContact CB-CB 4.43Å; A244-V275 HydrophobicContact CB-CG2 4.14Å; A244-E278 HydrophobicContact CB-CG 3.95Å
245	D	89.9	Confident	85.1	Confident	39 Å²	39	50.3 Å²	50.3	21%	0.209	27%	0.272	C	S	.	.			trans	-76.9	80.9	178.6	-168.1	7.2	0	0	0	112.4	S247 L248 S270 T298	D245-S247 PolarHBondContact O-N 3.06Å; D245-S247 WeakPolarHBondContact OD1-CB 3.4Å; D245-S247 PolarHBondContact OD1-N 3.26Å; D245-S247 PolarHBondContact OD1-OG 2.77Å; D245-S247 PolarHBondContact OD2-OG 3.11Å; D245-L248 HydrophobicContact CB-CD1 4.28Å; D245-L248 HydrophobicContact CB-CG 4.31Å; D245-L248 WeakPolarHBondContact O-CB 3.27Å; D245-L248 WeakPolarHBondContact O-CG 3.4Å; D245-L248 PolarHBondContact O-N 3Å; D245-S270 PolarHBondContact N-OG 3.32Å; D245-T298 HydrophobicContact CB-CG2 4.07Å; D245-T298 PolarHBondContact OD1-OG1 2.86Å
246	I	91.5	Very high	83.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-60.4	-6.3	176.9	56.4	165.6	0	0	0	114.2	V242 A244 L248 A249 E278 I279 L294 I299 L305 T308 L310	V242-I246 HydrophobicContact CG1-CD1 4.29Å; V242-I246 HydrophobicContact CG1-CG1 4.32Å; V242-I246 HydrophobicContact CG1-CG2 3.74Å; A244-I246 VanDerWaalsContact C-N 3.31Å; A244-I246 PolarHBondContact O-N 3.43Å; I246-L248 PolarHBondContact O-N 3.17Å; I246-A249 WeakPolarHBondContact O-CB 3.34Å; I246-A249 PolarHBondContact O-N 3.49Å; I246-E278 HydrophobicContact CG2-CB 4.29Å; I246-I279 HydrophobicContact CB-CD1 4.41Å; I246-I279 HydrophobicContact CG2-CD1 4.29Å; I246-L294 HydrophobicContact CD1-CD1 4.2Å; I246-I299 HydrophobicContact CD1-CG1 4.42Å; I246-I299 HydrophobicContact CG1-CD1 4.17Å; I246-I299 HydrophobicContact CG1-CG1 4.21Å; I246-L305 HydrophobicContact CD1-CD2 4.05Å; I246-L305 HydrophobicContact CG1-CD2 4.06Å; I246-T308 WeakPolarHBondContact O-CG2 3.49Å; I246-L310 HydrophobicContact CD1-CD1 3.94Å
247	S	90	Very high	81.9	Confident	21 Å²	21	50.2 Å²	50.2	15%	0.147	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-70.1	-14.5	168.2	77.3	0	0	0	0	113.5	D245 A249	D245-S247 PolarHBondContact O-N 3.06Å; D245-S247 WeakPolarHBondContact OD1-CB 3.4Å; D245-S247 PolarHBondContact OD1-N 3.26Å; D245-S247 PolarHBondContact OD1-OG 2.77Å; D245-S247 PolarHBondContact OD2-OG 3.11Å; S247-A249 VanDerWaalsContact C-N 3.32Å
248	L	86.3	Confident	80.1	Confident	50 Å²	50	53.6 Å²	53.6	26%	0.262	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-77.4	-16.3	172.6	-58.5	178.7	0	0	0	113	D245 I246 K250 T268 V275	D245-L248 HydrophobicContact CB-CD1 4.28Å; D245-L248 HydrophobicContact CB-CG 4.31Å; D245-L248 WeakPolarHBondContact O-CB 3.27Å; D245-L248 WeakPolarHBondContact O-CG 3.4Å; D245-L248 PolarHBondContact O-N 3Å; I246-L248 PolarHBondContact O-N 3.17Å; L248-K250 PolarHBondContact O-N 2.91Å; L248-T268 HydrophobicContact CD1-CG2 4.18Å; L248-V275 HydrophobicContact CB-CG1 4.45Å
249	A	81.4	Confident	78.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.314	C	S	.	.			trans	-70.8	49	-177.2	0	0	0	0	0	114.6	I246 S247 L254 V275 I279 T308	I246-A249 WeakPolarHBondContact O-CB 3.34Å; I246-A249 PolarHBondContact O-N 3.49Å; S247-A249 VanDerWaalsContact C-N 3.32Å; A249-L254 HydrophobicContact CB-CD1 3.83Å; A249-V275 HydrophobicContact CB-CG1 3.83Å; A249-I279 HydrophobicContact CB-CD1 3.63Å; A249-I279 HydrophobicContact CB-CG1 3.72Å; A249-T308 HydrophobicContact CB-CG2 4.07Å; A249-T308 VanDerWaalsContact O-CA 3.31Å; A249-T308 WeakPolarHBondContact O-CA 3.37Å
250	K	82.1	Confident	76.4	Confident	90 Å²	90	60.5 Å²	60.5	39%	0.391	32%	0.316	S	S	.	.			trans	-70.6	132.5	-176.6	-66.4	162.9	-171.3	159.1	0	110.6	L248 S252 V253 L254 K307	L248-K250 PolarHBondContact O-N 2.91Å; K250-S252 VanDerWaalsContact C-N 3.25Å; K250-S252 PolarHBondContact O-N 3.39Å; K250-S252 VanDerWaalsContact O-N 3.09Å; K250-V253 HydrophobicContact CB-CG2 4.04Å; K250-V253 PolarHBondContact O-N 3.25Å; K250-L254 PolarHBondContact O-N 3.04Å; K250-K307 WeakPolarHBondContact CA-O 3.45Å; K250-K307 HydrophobicContact CG-CB 4.29Å
251	R	73.4	Confident	74.3	Confident	81 Å²	81	62.8 Å²	62.8	31%	0.306	34%	0.338	S	S	.	.	H	α-helix	trans	-49.1	-41.9	-174.8	-64.6	-165.3	-66.1	-78.3	4	113.6	D197 V253 N255 S306 K307 T308	D197-R251 VanDerWaalsContact OD1-CD 3.28Å; D197-R251 WeakPolarHBondContact OD1-CD 3.17Å; D197-R251 IonicContact OD1-CZ 3.62Å; D197-R251 IonicContact OD1-NE 3.74Å; D197-R251 PolarHBondContact OD1-NE 3.47Å; D197-R251 IonicContact OD2-CZ 2.74Å; D197-R251 IonicContact OD2-NE 3.65Å; D197-R251 PolarHBondContact OD2-NE 3.08Å; D197-R251 IonicContact OD2-NH2 3.37Å; R251-V253 PolarHBondContact O-N 3.07Å; R251-N255 VanDerWaalsContact O-CB 3.25Å; R251-N255 WeakPolarHBondContact O-CB 3.19Å; R251-N255 PolarHBondContact O-N 3.16Å; R251-S306 PolarHBondContact NH1-O 3.22Å; R251-S306 VanDerWaalsContact NH1-O 3.07Å; R251-K307 WeakPolarHBondContact CG-O 3.44Å; R251-K307 PolarHBondContact N-O 3.47Å; R251-T308 WeakPolarHBondContact CD-O 3.38Å; R251-T308 PolarHBondContact NH1-O 2.62Å
252	S	61.4	Low	72.2	Confident	68 Å²	68	63.9 Å²	63.9	48%	0.476	35%	0.352	S	S	.	.	H	α-helix	trans	-69.6	-28	178.8	52.3	0	0	0	0	115.1	K250	K250-S252 VanDerWaalsContact C-N 3.25Å; K250-S252 PolarHBondContact O-N 3.39Å; K250-S252 VanDerWaalsContact O-N 3.09Å
253	V	61.7	Low	70.2	Confident	27 Å²	27	70.1 Å²	70.1	16%	0.164	39%	0.385	C	S	.	.	H	α-helix	trans	-81.8	-44.3	-179.2	-174.7	0	0	0	0	110.3	K250 R251 N256 H260 L272	K250-V253 HydrophobicContact CB-CG2 4.04Å; K250-V253 PolarHBondContact O-N 3.25Å; R251-V253 PolarHBondContact O-N 3.07Å; V253-N256 CarbonylContact O-C 3.55Å; V253-N256 PolarHBondContact O-N 3.07Å; V253-H260 HydrophobicContact CG1-CB 4.1Å; V253-L272 HydrophobicContact CG1-CD1 3.67Å
254	L	63.1	Low	68.4	Low	34 Å²	34	72.9 Å²	72.9	18%	0.178	39%	0.391	C	S	.	.	H	α-helix	trans	-69.8	-35.5	-179.9	-57.2	-171.5	0	0	0	112.7	A249 K250 N256 I279	A249-L254 HydrophobicContact CB-CD1 3.83Å; K250-L254 PolarHBondContact O-N 3.04Å; L254-N256 PolarHBondContact O-N 3.38Å; L254-I279 HydrophobicContact CD1-CG1 4.48Å
255	N	65.8	Low	66.4	Low	144 Å²	144	84.9 Å²	84.9	77%	0.77	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-13.5	178.8	-169.1	52.6	0	0	0	113.7	R251	R251-N255 VanDerWaalsContact O-CB 3.25Å; R251-N255 WeakPolarHBondContact O-CB 3.19Å; R251-N255 PolarHBondContact O-N 3.16Å
256	N	62.2	Low	64.6	Low	53 Å²	53	87.1 Å²	87.1	28%	0.283	46%	0.455	S	S	.	.			trans	-158.1	69	-178.3	-172.8	56.3	0	0	0	112.9	V253 L254 S258 K259	V253-N256 CarbonylContact O-C 3.55Å; V253-N256 PolarHBondContact O-N 3.07Å; L254-N256 PolarHBondContact O-N 3.38Å; N256-S258 VanDerWaalsContact C-N 3.26Å; N256-S258 PolarHBondContact O-N 3.18Å; N256-S258 PolarHBondContact OD1-OG 2.84Å; N256-K259 WeakPolarHBondContact ND2-CB 3.02Å; N256-K259 VanDerWaalsContact ND2-CD 3.26Å; N256-K259 WeakPolarHBondContact ND2-CD 3.29Å; N256-K259 WeakPolarHBondContact ND2-CG 3.37Å; N256-K259 PolarHBondContact O-N 2.9Å
257	P	58.9	Low	62.5	Low	75 Å²	75	95.2 Å²	95.2	49%	0.487	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-61.7	-31.3	-172.8	23.5	-34.2	0	0	0	113.5	K259 H260 A261	P257-K259 VanDerWaalsContact C-N 3.25Å; P257-K259 PolarHBondContact O-N 2.95Å; P257-K259 VanDerWaalsContact O-N 3.16Å; P257-H260 PolarHBondContact O-N 3.27Å; P257-A261 PolarHBondContact O-N 2.93Å
258	S	58.9	Low	61	Low	97 Å²	97	97.7 Å²	97.7	68%	0.678	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-60.2	-25.2	-176.4	59.6	0	0	0	0	115.1	N256	N256-S258 VanDerWaalsContact C-N 3.26Å; N256-S258 PolarHBondContact O-N 3.18Å; N256-S258 PolarHBondContact OD1-OG 2.84Å
259	K	56.5	Low	59.8	Low	158 Å²	158	107.4 Å²	107.4	69%	0.687	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-93.1	-6.9	176.4	-66.7	-174.9	-166.6	172.8	0	114.1	N256 P257	N256-K259 WeakPolarHBondContact ND2-CB 3.02Å; N256-K259 VanDerWaalsContact ND2-CD 3.26Å; N256-K259 WeakPolarHBondContact ND2-CD 3.29Å; N256-K259 WeakPolarHBondContact ND2-CG 3.37Å; N256-K259 PolarHBondContact O-N 2.9Å; P257-K259 VanDerWaalsContact C-N 3.25Å; P257-K259 PolarHBondContact O-N 2.95Å; P257-K259 VanDerWaalsContact O-N 3.16Å
260	H	56.6	Low	59.3	Low	78 Å²	78	107.8 Å²	107.8	36%	0.361	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-6.6	-172.5	-69.6	-57.8	0	0	0	115.1	V253 P257 I262 I263	V253-H260 HydrophobicContact CG1-CB 4.1Å; P257-H260 PolarHBondContact O-N 3.27Å; H260-I262 PolarHBondContact O-N 2.99Å; H260-I263 PolarHBondContact O-N 3.37Å
261	A	51.9	Low	59.3	Low	73 Å²	73	105.9 Å²	105.9	60%	0.603	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	3.1	174.8	0	0	0	0	0	116.2	P257	P257-A261 PolarHBondContact O-N 2.93Å
262	I	50.4	Low	59.8	Low	161 Å²	161	105 Å²	105	83%	0.826	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-11.7	-178	-66.5	175.3	0	0	0	112.3	H260 E264	H260-I262 PolarHBondContact O-N 2.99Å; I262-E264 VanDerWaalsContact C-N 3.35Å; I262-E264 PolarHBondContact O-N 3.15Å
263	I	53.4	Low	61	Low	132 Å²	132	105.1 Å²	105.1	68%	0.677	55%	0.553	S	S	*	*			trans	-98.7	35.7	-176	-41.1	-174.7	0	0	0	111.9	H260 R265	H260-I263 PolarHBondContact O-N 3.37Å; I263-R265 PolarHBondContact O-N 3.07Å
264	E	50.5	Low	62.4	Low	146 Å²	146	108.3 Å²	108.3	68%	0.682	57%	0.565	S	S	*	*			trans	-100.7	76.8	176.2	-65.4	-161.5	157.4	0	0	112.2	I262	I262-E264 VanDerWaalsContact C-N 3.35Å; I262-E264 PolarHBondContact O-N 3.15Å
265	R	48.8	Very low	63.7	Low	255 Å²	255	106.7 Å²	106.7	96%	0.962	56%	0.557	S	S	*	*			trans	-127.7	6.1	156.6	-73.5	-169.4	-178.7	140.1	1.6	113.1	I263	I263-R265 PolarHBondContact O-N 3.07Å
266	S	51.2	Low	64.8	Low	87 Å²	87	102.4 Å²	102.4	61%	0.608	53%	0.532	S	S	*	.	S	Bend	trans	-84.6	124.2	172.9	-64.5	0	0	0	0	109.6	T268	S266-T268 PolarHBondContact O-N 3.44Å
267	N	47.4	Very low	66.2	Low	170 Å²	170	103.2 Å²	103.2	91%	0.909	54%	0.543	S	S	*	.			trans	-76	67.2	176.2	-172.6	11.3	0	0	0	110.6
268	T	58	Low	67.9	Low	73 Å²	73	101.2 Å²	101.2	45%	0.448	53%	0.526	S	S	.	.			trans	-82	136.2	176.6	43.9	0	0	0	0	110.5	L248 S266 S270	L248-T268 HydrophobicContact CD1-CG2 4.18Å; S266-T268 PolarHBondContact O-N 3.44Å; T268-S270 PolarHBondContact O-N 3.45Å; T268-S270 PolarHBondContact OG1-O 2.93Å
269	R	61.1	Low	69.5	Low	253 Å²	253	96.8 Å²	96.8	96%	0.955	50%	0.495	S	S	*	.	S	Bend	trans	-67.9	-0.9	-178.7	-88.2	-177.6	163	-164.5	-5.2	115.5
270	S	71.2	Confident	71.3	Confident	9 Å²	9	94.6 Å²	94.6	6%	0.063	49%	0.487	C	S	.	.	S	Bend	trans	-137.1	135.7	-178.5	-47	0	0	0	0	108.6	A244 D245 T268 E274	A244-S270 WeakPolarHBondContact CA-OG 3.36Å; D245-S270 PolarHBondContact N-OG 3.32Å; T268-S270 PolarHBondContact O-N 3.45Å; T268-S270 PolarHBondContact OG1-O 2.93Å; S270-E274 WeakPolarHBondContact CA-OE2 3.45Å
271	S	82.9	Confident	73.1	Confident	49 Å²	49	94.3 Å²	94.3	34%	0.343	48%	0.483	S	S	.	.			trans	-72.5	157.4	168.5	69	0	0	0	0	111	A273 E274 V275	S271-A273 PolarHBondContact O-N 2.94Å; S271-E274 WeakPolarHBondContact CB-OE1 3.4Å; S271-E274 PolarHBondContact N-OE1 2.94Å; S271-E274 PolarHBondContact N-OE2 3.27Å; S271-E274 PolarHBondContact O-N 3.48Å; S271-E274 VanDerWaalsContact OG-CD 3.23Å; S271-E274 WeakPolarHBondContact OG-CG 3.42Å; S271-E274 PolarHBondContact OG-N 3.41Å; S271-E274 PolarHBondContact OG-OE1 3.14Å; S271-V275 PolarHBondContact O-N 3.18Å; S271-V275 VanDerWaalsContact O-N 3.14Å
272	L	84.6	Confident	75.2	Confident	62 Å²	62	90.9 Å²	90.9	33%	0.325	46%	0.455	S	S	.	.	H	α-helix	trans	-64	-26.7	174.9	-170.3	137	0	0	0	112.2	V253 Q276	V253-L272 HydrophobicContact CG1-CD1 3.67Å; L272-Q276 WeakPolarHBondContact O-CB 3.36Å; L272-Q276 PolarHBondContact O-N 3.29Å
273	A	86.4	Confident	77.4	Confident	72 Å²	72	85.9 Å²	85.9	60%	0.595	43%	0.427	S	S	*	.	H	α-helix	trans	-69.8	-42.1	174.8	0	0	0	0	0	112.6	S271 V275 Q276 S277	S271-A273 PolarHBondContact O-N 2.94Å; A273-V275 VanDerWaalsContact C-N 3.35Å; A273-Q276 PolarHBondContact O-N 3.42Å; A273-S277 WeakPolarHBondContact O-CB 3.39Å; A273-S277 PolarHBondContact O-N 2.58Å
274	E	89.6	Confident	79.4	Confident	93 Å²	93	84.3 Å²	84.3	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-60	-45.7	171.3	-72.3	149.8	-117.8	0	0	111.2	A244 S270 S271 Q276 S277 E278	A244-E274 HydrophobicContact CB-CB 4.43Å; S270-E274 WeakPolarHBondContact CA-OE2 3.45Å; S271-E274 WeakPolarHBondContact CB-OE1 3.4Å; S271-E274 PolarHBondContact N-OE1 2.94Å; S271-E274 PolarHBondContact N-OE2 3.27Å; S271-E274 PolarHBondContact O-N 3.48Å; S271-E274 VanDerWaalsContact OG-CD 3.23Å; S271-E274 WeakPolarHBondContact OG-CG 3.42Å; S271-E274 PolarHBondContact OG-N 3.41Å; S271-E274 PolarHBondContact OG-OE1 3.14Å; E274-Q276 PolarHBondContact O-N 3.03Å; E274-S277 PolarHBondContact O-N 3.06Å; E274-E278 WeakPolarHBondContact O-CG 3.23Å; E274-E278 PolarHBondContact O-N 2.91Å
275	V	90.8	Very high	81.5	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.006	40%	0.396	C	S	.	.	H	α-helix	trans	-61.7	-44.2	178.9	171.8	0	0	0	0	111	A244 L248 A249 S271 A273 E278 I279	A244-V275 HydrophobicContact CB-CG2 4.14Å; L248-V275 HydrophobicContact CB-CG1 4.45Å; A249-V275 HydrophobicContact CB-CG1 3.83Å; S271-V275 PolarHBondContact O-N 3.18Å; S271-V275 VanDerWaalsContact O-N 3.14Å; A273-V275 VanDerWaalsContact C-N 3.35Å; V275-E278 PolarHBondContact O-N 3.07Å; V275-I279 VanDerWaalsContact O-CG1 3.27Å; V275-I279 WeakPolarHBondContact O-CG1 3.21Å; V275-I279 PolarHBondContact O-N 2.87Å; V275-I279 VanDerWaalsContact O-N 3.07Å
276	Q	90.1	Very high	83.8	Confident	53 Å²	53	67.5 Å²	67.5	25%	0.248	35%	0.351	C	S	.	.	H	α-helix	trans	-62.8	-45	176	178.5	60.9	18	0	0	112.1	L272 A273 E274 E278 I279 E280	L272-Q276 WeakPolarHBondContact O-CB 3.36Å; L272-Q276 PolarHBondContact O-N 3.29Å; A273-Q276 PolarHBondContact O-N 3.42Å; E274-Q276 PolarHBondContact O-N 3.03Å; Q276-E278 VanDerWaalsContact C-N 3.35Å; Q276-E278 PolarHBondContact O-N 2.97Å; Q276-I279 PolarHBondContact O-N 2.86Å; Q276-I279 VanDerWaalsContact O-N 3.15Å; Q276-E280 WeakPolarHBondContact CG-OE1 3.23Å; Q276-E280 PolarHBondContact NE2-OE1 2.99Å; Q276-E280 PolarHBondContact O-N 2.86Å
277	S	91.8	Very high	85.8	Confident	71 Å²	71	70 Å²	70	50%	0.497	35%	0.346	S	S	.	.	H	α-helix	trans	-60.5	-42	178	-174.5	0	0	0	0	112.1	A273 E274 I279 E280 R281	A273-S277 WeakPolarHBondContact O-CB 3.39Å; A273-S277 PolarHBondContact O-N 2.58Å; E274-S277 PolarHBondContact O-N 3.06Å; S277-I279 PolarHBondContact O-N 2.98Å; S277-E280 PolarHBondContact O-N 2.91Å; S277-R281 VanDerWaalsContact O-CB 3.29Å; S277-R281 WeakPolarHBondContact O-CB 3.41Å; S277-R281 PolarHBondContact O-N 2.88Å
278	E	93.8	Very high	87.9	Confident	32 Å²	32	65.2 Å²	65.2	15%	0.15	32%	0.324	C	S	.	.	H	α-helix	trans	-64.3	-38	174.4	-74.7	-69.9	94.2	0	0	112.3	A244 I246 E274 V275 Q276 R281 I282	A244-E278 HydrophobicContact CB-CG 3.95Å; I246-E278 HydrophobicContact CG2-CB 4.29Å; E274-E278 WeakPolarHBondContact O-CG 3.23Å; E274-E278 PolarHBondContact O-N 2.91Å; V275-E278 PolarHBondContact O-N 3.07Å; Q276-E278 VanDerWaalsContact C-N 3.35Å; Q276-E278 PolarHBondContact O-N 2.97Å; E278-R281 VanDerWaalsContact CD-NH2 3.3Å; E278-R281 PolarHBondContact O-N 2.96Å; E278-R281 IonicContact OE1-CZ 3.63Å; E278-R281 IonicContact OE1-NE 3.43Å; E278-R281 PolarHBondContact OE1-NE 3.21Å; E278-R281 IonicContact OE1-NH2 3.6Å; E278-R281 PolarHBondContact OE1-NH2 3.48Å; E278-R281 VanDerWaalsContact OE1-NH2 3.16Å; E278-R281 IonicContact OE2-CZ 2.64Å; E278-R281 IonicContact OE2-NE 3.51Å; E278-R281 IonicContact OE2-NH2 2.67Å; E278-R281 PolarHBondContact OE2-NH2 2.7Å; E278-I282 WeakPolarHBondContact O-CD1 3.17Å; E278-I282 WeakPolarHBondContact O-CG1 3.47Å; E278-I282 PolarHBondContact O-N 2.81Å
279	I	93.1	Very high	89.7	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-64	-49.2	174.2	-65.1	-68.3	0	0	0	110.8	I246 A249 L254 V275 Q276 S277 R281 I282 F283 L310	I246-I279 HydrophobicContact CB-CD1 4.41Å; I246-I279 HydrophobicContact CG2-CD1 4.29Å; A249-I279 HydrophobicContact CB-CD1 3.63Å; A249-I279 HydrophobicContact CB-CG1 3.72Å; L254-I279 HydrophobicContact CD1-CG1 4.48Å; V275-I279 VanDerWaalsContact O-CG1 3.27Å; V275-I279 WeakPolarHBondContact O-CG1 3.21Å; V275-I279 PolarHBondContact O-N 2.87Å; V275-I279 VanDerWaalsContact O-N 3.07Å; Q276-I279 PolarHBondContact O-N 2.86Å; Q276-I279 VanDerWaalsContact O-N 3.15Å; S277-I279 PolarHBondContact O-N 2.98Å; I279-R281 VanDerWaalsContact C-N 3.29Å; I279-R281 PolarHBondContact O-N 2.89Å; I279-I282 PolarHBondContact O-N 2.96Å; I279-I282 VanDerWaalsContact O-N 3.13Å; I279-F283 HydrophobicContact CG2-CD2 3.92Å; I279-F283 HydrophobicContact CG2-CE2 3.95Å; I279-F283 WeakPolarHBondContact O-CD2 3.34Å; I279-F283 PolarHBondContact O-N 3.36Å; I279-L310 HydrophobicContact CD1-CD1 3.67Å; I279-L310 HydrophobicContact CD1-CD2 3.69Å; I279-L310 HydrophobicContact CD1-CG 3.64Å; I279-L310 HydrophobicContact CG2-CD2 4.41Å
280	E	93.8	Very high	91.3	Very high	112 Å²	112	54.6 Å²	54.6	52%	0.523	28%	0.281	S	S	.	.	H	α-helix	trans	-58.7	-41.7	177.8	-72.2	173.8	-170	0	0	111.6	Q276 S277 I282 F283 E284	Q276-E280 WeakPolarHBondContact CG-OE1 3.23Å; Q276-E280 PolarHBondContact NE2-OE1 2.99Å; Q276-E280 PolarHBondContact O-N 2.86Å; S277-E280 PolarHBondContact O-N 2.91Å; E280-I282 PolarHBondContact O-N 3.25Å; E280-F283 PolarHBondContact O-N 3.47Å; E280-E284 PolarHBondContact O-N 2.87Å
281	R	95.3	Very high	92.5	Very high	73 Å²	73	54.3 Å²	54.3	28%	0.275	28%	0.278	S	S	.	.	H	α-helix	trans	-62.6	-39	174.9	-169.6	-179.4	66	77.5	-10.2	112.9	T240 R241 S277 E278 I279 E284 L285	T240-R281 PolarHBondContact OG1-NH1 2.88Å; T240-R281 PolarHBondContact OG1-NH2 3.18Å; R241-R281 PolarHBondContact O-NH2 2.68Å; S277-R281 VanDerWaalsContact O-CB 3.29Å; S277-R281 WeakPolarHBondContact O-CB 3.41Å; S277-R281 PolarHBondContact O-N 2.88Å; E278-R281 VanDerWaalsContact CD-NH2 3.3Å; E278-R281 PolarHBondContact O-N 2.96Å; E278-R281 IonicContact OE1-CZ 3.63Å; E278-R281 IonicContact OE1-NE 3.43Å; E278-R281 PolarHBondContact OE1-NE 3.21Å; E278-R281 IonicContact OE1-NH2 3.6Å; E278-R281 PolarHBondContact OE1-NH2 3.48Å; E278-R281 VanDerWaalsContact OE1-NH2 3.16Å; E278-R281 IonicContact OE2-CZ 2.64Å; E278-R281 IonicContact OE2-NE 3.51Å; E278-R281 IonicContact OE2-NH2 2.67Å; E278-R281 PolarHBondContact OE2-NH2 2.7Å; I279-R281 VanDerWaalsContact C-N 3.29Å; I279-R281 PolarHBondContact O-N 2.89Å; R281-E284 PolarHBondContact O-N 2.86Å; R281-L285 WeakPolarHBondContact O-CG 3.48Å; R281-L285 PolarHBondContact O-N 2.61Å
282	I	95.9	Very high	93.3	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.8	-41.1	175.3	-67.8	160.2	0	0	0	110.9	P204 E278 I279 E280 A286 L294 L310	P204-I282 HydrophobicContact CB-CG2 4.14Å; P204-I282 HydrophobicContact CG-CG2 4.07Å; E278-I282 WeakPolarHBondContact O-CD1 3.17Å; E278-I282 WeakPolarHBondContact O-CG1 3.47Å; E278-I282 PolarHBondContact O-N 2.81Å; I279-I282 PolarHBondContact O-N 2.96Å; I279-I282 VanDerWaalsContact O-N 3.13Å; E280-I282 PolarHBondContact O-N 3.25Å; I282-A286 WeakPolarHBondContact O-CB 3.31Å; I282-A286 PolarHBondContact O-N 2.86Å; I282-A286 VanDerWaalsContact O-N 3.11Å; I282-L294 HydrophobicContact CD1-CD1 3.77Å; I282-L294 HydrophobicContact CD1-CD2 4.07Å; I282-L294 HydrophobicContact CG1-CD1 4.4Å; I282-L294 HydrophobicContact CG1-CD2 3.89Å; I282-L310 HydrophobicContact CB-CD2 4.24Å; I282-L310 HydrophobicContact CD1-CD1 4.26Å; I282-L310 HydrophobicContact CD1-CD2 4.34Å; I282-L310 HydrophobicContact CG2-CD2 3.77Å
283	F	95.8	Very high	93.9	Very high	57 Å²	57	49 Å²	49	25%	0.25	25%	0.247	C	C	.	.	H	α-helix	trans	-61.5	-43.4	174.6	-93.2	-99.5	0	0	0	112.1	V198 P200 I279 E280 A286 R287 L310	V198-F283 HydrophobicContact CG1-CE1 4.25Å; P200-F283 HydrophobicContact CB-CD1 4.49Å; P200-F283 HydrophobicContact CG-CD1 4.29Å; P200-F283 HydrophobicContact CG-CD2 3.87Å; P200-F283 HydrophobicContact CG-CE1 4.16Å; P200-F283 HydrophobicContact CG-CE2 3.73Å; P200-F283 HydrophobicContact CG-CG 4.16Å; P200-F283 HydrophobicContact CG-CZ 3.89Å; I279-F283 HydrophobicContact CG2-CD2 3.92Å; I279-F283 HydrophobicContact CG2-CE2 3.95Å; I279-F283 WeakPolarHBondContact O-CD2 3.34Å; I279-F283 PolarHBondContact O-N 3.36Å; E280-F283 PolarHBondContact O-N 3.47Å; F283-A286 PolarHBondContact O-N 2.69Å; F283-R287 PolarHBondContact O-N 3.1Å; F283-L310 HydrophobicContact CD2-CD2 4.48Å; F283-L310 HydrophobicContact CE2-CD2 4.28Å
284	E	95.5	Very high	94.4	Very high	99 Å²	99	45.6 Å²	45.6	46%	0.463	22%	0.218	S	C	.	.	H	α-helix	trans	-68.2	-39.6	179.4	176.8	54.5	-160.8	0	0	112.8	E280 R281 A286 R287	E280-E284 PolarHBondContact O-N 2.87Å; R281-E284 PolarHBondContact O-N 2.86Å; E284-A286 VanDerWaalsContact C-N 3.33Å; E284-A286 PolarHBondContact O-N 2.98Å; E284-R287 VanDerWaalsContact CD-NE 3.29Å; E284-R287 VanDerWaalsContact O-CB 3.29Å; E284-R287 WeakPolarHBondContact O-CB 3.42Å; E284-R287 PolarHBondContact O-N 3.04Å; E284-R287 IonicContact OE1-CZ 2.94Å; E284-R287 VanDerWaalsContact OE1-CZ 3.3Å; E284-R287 IonicContact OE1-NE 2.74Å; E284-R287 PolarHBondContact OE1-NE 2.95Å; E284-R287 VanDerWaalsContact OE1-NE 3.11Å; E284-R287 IonicContact OE1-NH2 3.74Å; E284-R287 PolarHBondContact OE1-NH2 2.8Å; E284-R287 WeakPolarHBondContact OE2-CD 3.49Å; E284-R287 IonicContact OE2-CZ 3.93Å; E284-R287 IonicContact OE2-NE 3.19Å; E284-R287 PolarHBondContact OE2-NE 2.88Å; E284-R287 IonicContact OE2-NH2 2.74Å
285	L	95.4	Very high	94.7	Very high	48 Å²	48	43.3 Å²	43.3	25%	0.251	21%	0.209	S	C	.	.	H	α-helix	trans	-58.3	-47.1	171.5	-72.8	174.6	0	0	0	111.2	T240 R281 R287 T288 V292	T240-L285 HydrophobicContact CG2-CD1 3.99Å; R281-L285 WeakPolarHBondContact O-CG 3.48Å; R281-L285 PolarHBondContact O-N 2.61Å; L285-R287 VanDerWaalsContact C-N 3.26Å; L285-R287 PolarHBondContact O-N 3.07Å; L285-T288 PolarHBondContact O-N 2.84Å; L285-T288 PolarHBondContact O-OG1 3.3Å; L285-V292 HydrophobicContact CB-CG1 4.43Å; L285-V292 HydrophobicContact CB-CG2 3.85Å; L285-V292 HydrophobicContact CD1-CG1 4.41Å
286	A	95.9	Very high	94.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67	-22.8	-178.7	0	0	0	0	0	114	P200 M202 I282 F283 E284 T288 L289 V292	P200-A286 HydrophobicContact CB-CB 3.6Å; M202-A286 HydrophobicContact CB-CB 4.23Å; M202-A286 WeakPolarHBondContact O-CB 3.39Å; I282-A286 WeakPolarHBondContact O-CB 3.31Å; I282-A286 PolarHBondContact O-N 2.86Å; I282-A286 VanDerWaalsContact O-N 3.11Å; F283-A286 PolarHBondContact O-N 2.69Å; E284-A286 VanDerWaalsContact C-N 3.33Å; E284-A286 PolarHBondContact O-N 2.98Å; A286-T288 PolarHBondContact O-N 2.72Å; A286-L289 PolarHBondContact O-N 3.4Å; A286-L289 VanDerWaalsContact O-N 3.14Å; A286-V292 HydrophobicContact CB-CG2 4.06Å
287	R	93.6	Very high	94.8	Very high	138 Å²	138	43.8 Å²	43.8	52%	0.521	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.5	177.1	-168.9	-173.4	57	65	2	113	F283 E284 L285 L289	F283-R287 PolarHBondContact O-N 3.1Å; E284-R287 VanDerWaalsContact CD-NE 3.29Å; E284-R287 VanDerWaalsContact O-CB 3.29Å; E284-R287 WeakPolarHBondContact O-CB 3.42Å; E284-R287 PolarHBondContact O-N 3.04Å; E284-R287 IonicContact OE1-CZ 2.94Å; E284-R287 VanDerWaalsContact OE1-CZ 3.3Å; E284-R287 IonicContact OE1-NE 2.74Å; E284-R287 PolarHBondContact OE1-NE 2.95Å; E284-R287 VanDerWaalsContact OE1-NE 3.11Å; E284-R287 IonicContact OE1-NH2 3.74Å; E284-R287 PolarHBondContact OE1-NH2 2.8Å; E284-R287 WeakPolarHBondContact OE2-CD 3.49Å; E284-R287 IonicContact OE2-CZ 3.93Å; E284-R287 IonicContact OE2-NE 3.19Å; E284-R287 PolarHBondContact OE2-NE 2.88Å; E284-R287 IonicContact OE2-NH2 2.74Å; L285-R287 VanDerWaalsContact C-N 3.26Å; L285-R287 PolarHBondContact O-N 3.07Å; R287-L289 PolarHBondContact O-N 2.68Å
288	T	92.2	Very high	94.8	Very high	70 Å²	70	42.4 Å²	42.4	43%	0.429	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-7.5	179.7	64.8	0	0	0	0	114.5	L285 A286 Q290	L285-T288 PolarHBondContact O-N 2.84Å; L285-T288 PolarHBondContact O-OG1 3.3Å; A286-T288 PolarHBondContact O-N 2.72Å; T288-Q290 PolarHBondContact O-N 2.72Å; T288-Q290 WeakPolarHBondContact OG1-CB 3.49Å; T288-Q290 PolarHBondContact OG1-N 2.95Å
289	L	94.3	Very high	94.8	Very high	32 Å²	32	40.9 Å²	40.9	17%	0.168	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	13.5	-166.8	-56.9	-177.9	0	0	0	115.8	V60 M202 A286 R287 W382 H386	V60-L289 HydrophobicContact CG2-CD1 4.16Å; V60-L289 HydrophobicContact CG2-CD2 4.44Å; M202-L289 WeakPolarHBondContact CE-O 3.28Å; M202-L289 VanDerWaalsContact CG-CA 3.46Å; M202-L289 HydrophobicContact CG-CB 4.29Å; M202-L289 HydrophobicContact CG-CD2 4.02Å; M202-L289 HydrophobicContact SD-CB 4.3Å; M202-L289 HydrophobicContact SD-CD2 4.01Å; A286-L289 PolarHBondContact O-N 3.4Å; A286-L289 VanDerWaalsContact O-N 3.14Å; R287-L289 PolarHBondContact O-N 2.68Å; L289-W382 WeakPolarHBondContact O-CZ3 3.22Å; L289-H386 PolarHBondContact O-CE1 3.4Å; L289-H386 PolarHBondContact O-NE2 3.31Å
290	Q	95.4	Very high	94.9	Very high	72 Å²	72	42.2 Å²	42.2	34%	0.336	20%	0.202	S	C	.	.			trans	-73.7	153.3	168	-68.1	-176.5	-29.5	0	0	112.4	M202 G235 R236 T288 V292	M202-Q290 WeakPolarHBondContact CB-O 3.45Å; M202-Q290 WeakPolarHBondContact CG-O 3.3Å; G235-Q290 PolarHBondContact O-NE2 2.64Å; R236-Q290 WeakPolarHBondContact O-CB 3.37Å; T288-Q290 PolarHBondContact O-N 2.72Å; T288-Q290 WeakPolarHBondContact OG1-CB 3.49Å; T288-Q290 PolarHBondContact OG1-N 2.95Å; Q290-V292 PolarHBondContact O-N 3.17Å
291	L	97.4	Very high	95	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	115.5	172.5	-67.7	173	0	0	0	109.5	M202 F233 R236 I237 S238 Y381 W382	M202-L291 HydrophobicContact CE-CD2 3.92Å; F233-L291 HydrophobicContact CB-CD1 4.23Å; F233-L291 HydrophobicContact CD1-CD1 3.47Å; F233-L291 VanDerWaalsContact CD1-CD1 3.47Å; F233-L291 HydrophobicContact CE1-CD1 3.89Å; F233-L291 HydrophobicContact CG-CD1 3.84Å; R236-L291 PolarHBondContact O-N 2.93Å; I237-L291 CarbonylContact C-O 3.56Å; I237-L291 WeakPolarHBondContact CA-O 3.46Å; I237-L291 HydrophobicContact CB-CB 4.41Å; I237-L291 HydrophobicContact CG1-CB 4.15Å; S238-L291 PolarHBondContact N-O 3.19Å; L291-Y381 HydrophobicContact CD2-CD1 4.09Å; L291-Y381 HydrophobicContact CD2-CE1 4.49Å; L291-W382 HydrophobicContact CD1-CE3 4.31Å; L291-W382 HydrophobicContact CD2-CE3 4.14Å; L291-W382 HydrophobicContact CG-CE3 3.8Å; L291-W382 HydrophobicContact CG-CZ3 4.07Å
292	V	97.8	Very high	95	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.1	175.4	-176.5	0	0	0	0	109.3	P204 V205 L285 A286 Q290 L294	P204-V292 CarbonylContact C-O 3.59Å; P204-V292 WeakPolarHBondContact CA-O 3.49Å; P204-V292 HydrophobicContact CB-CB 4.43Å; P204-V292 HydrophobicContact CB-CG1 4.26Å; V205-V292 PolarHBondContact N-O 3.34Å; L285-V292 HydrophobicContact CB-CG1 4.43Å; L285-V292 HydrophobicContact CB-CG2 3.85Å; L285-V292 HydrophobicContact CD1-CG1 4.41Å; A286-V292 HydrophobicContact CB-CG2 4.06Å; Q290-V292 PolarHBondContact O-N 3.17Å; V292-L294 HydrophobicContact CG1-CD2 3.87Å
293	V	98	Very high	94.9	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128.1	179.9	-178.4	0	0	0	0	109.9	V205 F226 I237 S238 I239 T240	V205-V293 HydrophobicContact CB-CB 4.49Å; V205-V293 HydrophobicContact CB-CG1 4.38Å; V205-V293 HydrophobicContact CB-CG2 4.04Å; V205-V293 HydrophobicContact CG2-CG2 4.17Å; F226-V293 HydrophobicContact CD1-CG1 3.81Å; F226-V293 HydrophobicContact CE1-CG1 3.57Å; I237-V293 HydrophobicContact CD1-CG2 3.77Å; I237-V293 HydrophobicContact CG1-CG2 3.93Å; S238-V293 PolarHBondContact O-N 2.75Å; I239-V293 WeakPolarHBondContact CA-O 3.1Å; I239-V293 HydrophobicContact CG1-CB 4.19Å; I239-V293 HydrophobicContact CG2-CB 4.44Å; I239-V293 HydrophobicContact CG2-CG1 4.44Å; T240-V293 PolarHBondContact N-O 2.88Å
294	L	97.3	Very high	94.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.3	-173.9	-49.5	-177.5	0	0	0	111.5	P204 V205 V206 T240 V242 I246 I282 V292 A296	P204-L294 HydrophobicContact CB-CD1 3.72Å; P204-L294 HydrophobicContact CB-CD2 4.32Å; P204-L294 HydrophobicContact CB-CG 3.83Å; P204-L294 HydrophobicContact CG-CD1 4.25Å; V205-L294 PolarHBondContact O-N 2.73Å; V206-L294 HydrophobicContact CG2-CB 4.31Å; V206-L294 HydrophobicContact CG2-CD1 4.17Å; V206-L294 HydrophobicContact CG2-CG 4.49Å; T240-L294 HydrophobicContact CG2-CD2 3.56Å; T240-L294 WeakPolarHBondContact O-CA 3.47Å; V242-L294 HydrophobicContact CG2-CB 4.28Å; V242-L294 HydrophobicContact CG2-CD2 4.1Å; I246-L294 HydrophobicContact CD1-CD1 4.2Å; I282-L294 HydrophobicContact CD1-CD1 3.77Å; I282-L294 HydrophobicContact CD1-CD2 4.07Å; I282-L294 HydrophobicContact CG1-CD1 4.4Å; I282-L294 HydrophobicContact CG1-CD2 3.89Å; V292-L294 HydrophobicContact CG1-CD2 3.87Å; L294-A296 PolarHBondContact O-N 2.94Å
295	D	96	Very high	94.7	Very high	45 Å²	45	34.1 Å²	34.1	24%	0.241	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	77.8	162.7	-178.8	34.5	0	0	0	109	F226 T240 R241 V242	F226-D295 HydrophobicContact CE2-CB 3.96Å; F226-D295 WeakPolarHBondContact CE2-OD1 3.25Å; F226-D295 HydrophobicContact CZ-CB 3.89Å; T240-D295 PolarHBondContact O-N 3.37Å; R241-D295 CarbonylContact C-O 3.57Å; R241-D295 WeakPolarHBondContact CA-O 3.45Å; R241-D295 HydrophobicContact CB-CB 4.37Å; R241-D295 HydrophobicContact CG-CB 4.32Å; R241-D295 WeakPolarHBondContact CG-O 3.45Å; R241-D295 IonicContact NE-OD2 3.96Å; V242-D295 PolarHBondContact N-O 2.98Å
296	A	93.4	Very high	94.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116	-178.3	0	0	0	0	0	111.2	K213 V242 L294 T298 I299	K213-A296 VanDerWaalsContact CD-O 3.32Å; K213-A296 WeakPolarHBondContact CD-O 3.49Å; K213-A296 WeakPolarHBondContact CE-O 3.36Å; K213-A296 PolarHBondContact NZ-O 3.32Å; V242-A296 HydrophobicContact CB-CB 4.16Å; V242-A296 WeakPolarHBondContact O-CA 3.32Å; L294-A296 PolarHBondContact O-N 2.94Å; A296-T298 PolarHBondContact O-N 2.87Å; A296-I299 HydrophobicContact CB-CB 4.36Å; A296-I299 HydrophobicContact CB-CG1 3.95Å
297	D	89.6	Confident	94	Very high	63 Å²	63	41.4 Å²	41.4	34%	0.337	21%	0.214	S	C	.	.	S	Bend	trans	-65.6	-36.3	-175.9	-67.4	-28.2	0	0	0	112.8	R241 V242	R241-D297 IonicContact CZ-OD1 3.43Å; R241-D297 IonicContact CZ-OD2 3.69Å; R241-D297 IonicContact NE-OD1 2.75Å; R241-D297 IonicContact NH2-OD1 2.69Å; R241-D297 PolarHBondContact NH2-OD1 3.23Å; R241-D297 IonicContact NH2-OD2 3.72Å; R241-D297 PolarHBondContact NH2-OD2 3.31Å; V242-D297 PolarHBondContact O-N 3.15Å
298	T	90.8	Very high	93.9	Very high	42 Å²	42	34.9 Å²	34.9	26%	0.258	19%	0.19	S	C	.	.	S	Bend	trans	-86.2	-16.6	-169.8	70.5	0	0	0	0	114.3	D245 A296 N300 Q304	D245-T298 HydrophobicContact CB-CG2 4.07Å; D245-T298 PolarHBondContact OD1-OG1 2.86Å; A296-T298 PolarHBondContact O-N 2.87Å; T298-N300 VanDerWaalsContact C-ND2 3.33Å; T298-N300 PolarHBondContact O-N 2.92Å; T298-N300 PolarHBondContact O-ND2 2.83Å; T298-Q304 PolarHBondContact O-NE2 3.08Å
299	I	94.8	Very high	93.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.176	C	C	.	.			trans	-89.9	115.8	-170.7	-53.7	-56	0	0	0	110.7	V206 V208 K213 I246 A296 Q304 L305	V206-I299 HydrophobicContact CG1-CB 4.38Å; V206-I299 HydrophobicContact CG1-CG2 4Å; V208-I299 HydrophobicContact CG1-CG2 4.17Å; K213-I299 WeakPolarHBondContact CE-O 3.33Å; I246-I299 HydrophobicContact CD1-CG1 4.42Å; I246-I299 HydrophobicContact CG1-CD1 4.17Å; I246-I299 HydrophobicContact CG1-CG1 4.21Å; A296-I299 HydrophobicContact CB-CB 4.36Å; A296-I299 HydrophobicContact CB-CG1 3.95Å; I299-Q304 HydrophobicContact CD1-CB 4.14Å; I299-L305 HydrophobicContact CD1-CD2 3.71Å; I299-L305 HydrophobicContact CD1-CG 4.12Å; I299-L305 HydrophobicContact CG1-CD1 4.29Å; I299-L305 HydrophobicContact CG1-CD2 4.2Å; I299-L305 HydrophobicContact CG1-CG 4.38Å; I299-L305 HydrophobicContact CG2-CD1 3.89Å; I299-L305 HydrophobicContact CG2-CG 4.09Å
300	N	95.6	Very high	93.8	Very high	32 Å²	32	31 Å²	31	17%	0.171	17%	0.168	C	C	.	.			trans	-128.1	-5.9	-173.8	-70.7	-93.3	0	0	0	112.6	L212 K213 T298	L212-N300 VanDerWaalsContact CA-OD1 3.27Å; L212-N300 WeakPolarHBondContact CA-OD1 3.34Å; L212-N300 HydrophobicContact CD2-CB 4.08Å; K213-N300 PolarHBondContact N-OD1 2.92Å; T298-N300 VanDerWaalsContact C-ND2 3.33Å; T298-N300 PolarHBondContact O-N 2.92Å; T298-N300 PolarHBondContact O-ND2 2.83Å
301	H	95.8	Very high	93.8	Very high	59 Å²	59	28 Å²	28	27%	0.273	16%	0.156	S	C	.	.	S	Bend	trans	-156.6	135.2	-172.6	-173	-84.5	0	0	0	111.7	A303 Q304 C353	H301-A303 VanDerWaalsContact C-N 3.29Å; H301-A303 WeakPolarHBondContact ND1-CB 3.49Å; H301-A303 PolarHBondContact ND1-N 2.85Å; H301-A303 PolarHBondContact O-N 2.82Å; H301-Q304 WeakPolarHBondContact O-CB 3.44Å; H301-Q304 PolarHBondContact O-N 3Å; H301-C353 PolarHBondContact NE2-SG 3.39Å
302	P	95.5	Very high	93.8	Very high	7 Å²	7	28.3 Å²	28.3	5%	0.045	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-58.2	-36.5	-172.8	20.6	-33	0	0	0	113.8	Q304 L305 S306 I314 L357 F358	P302-Q304 PolarHBondContact O-N 2.89Å; P302-L305 PolarHBondContact O-N 3.09Å; P302-S306 PolarHBondContact O-N 2.78Å; P302-I314 HydrophobicContact CB-CG1 4.31Å; P302-I314 HydrophobicContact CB-CG2 4.32Å; P302-L357 HydrophobicContact CB-CB 4.15Å; P302-L357 WeakPolarHBondContact CB-O 3.29Å; P302-L357 HydrophobicContact CG-CB 3.9Å; P302-L357 HydrophobicContact CG-CD1 4.38Å; P302-F358 HydrophobicContact CB-CE1 4.47Å; P302-F358 HydrophobicContact CG-CD1 4.27Å; P302-F358 HydrophobicContact CG-CE1 3.69Å; P302-F358 HydrophobicContact CG-CZ 4.2Å
303	A	93.7	Very high	93.8	Very high	50 Å²	50	28.3 Å²	28.3	41%	0.413	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-65.4	-8	178.1	0	0	0	0	0	115.1	H301 S306	H301-A303 VanDerWaalsContact C-N 3.29Å; H301-A303 WeakPolarHBondContact ND1-CB 3.49Å; H301-A303 PolarHBondContact ND1-N 2.85Å; H301-A303 PolarHBondContact O-N 2.82Å; A303-S306 PolarHBondContact O-OG 2.88Å
304	Q	93.4	Very high	93.8	Very high	53 Å²	53	28.7 Å²	28.7	25%	0.248	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-69.7	-33	167.8	-73.3	176.1	-89.4	0	0	111.9	T298 I299 H301 P302	T298-Q304 PolarHBondContact O-NE2 3.08Å; I299-Q304 HydrophobicContact CD1-CB 4.14Å; H301-Q304 WeakPolarHBondContact O-CB 3.44Å; H301-Q304 PolarHBondContact O-N 3Å; P302-Q304 PolarHBondContact O-N 2.89Å
305	L	93.1	Very high	93.9	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.016	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-15	-174.8	-62.8	-176.5	0	0	0	114.1	V206 I246 I299 P302 K307 T308 P312 I314	V206-L305 HydrophobicContact CG1-CD1 4.26Å; V206-L305 HydrophobicContact CG2-CD1 4.01Å; I246-L305 HydrophobicContact CD1-CD2 4.05Å; I246-L305 HydrophobicContact CG1-CD2 4.06Å; I299-L305 HydrophobicContact CD1-CD2 3.71Å; I299-L305 HydrophobicContact CD1-CG 4.12Å; I299-L305 HydrophobicContact CG1-CD1 4.29Å; I299-L305 HydrophobicContact CG1-CD2 4.2Å; I299-L305 HydrophobicContact CG1-CG 4.38Å; I299-L305 HydrophobicContact CG2-CD1 3.89Å; I299-L305 HydrophobicContact CG2-CG 4.09Å; P302-L305 PolarHBondContact O-N 3.09Å; L305-K307 PolarHBondContact O-N 3.2Å; L305-K307 VanDerWaalsContact O-N 3.1Å; L305-T308 HydrophobicContact CD2-CG2 4.11Å; L305-T308 WeakPolarHBondContact O-CB 3.34Å; L305-T308 WeakPolarHBondContact O-CG2 3.36Å; L305-T308 PolarHBondContact O-N 2.88Å; L305-T308 PolarHBondContact O-OG1 2.83Å; L305-P312 HydrophobicContact CB-CG 4.01Å; L305-P312 HydrophobicContact CD1-CB 4.44Å; L305-P312 HydrophobicContact CD1-CG 3.83Å; L305-I314 HydrophobicContact CD1-CD1 4.29Å
306	S	89.5	Confident	94	Very high	61 Å²	61	27.1 Å²	27.1	43%	0.427	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-25	-178.6	64.9	0	0	0	0	114.8	R251 P302 A303	R251-S306 PolarHBondContact NH1-O 3.22Å; R251-S306 VanDerWaalsContact NH1-O 3.07Å; P302-S306 PolarHBondContact O-N 2.78Å; A303-S306 PolarHBondContact O-OG 2.88Å
307	K	87.7	Confident	94.2	Very high	139 Å²	139	27.6 Å²	27.6	60%	0.604	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	2	176.7	-62.1	-164.1	176.4	-166.8	0	114.5	K250 R251 L305	K250-K307 WeakPolarHBondContact CA-O 3.45Å; K250-K307 HydrophobicContact CG-CB 4.29Å; R251-K307 WeakPolarHBondContact CG-O 3.44Å; R251-K307 PolarHBondContact N-O 3.47Å; L305-K307 PolarHBondContact O-N 3.2Å; L305-K307 VanDerWaalsContact O-N 3.1Å
308	T	91.2	Very high	94.5	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	15%	0.151	C	C	.	.	S	Bend	trans	-89.2	175.5	175.7	72.9	0	0	0	0	112.1	I246 A249 R251 L305 L310	I246-T308 WeakPolarHBondContact O-CG2 3.49Å; A249-T308 HydrophobicContact CB-CG2 4.07Å; A249-T308 VanDerWaalsContact O-CA 3.31Å; A249-T308 WeakPolarHBondContact O-CA 3.37Å; R251-T308 WeakPolarHBondContact CD-O 3.38Å; R251-T308 PolarHBondContact NH1-O 2.62Å; L305-T308 HydrophobicContact CD2-CG2 4.11Å; L305-T308 WeakPolarHBondContact O-CB 3.34Å; L305-T308 WeakPolarHBondContact O-CG2 3.36Å; L305-T308 PolarHBondContact O-N 2.88Å; L305-T308 PolarHBondContact O-OG1 2.83Å; T308-L310 PolarHBondContact OG1-N 3.31Å
309	S	90.8	Very high	94.8	Very high	21 Å²	21	27.4 Å²	27.4	15%	0.147	15%	0.148	C	C	.	.	S	Bend	trans	-89.1	-4.2	167	46.8	0	0	0	0	113.6	V199 P200 A311	V199-S309 WeakPolarHBondContact CA-O 3.47Å; V199-S309 WeakPolarHBondContact CG1-O 3.28Å; P200-S309 WeakPolarHBondContact CD-O 3.49Å; S309-A311 VanDerWaalsContact C-N 3.34Å; S309-A311 PolarHBondContact O-N 2.98Å
310	L	94.1	Very high	94.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.			trans	-69.4	-28.3	-173.4	-68.3	-178.2	0	0	0	114.2	P200 P204 I246 I279 I282 F283 T308 P312	P200-L310 WeakPolarHBondContact CD-O 3.34Å; P200-L310 HydrophobicContact CG-CD2 4.08Å; P204-L310 WeakPolarHBondContact CD-O 3.29Å; P204-L310 HydrophobicContact CG-CB 4.19Å; I246-L310 HydrophobicContact CD1-CD1 3.94Å; I279-L310 HydrophobicContact CD1-CD1 3.67Å; I279-L310 HydrophobicContact CD1-CD2 3.69Å; I279-L310 HydrophobicContact CD1-CG 3.64Å; I279-L310 HydrophobicContact CG2-CD2 4.41Å; I282-L310 HydrophobicContact CB-CD2 4.24Å; I282-L310 HydrophobicContact CD1-CD1 4.26Å; I282-L310 HydrophobicContact CD1-CD2 4.34Å; I282-L310 HydrophobicContact CG2-CD2 3.77Å; F283-L310 HydrophobicContact CD2-CD2 4.48Å; F283-L310 HydrophobicContact CE2-CD2 4.28Å; T308-L310 PolarHBondContact OG1-N 3.31Å; L310-P312 VanDerWaalsContact C-N 3.29Å
311	A	95	Very high	94.6	Very high	8 Å²	8	31.5 Å²	31.5	7%	0.066	18%	0.179	C	C	.	.			trans	40.3	50.8	-174.4	0	0	0	0	0	114	F92 V199 R203 S309	F92-A311 HydrophobicContact CE1-CB 3.67Å; F92-A311 HydrophobicContact CZ-CB 3.96Å; V199-A311 HydrophobicContact CB-CB 4.23Å; V199-A311 HydrophobicContact CG1-CB 3.78Å; R203-A311 WeakPolarHBondContact CG-O 3.1Å; R203-A311 PolarHBondContact NE-O 3.41Å; S309-A311 VanDerWaalsContact C-N 3.34Å; S309-A311 PolarHBondContact O-N 2.98Å
312	P	96.9	Very high	94.6	Very high	10 Å²	10	32 Å²	32	7%	0.065	19%	0.187	C	C	.	.			trans	-61.2	159.8	-170.9	30.4	-40.4	0	0	0	113	R203 P204 V206 L305 L310 I314	R203-P312 PolarHBondContact NH2-O 3.02Å; P204-P312 HydrophobicContact CG-CB 4.2Å; P204-P312 CarbonylContact O-C 3.54Å; P204-P312 WeakPolarHBondContact O-CA 3.1Å; P204-P312 WeakPolarHBondContact O-CB 3.42Å; V206-P312 HydrophobicContact CG2-CB 3.77Å; L305-P312 HydrophobicContact CB-CG 4.01Å; L305-P312 HydrophobicContact CD1-CB 4.44Å; L305-P312 HydrophobicContact CD1-CG 3.83Å; L310-P312 VanDerWaalsContact C-N 3.29Å; P312-I314 HydrophobicContact CB-CD1 4.05Å; P312-I314 HydrophobicContact CG-CD1 3.52Å; P312-I314 HydrophobicContact CG-CG1 4.27Å
313	I	98.1	Very high	94.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	111	161.3	-69.8	162.4	0	0	0	107	R203 P204 V205 V206 V315 D359 Y377 L378 Y381	R203-I313 HydrophobicContact CB-CD1 3.93Å; R203-I313 HydrophobicContact CB-CG1 3.76Å; P204-I313 PolarHBondContact O-N 2.94Å; V205-I313 WeakPolarHBondContact CA-O 3.29Å; V205-I313 HydrophobicContact CG1-CG2 4.35Å; V205-I313 HydrophobicContact CG2-CB 4.32Å; V205-I313 HydrophobicContact CG2-CD1 4.3Å; V206-I313 PolarHBondContact N-O 3.35Å; I313-V315 HydrophobicContact CG2-CG2 4.08Å; I313-D359 WeakPolarHBondContact CA-OD2 3.22Å; I313-D359 HydrophobicContact CG2-CB 3.82Å; I313-Y377 HydrophobicContact CD1-CE1 4.36Å; I313-Y377 HydrophobicContact CG2-CE1 3.9Å; I313-L378 HydrophobicContact CD1-CD2 4.47Å; I313-Y381 HydrophobicContact CD1-CD1 3.63Å; I313-Y381 HydrophobicContact CD1-CD2 4.35Å; I313-Y381 HydrophobicContact CD1-CE1 3.68Å; I313-Y381 HydrophobicContact CD1-CE2 4.42Å; I313-Y381 HydrophobicContact CD1-CG 4Å
314	I	97.9	Very high	94.9	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.046	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	116.5	177.1	-52.7	-62.8	0	0	0	109.7	V206 V208 P302 L305 P312 F358 D359 V360	V206-I314 HydrophobicContact CB-CD1 4.2Å; V208-I314 HydrophobicContact CG1-CG2 4.43Å; V208-I314 HydrophobicContact CG2-CG2 3.62Å; P302-I314 HydrophobicContact CB-CG1 4.31Å; P302-I314 HydrophobicContact CB-CG2 4.32Å; L305-I314 HydrophobicContact CD1-CD1 4.29Å; P312-I314 HydrophobicContact CB-CD1 4.05Å; P312-I314 HydrophobicContact CG-CD1 3.52Å; P312-I314 HydrophobicContact CG-CG1 4.27Å; I314-F358 HydrophobicContact CG2-CD1 3.77Å; I314-F358 HydrophobicContact CG2-CE1 4.4Å; I314-D359 PolarHBondContact N-OD2 2.91Å; I314-D359 PolarHBondContact O-N 2.86Å; I314-V360 PolarHBondContact O-N 2.91Å
315	V	98.4	Very high	95	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	115.2	175.5	-178.5	0	0	0	0	108.8	V205 V206 L207 V208 I313 V360 L362 L374	V205-V315 HydrophobicContact CG1-CG2 3.68Å; V206-V315 PolarHBondContact O-N 2.89Å; L207-V315 WeakPolarHBondContact CA-O 3.38Å; L207-V315 HydrophobicContact CD2-CB 3.79Å; L207-V315 HydrophobicContact CD2-CG1 3.56Å; V208-V315 PolarHBondContact N-O 3.02Å; I313-V315 HydrophobicContact CG2-CG2 4.08Å; V315-V360 HydrophobicContact CB-CB 4.47Å; V315-V360 HydrophobicContact CG1-CB 4.21Å; V315-V360 HydrophobicContact CG1-CG1 4.4Å; V315-V360 HydrophobicContact CG2-CB 4.17Å; V315-V360 HydrophobicContact CG2-CG2 4.28Å; V315-L362 HydrophobicContact CG1-CD1 3.69Å; V315-L362 HydrophobicContact CG1-CG 4.03Å; V315-L374 HydrophobicContact CG1-CD1 3.91Å; V315-L374 HydrophobicContact CG1-CD2 4.48Å; V315-L374 HydrophobicContact CG2-CD1 3.76Å
316	Y	98.2	Very high	95.2	Very high	11 Å²	11	40.6 Å²	40.6	4%	0.043	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	111.7	178.6	175.5	-149.8	0	0	0	111.2	V208 K318 L350 F358 V360 I361 L362	V208-Y316 HydrophobicContact CG2-CD2 4.48Å; V208-Y316 WeakPolarHBondContact O-CA 3.42Å; Y316-K318 HydrophobicContact CD1-CB 4.09Å; Y316-K318 HydrophobicContact CD2-CB 4.44Å; Y316-K318 HydrophobicContact CE1-CB 3.75Å; Y316-K318 HydrophobicContact CE1-CD 3.96Å; Y316-K318 HydrophobicContact CE1-CG 3.88Å; Y316-K318 HydrophobicContact CE2-CB 4.11Å; Y316-K318 HydrophobicContact CG-CB 4.42Å; Y316-K318 PolarHBondContact O-N 2.95Å; Y316-L350 HydrophobicContact CD2-CD1 4.47Å; Y316-L350 HydrophobicContact CE2-CB 3.77Å; Y316-L350 HydrophobicContact CE2-CD1 4Å; Y316-L350 HydrophobicContact CE2-CG 4.35Å; Y316-F358 HydrophobicContact CD1-CD1 4.41Å; Y316-F358 AromaticContact CD1-CD2 3.96Å; Y316-F358 HydrophobicContact CD1-CD2 3.96Å; Y316-F358 HydrophobicContact CD1-CE1 4.12Å; Y316-F358 AromaticContact CD1-CE2 3.66Å; Y316-F358 HydrophobicContact CD1-CE2 3.66Å; Y316-F358 HydrophobicContact CD1-CG 4.32Å; Y316-F358 AromaticContact CD1-CZ 3.74Å; Y316-F358 HydrophobicContact CD1-CZ 3.74Å; Y316-F358 HydrophobicContact CE1-CE2 4.18Å; Y316-F358 HydrophobicContact CE1-CZ 4.24Å; Y316-F358 HydrophobicContact CG-CD1 4.2Å; Y316-F358 AromaticContact CG-CE1 3.95Å; Y316-F358 HydrophobicContact CG-CE1 3.95Å; Y316-F358 HydrophobicContact CG-CE2 4.32Å; Y316-F358 HydrophobicContact CG-CG 4.47Å; Y316-F358 HydrophobicContact CG-CZ 4.01Å; Y316-V360 PolarHBondContact N-O 2.74Å; Y316-I361 HydrophobicContact CD1-CG1 4.4Å; Y316-I361 HydrophobicContact CD1-CG2 4.06Å; Y316-L362 PolarHBondContact O-N 2.82Å
317	V	97.8	Very high	95.6	Very high	10 Å²	10	45.5 Å²	45.5	6%	0.061	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	114	168.8	-173.3	0	0	0	0	108.2	L207 V208 G209 P210 M221 L225	L207-V317 HydrophobicContact CD2-CG2 3.81Å; V208-V317 PolarHBondContact O-N 2.7Å; G209-V317 CarbonylContact C-O 3.52Å; P210-V317 WeakPolarHBondContact CA-O 3.44Å; P210-V317 WeakPolarHBondContact CB-O 3.31Å; M221-V317 HydrophobicContact CE-CG1 3.9Å; L225-V317 HydrophobicContact CD1-CG2 3.52Å
318	K	96.6	Very high	96	Very high	67 Å²	67	41.9 Å²	41.9	29%	0.291	22%	0.216	S	C	.	.			trans	-120.1	113.8	-168.4	174.2	-176.8	155.4	-150.5	0	111.3	Y316 S320 I361 L362 D363	Y316-K318 HydrophobicContact CD1-CB 4.09Å; Y316-K318 HydrophobicContact CD2-CB 4.44Å; Y316-K318 HydrophobicContact CE1-CB 3.75Å; Y316-K318 HydrophobicContact CE1-CD 3.96Å; Y316-K318 HydrophobicContact CE1-CG 3.88Å; Y316-K318 HydrophobicContact CE2-CB 4.11Å; Y316-K318 HydrophobicContact CG-CB 4.42Å; Y316-K318 PolarHBondContact O-N 2.95Å; K318-S320 WeakPolarHBondContact CE-OG 3.39Å; K318-S320 PolarHBondContact O-N 3.21Å; K318-I361 HydrophobicContact CB-CG2 4.08Å; K318-I361 HydrophobicContact CD-CG2 3.68Å; K318-L362 PolarHBondContact N-O 3.37Å; K318-D363 HydrophobicContact CB-CB 3.94Å; K318-D363 HydrophobicContact CD-CB 3.76Å; K318-D363 WeakPolarHBondContact CE-OD2 3.29Å; K318-D363 HydrophobicContact CG-CB 3.97Å; K318-D363 IonicContact NZ-OD2 3.02Å; K318-D363 PolarHBondContact NZ-OD2 2.82Å; K318-D363 WeakPolarHBondContact O-CA 3.17Å
319	I	96.2	Very high	96.4	Very high	35 Å²	35	41.9 Å²	41.9	18%	0.179	22%	0.216	C	C	.	.			trans	-85.2	101.9	168.5	-66	169.1	0	0	0	108.8	P210 M221 S321 V324 L325 L328	P210-I319 HydrophobicContact CB-CB 4.28Å; P210-I319 HydrophobicContact CB-CD1 3.71Å; P210-I319 HydrophobicContact CB-CG1 3.75Å; P210-I319 HydrophobicContact CG-CD1 3.61Å; P210-I319 HydrophobicContact CG-CG1 4.09Å; M221-I319 HydrophobicContact CE-CD1 4.15Å; M221-I319 HydrophobicContact CE-CG1 4.23Å; M221-I319 HydrophobicContact SD-CD1 4.07Å; I319-S321 WeakPolarHBondContact CG2-O 3.28Å; I319-S321 PolarHBondContact O-N 2.73Å; I319-V324 HydrophobicContact CG2-CB 4.05Å; I319-V324 HydrophobicContact CG2-CG1 4.13Å; I319-L325 HydrophobicContact CD1-CB 4.23Å; I319-L325 HydrophobicContact CD1-CD1 4.01Å; I319-L325 HydrophobicContact CG2-CB 4.17Å; I319-L328 HydrophobicContact CD1-CD1 3.89Å
320	S	92.7	Very high	96.7	Very high	69 Å²	69	45.6 Å²	45.6	48%	0.483	23%	0.23	S	C	.	.	S	Bend	trans	-60.3	-7.5	-176.5	-73.4	0	0	0	0	116	K318 D363	K318-S320 WeakPolarHBondContact CE-OG 3.39Å; K318-S320 PolarHBondContact O-N 3.21Å; S320-D363 PolarHBondContact OG-OD2 3.21Å
321	S	95.3	Very high	96.8	Very high	48 Å²	48	50 Å²	50	34%	0.336	26%	0.26	S	S	.	.			trans	-126.4	110.5	171.6	-168.6	0	0	0	0	112.1	I319 K323 V324 L325	I319-S321 WeakPolarHBondContact CG2-O 3.28Å; I319-S321 PolarHBondContact O-N 2.73Å; S321-K323 PolarHBondContact O-N 2.86Å; S321-V324 WeakPolarHBondContact O-CA 3.39Å; S321-V324 WeakPolarHBondContact O-CB 3.46Å; S321-V324 PolarHBondContact O-N 3.41Å; S321-L325 PolarHBondContact O-N 3.44Å
322	P	95.4	Very high	96.9	Very high	69 Å²	69	54.3 Å²	54.3	45%	0.448	28%	0.275	S	S	.	.	H	α-helix	trans	-54.3	-28.3	173.4	-29.6	36.7	0	0	0	113.6	V324 Q326 M344	P322-V324 VanDerWaalsContact C-N 3.34Å; P322-Q326 WeakPolarHBondContact O-CB 3.48Å; P322-Q326 PolarHBondContact O-N 3.05Å; P322-M344 HydrophobicContact CB-CE 3.72Å
323	K	96.8	Very high	96.8	Very high	151 Å²	151	55.2 Å²	55.2	66%	0.657	29%	0.286	S	S	*	.	H	α-helix	trans	-70.5	-25.2	174.9	-66.2	178.3	-178.4	173.5	0	113.3	S321 R327	S321-K323 PolarHBondContact O-N 2.86Å; K323-R327 VanDerWaalsContact O-CG 3.32Å; K323-R327 WeakPolarHBondContact O-CG 3.15Å; K323-R327 PolarHBondContact O-N 2.99Å
324	V	97.1	Very high	96.6	Very high	62 Å²	62	64.2 Å²	64.2	38%	0.376	33%	0.325	S	S	.	.	H	α-helix	trans	-77.2	-49.1	173.4	172.8	0	0	0	0	109.7	I319 S321 P322 Q326 R327 L328	I319-V324 HydrophobicContact CG2-CB 4.05Å; I319-V324 HydrophobicContact CG2-CG1 4.13Å; S321-V324 WeakPolarHBondContact O-CA 3.39Å; S321-V324 WeakPolarHBondContact O-CB 3.46Å; S321-V324 PolarHBondContact O-N 3.41Å; P322-V324 VanDerWaalsContact C-N 3.34Å; V324-Q326 VanDerWaalsContact C-N 3.27Å; V324-Q326 PolarHBondContact O-N 3.3Å; V324-R327 WeakPolarHBondContact O-CA 3.36Å; V324-R327 WeakPolarHBondContact O-CB 3.45Å; V324-R327 PolarHBondContact O-N 2.95Å; V324-L328 HydrophobicContact CG1-CD1 4.04Å; V324-L328 HydrophobicContact CG1-CG 4.39Å; V324-L328 WeakPolarHBondContact O-CG 3.25Å; V324-L328 PolarHBondContact O-N 3.2Å
325	L	97.1	Very high	96.4	Very high	4 Å²	4	66.8 Å²	66.8	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-54	-44.8	172.7	176.5	59.5	0	0	0	111.5	V217 I319 S321 R327 L328 I329 M344 A347	V217-L325 HydrophobicContact CG1-CD1 4.13Å; I319-L325 HydrophobicContact CD1-CB 4.23Å; I319-L325 HydrophobicContact CD1-CD1 4.01Å; I319-L325 HydrophobicContact CG2-CB 4.17Å; S321-L325 PolarHBondContact O-N 3.44Å; L325-R327 PolarHBondContact O-N 3.17Å; L325-L328 PolarHBondContact O-N 3.39Å; L325-I329 HydrophobicContact CD1-CD1 3.7Å; L325-I329 HydrophobicContact CD1-CG1 3.91Å; L325-I329 HydrophobicContact CG-CD1 3.78Å; L325-I329 HydrophobicContact CG-CG1 4.4Å; L325-I329 WeakPolarHBondContact O-CG1 3.48Å; L325-I329 PolarHBondContact O-N 2.89Å; L325-M344 HydrophobicContact CB-SD 4.45Å; L325-M344 HydrophobicContact CD2-CE 4.18Å; L325-M344 HydrophobicContact CD2-SD 4.01Å; L325-M344 HydrophobicContact CG-SD 3.98Å; L325-A347 HydrophobicContact CD2-CB 3.42Å; L325-A347 VanDerWaalsContact CD2-CB 3.42Å
326	Q	97.2	Very high	96.3	Very high	77 Å²	77	67.8 Å²	67.8	36%	0.36	35%	0.348	S	S	.	.	H	α-helix	trans	-60.4	-29.8	177.1	-153.8	-151.8	56.5	0	0	113.5	P322 V324 K330 L340 M344	P322-Q326 WeakPolarHBondContact O-CB 3.48Å; P322-Q326 PolarHBondContact O-N 3.05Å; V324-Q326 VanDerWaalsContact C-N 3.27Å; V324-Q326 PolarHBondContact O-N 3.3Å; Q326-K330 VanDerWaalsContact CD-NZ 3.26Å; Q326-K330 VanDerWaalsContact O-CD 3.29Å; Q326-K330 WeakPolarHBondContact O-CD 3.41Å; Q326-K330 WeakPolarHBondContact O-CG 3.42Å; Q326-K330 PolarHBondContact O-N 3.35Å; Q326-L340 HydrophobicContact CB-CD1 4.49Å; Q326-L340 HydrophobicContact CG-CD1 3.71Å; Q326-L340 HydrophobicContact CG-CD2 3.88Å; Q326-L340 HydrophobicContact CG-CG 4.26Å; Q326-M344 HydrophobicContact CB-SD 4.15Å; Q326-M344 HydrophobicContact CG-SD 4.38Å
327	R	97.4	Very high	96.1	Very high	164 Å²	164	69.1 Å²	69.1	62%	0.619	36%	0.361	S	S	*	.	H	α-helix	trans	-78.8	-41.9	174.8	-72	169.1	-175.5	141.5	-6.2	111.6	K323 V324 L325 K330 S331	K323-R327 VanDerWaalsContact O-CG 3.32Å; K323-R327 WeakPolarHBondContact O-CG 3.15Å; K323-R327 PolarHBondContact O-N 2.99Å; V324-R327 WeakPolarHBondContact O-CA 3.36Å; V324-R327 WeakPolarHBondContact O-CB 3.45Å; V324-R327 PolarHBondContact O-N 2.95Å; L325-R327 PolarHBondContact O-N 3.17Å; R327-K330 CarbonylContact O-C 3.6Å; R327-K330 PolarHBondContact O-N 3.26Å; R327-K330 VanDerWaalsContact O-N 3.16Å; R327-S331 PolarHBondContact O-N 3.49Å
328	L	97.1	Very high	96.1	Very high	64 Å²	64	76.8 Å²	76.8	34%	0.335	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-44.6	177.4	-67.8	170.5	0	0	0	111.6	V217 I319 V324 L325 K330 S331 R332	V217-L328 HydrophobicContact CG1-CB 4.13Å; V217-L328 HydrophobicContact CG2-CB 4.36Å; I319-L328 HydrophobicContact CD1-CD1 3.89Å; V324-L328 HydrophobicContact CG1-CD1 4.04Å; V324-L328 HydrophobicContact CG1-CG 4.39Å; V324-L328 WeakPolarHBondContact O-CG 3.25Å; V324-L328 PolarHBondContact O-N 3.2Å; L325-L328 PolarHBondContact O-N 3.39Å; L328-K330 VanDerWaalsContact C-N 3.28Å; L328-K330 PolarHBondContact O-N 3.18Å; L328-S331 PolarHBondContact O-N 3.41Å; L328-S331 PolarHBondContact O-OG 2.88Å; L328-R332 PolarHBondContact O-N 3.1Å
329	I	97.6	Very high	96	Very high	0 Å²	0	77.6 Å²	77.6	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-63.2	-36.7	176.1	-61.7	167	0	0	0	111.2	V217 L325 Q336 L340 Q343 M344	V217-I329 HydrophobicContact CG2-CG1 4.01Å; L325-I329 HydrophobicContact CD1-CD1 3.7Å; L325-I329 HydrophobicContact CD1-CG1 3.91Å; L325-I329 HydrophobicContact CG-CD1 3.78Å; L325-I329 HydrophobicContact CG-CG1 4.4Å; L325-I329 WeakPolarHBondContact O-CG1 3.48Å; L325-I329 PolarHBondContact O-N 2.89Å; I329-Q336 HydrophobicContact CG2-CB 4.22Å; I329-L340 HydrophobicContact CB-CD1 3.79Å; I329-L340 HydrophobicContact CD1-CD1 3.74Å; I329-L340 HydrophobicContact CG1-CD1 4.37Å; I329-L340 HydrophobicContact CG2-CB 4.31Å; I329-L340 HydrophobicContact CG2-CD1 3.72Å; I329-Q343 HydrophobicContact CD1-CB 3.69Å; I329-Q343 HydrophobicContact CD1-CG 4.46Å; I329-Q343 VanDerWaalsContact CD1-OE1 3.26Å; I329-Q343 VanDerWaalsContact CG1-OE1 3.29Å; I329-M344 HydrophobicContact CD1-SD 4.3Å
330	K	97.2	Very high	96.1	Very high	100 Å²	100	76.7 Å²	76.7	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-73.5	-32.5	177.7	-73.6	172	-176.3	174.1	0	113.2	Q326 R327 L328 R332 G333	Q326-K330 VanDerWaalsContact CD-NZ 3.26Å; Q326-K330 VanDerWaalsContact O-CD 3.29Å; Q326-K330 WeakPolarHBondContact O-CD 3.41Å; Q326-K330 WeakPolarHBondContact O-CG 3.42Å; Q326-K330 PolarHBondContact O-N 3.35Å; R327-K330 CarbonylContact O-C 3.6Å; R327-K330 PolarHBondContact O-N 3.26Å; R327-K330 VanDerWaalsContact O-N 3.16Å; L328-K330 VanDerWaalsContact C-N 3.28Å; L328-K330 PolarHBondContact O-N 3.18Å; K330-R332 VanDerWaalsContact C-N 3.3Å; K330-R332 PolarHBondContact O-N 3.47Å; K330-G333 PolarHBondContact O-N 2.84Å
331	S	96.9	Very high	96.3	Very high	91 Å²	91	79.5 Å²	79.5	64%	0.636	40%	0.404	S	S	*	.	H	α-helix	trans	-71.8	-24.1	179	65.5	0	0	0	0	113	R327 L328 G333	R327-S331 PolarHBondContact O-N 3.49Å; L328-S331 PolarHBondContact O-N 3.41Å; L328-S331 PolarHBondContact O-OG 2.88Å; S331-G333 PolarHBondContact O-N 3.5Å
332	R	96.4	Very high	96.4	Very high	100 Å²	100	80.5 Å²	80.5	38%	0.377	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-3.8	166.3	-56.1	-51.4	-61.2	-165.5	-4.9	114.1	E216 V217 M220 L328 K330 Q336	E216-R332 HydrophobicContact CB-CG 4.33Å; E216-R332 IonicContact OE2-CZ 3.04Å; E216-R332 IonicContact OE2-NE 3.65Å; E216-R332 PolarHBondContact OE2-NE 2.79Å; E216-R332 IonicContact OE2-NH2 3.22Å; E216-R332 PolarHBondContact OE2-NH2 2.82Å; V217-R332 HydrophobicContact CG2-CG 3.81Å; M220-R332 VanDerWaalsContact SD-CZ 3.58Å; M220-R332 PolarHBondContact SD-NH1 3.32Å; L328-R332 PolarHBondContact O-N 3.1Å; K330-R332 VanDerWaalsContact C-N 3.3Å; K330-R332 PolarHBondContact O-N 3.47Å; R332-Q336 HydrophobicContact CB-CB 3.83Å; R332-Q336 HydrophobicContact CB-CG 3.55Å; R332-Q336 HydrophobicContact CG-CG 4.35Å
333	G	95.5	Very high	96.5	Very high	29 Å²	29	77.2 Å²	77.2	30%	0.299	39%	0.386	S	S	.	.			trans	89.8	-168.3	169.3	0	0	0	0	0	115.7	K330 S331 S335 Q336 A337	K330-G333 PolarHBondContact O-N 2.84Å; S331-G333 PolarHBondContact O-N 3.5Å; G333-S335 VanDerWaalsContact C-N 3.26Å; G333-S335 PolarHBondContact O-N 3.13Å; G333-Q336 PolarHBondContact O-N 3Å; G333-A337 VanDerWaalsContact O-CB 3.29Å; G333-A337 WeakPolarHBondContact O-CB 3.3Å; G333-A337 PolarHBondContact O-N 2.97Å
334	K	93.9	Very high	96.5	Very high	188 Å²	188	71.1 Å²	71.1	82%	0.817	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.2	-167	-65.5	-178.1	-177.7	175.8	0	114.8	K338	K334-K338 WeakPolarHBondContact O-CG 3.25Å
335	S	94.7	Very high	96.5	Very high	64 Å²	64	71.8 Å²	71.8	45%	0.448	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-64	171.6	43.2	0	0	0	0	110	G333 A337 K338	G333-S335 VanDerWaalsContact C-N 3.26Å; G333-S335 PolarHBondContact O-N 3.13Å; S335-A337 PolarHBondContact O-N 2.96Å; S335-K338 WeakPolarHBondContact O-CB 3.14Å; S335-K338 PolarHBondContact O-N 3.11Å
336	Q	95.1	Very high	96.5	Very high	21 Å²	21	72.3 Å²	72.3	10%	0.098	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-63.9	-38.7	-178.2	-63.8	-57.5	-32.5	0	0	112.4	E216 I329 R332 G333 K338 H339 L340	E216-Q336 HydrophobicContact CB-CG 4.33Å; E216-Q336 HydrophobicContact CG-CG 4.33Å; E216-Q336 VanDerWaalsContact OE1-CG 3.32Å; E216-Q336 WeakPolarHBondContact OE1-CG 3.49Å; E216-Q336 PolarHBondContact OE1-NE2 3.14Å; I329-Q336 HydrophobicContact CG2-CB 4.22Å; R332-Q336 HydrophobicContact CB-CB 3.83Å; R332-Q336 HydrophobicContact CB-CG 3.55Å; R332-Q336 HydrophobicContact CG-CG 4.35Å; G333-Q336 PolarHBondContact O-N 3Å; Q336-K338 PolarHBondContact O-N 3.16Å; Q336-K338 VanDerWaalsContact O-N 3.11Å; Q336-H339 PolarHBondContact O-N 3.16Å; Q336-L340 PolarHBondContact O-N 2.64Å
337	A	94.9	Very high	96.5	Very high	38 Å²	38	69.1 Å²	69.1	31%	0.314	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-60.1	-23.5	179.7	0	0	0	0	0	114.6	G333 S335 H339 L340	G333-A337 VanDerWaalsContact O-CB 3.29Å; G333-A337 WeakPolarHBondContact O-CB 3.3Å; G333-A337 PolarHBondContact O-N 2.97Å; S335-A337 PolarHBondContact O-N 2.96Å; A337-H339 VanDerWaalsContact C-N 3.28Å; A337-H339 PolarHBondContact O-N 2.69Å; A337-L340 WeakPolarHBondContact O-CB 3.36Å; A337-L340 PolarHBondContact O-N 3.49Å
338	K	96.3	Very high	96.5	Very high	171 Å²	171	64.3 Å²	64.3	74%	0.743	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-64.4	-33.6	172.2	-71.9	169.1	-179.2	-176.6	0	112.4	K334 S335 Q336	K334-K338 WeakPolarHBondContact O-CG 3.25Å; S335-K338 WeakPolarHBondContact O-CB 3.14Å; S335-K338 PolarHBondContact O-N 3.11Å; Q336-K338 PolarHBondContact O-N 3.16Å; Q336-K338 VanDerWaalsContact O-N 3.11Å
339	H	96.1	Very high	96.4	Very high	84 Å²	84	67 Å²	67	39%	0.389	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-97.8	10.8	-175.8	-61.5	-90.4	0	0	0	112.6	Y215 Q336 A337 N341 V342 Q343	Y215-H339 HydrophobicContact CD1-CB 4.24Å; Y215-H339 HydrophobicContact CE1-CB 3.4Å; Y215-H339 VanDerWaalsContact CE1-CB 3.4Å; Y215-H339 AromaticContact CE1-CG 3.64Å; Q336-H339 PolarHBondContact O-N 3.16Å; A337-H339 VanDerWaalsContact C-N 3.28Å; A337-H339 PolarHBondContact O-N 2.69Å; H339-N341 VanDerWaalsContact C-N 3.33Å; H339-N341 PolarHBondContact O-N 2.84Å; H339-V342 HydrophobicContact CB-CG1 3.99Å; H339-V342 WeakPolarHBondContact O-CG1 3.42Å; H339-V342 PolarHBondContact O-N 3.41Å; H339-Q343 PolarHBondContact O-N 3Å; H339-Q343 VanDerWaalsContact O-N 3.09Å
340	L	96.8	Very high	96.4	Very high	16 Å²	16	67.1 Å²	67.1	8%	0.084	35%	0.352	C	S	.	.	H	α-helix	trans	-51.5	-48.2	-179	178.6	64.4	0	0	0	112.7	Q326 I329 Q336 A337 V342 Q343 M344	Q326-L340 HydrophobicContact CB-CD1 4.49Å; Q326-L340 HydrophobicContact CG-CD1 3.71Å; Q326-L340 HydrophobicContact CG-CD2 3.88Å; Q326-L340 HydrophobicContact CG-CG 4.26Å; I329-L340 HydrophobicContact CB-CD1 3.79Å; I329-L340 HydrophobicContact CD1-CD1 3.74Å; I329-L340 HydrophobicContact CG1-CD1 4.37Å; I329-L340 HydrophobicContact CG2-CB 4.31Å; I329-L340 HydrophobicContact CG2-CD1 3.72Å; Q336-L340 PolarHBondContact O-N 2.64Å; A337-L340 WeakPolarHBondContact O-CB 3.36Å; A337-L340 PolarHBondContact O-N 3.49Å; L340-V342 PolarHBondContact O-N 3.34Å; L340-Q343 PolarHBondContact O-N 3.48Å; L340-M344 HydrophobicContact CD1-CG 4.06Å; L340-M344 HydrophobicContact CD1-SD 4.27Å; L340-M344 HydrophobicContact CG-CG 4.33Å; L340-M344 VanDerWaalsContact O-CG 3.32Å; L340-M344 WeakPolarHBondContact O-CG 3.26Å; L340-M344 PolarHBondContact O-N 3.22Å
341	N	97.4	Very high	96.3	Very high	128 Å²	128	65.7 Å²	65.7	68%	0.684	36%	0.359	S	S	*	.	H	α-helix	trans	-66.4	-38.8	-174.5	-66.7	-4.3	0	0	0	112.7	H339 V345	H339-N341 VanDerWaalsContact C-N 3.33Å; H339-N341 PolarHBondContact O-N 2.84Å; N341-V345 WeakPolarHBondContact O-CB 3.43Å; N341-V345 VanDerWaalsContact O-CG2 3.3Å; N341-V345 WeakPolarHBondContact O-CG2 3.44Å; N341-V345 PolarHBondContact O-N 3.34Å
342	V	97.4	Very high	96.2	Very high	69 Å²	69	68.6 Å²	68.6	42%	0.418	36%	0.363	S	S	.	.	H	α-helix	trans	-72.7	-33.8	178.7	62.6	0	0	0	0	111.6	L212 H339 L340 A346	L212-V342 HydrophobicContact CD1-CG2 3.91Å; H339-V342 HydrophobicContact CB-CG1 3.99Å; H339-V342 WeakPolarHBondContact O-CG1 3.42Å; H339-V342 PolarHBondContact O-N 3.41Å; L340-V342 PolarHBondContact O-N 3.34Å; V342-A346 PolarHBondContact O-N 3.16Å
343	Q	97.3	Very high	96.2	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.8	-47.1	171.2	-75.2	-174.9	50.5	0	0	112.1	S211 Y215 I329 H339 L340 V345 A346 A347	S211-Q343 WeakPolarHBondContact OG-CA 3.38Å; S211-Q343 WeakPolarHBondContact OG-CB 3.34Å; S211-Q343 PolarHBondContact OG-O 2.88Å; Y215-Q343 HydrophobicContact CD1-CG 4.31Å; Y215-Q343 HydrophobicContact CD2-CG 3.84Å; Y215-Q343 HydrophobicContact CE1-CG 4.48Å; Y215-Q343 HydrophobicContact CE2-CG 4.04Å; Y215-Q343 HydrophobicContact CG-CG 3.95Å; Y215-Q343 VanDerWaalsContact CG-NE2 3.25Å; I329-Q343 HydrophobicContact CD1-CB 3.69Å; I329-Q343 HydrophobicContact CD1-CG 4.46Å; I329-Q343 VanDerWaalsContact CD1-OE1 3.26Å; I329-Q343 VanDerWaalsContact CG1-OE1 3.29Å; H339-Q343 PolarHBondContact O-N 3Å; H339-Q343 VanDerWaalsContact O-N 3.09Å; L340-Q343 PolarHBondContact O-N 3.48Å; Q343-V345 PolarHBondContact O-N 3.19Å; Q343-A346 PolarHBondContact O-N 2.77Å; Q343-A347 PolarHBondContact O-N 3.36Å
344	M	97.6	Very high	96.2	Very high	24 Å²	24	66.3 Å²	66.3	12%	0.118	36%	0.356	C	S	.	.	H	α-helix	trans	-59.6	-47.5	176.6	-67.9	-50.1	-48.6	0	0	111.9	P322 L325 Q326 I329 L340 A346 A347 D348	P322-M344 HydrophobicContact CB-CE 3.72Å; L325-M344 HydrophobicContact CB-SD 4.45Å; L325-M344 HydrophobicContact CD2-CE 4.18Å; L325-M344 HydrophobicContact CD2-SD 4.01Å; L325-M344 HydrophobicContact CG-SD 3.98Å; Q326-M344 HydrophobicContact CB-SD 4.15Å; Q326-M344 HydrophobicContact CG-SD 4.38Å; I329-M344 HydrophobicContact CD1-SD 4.3Å; L340-M344 HydrophobicContact CD1-CG 4.06Å; L340-M344 HydrophobicContact CD1-SD 4.27Å; L340-M344 HydrophobicContact CG-CG 4.33Å; L340-M344 VanDerWaalsContact O-CG 3.32Å; L340-M344 WeakPolarHBondContact O-CG 3.26Å; L340-M344 PolarHBondContact O-N 3.22Å; M344-A346 PolarHBondContact O-N 2.67Å; M344-A347 WeakPolarHBondContact O-CB 2.9Å; M344-A347 PolarHBondContact O-N 2.78Å; M344-A347 VanDerWaalsContact O-N 3.11Å; M344-D348 VanDerWaalsContact O-CG 3.23Å; M344-D348 PolarHBondContact O-N 3.43Å
345	V	97.3	Very high	96.2	Very high	76 Å²	76	61.5 Å²	61.5	46%	0.461	34%	0.344	S	S	.	.	H	α-helix	trans	-61.3	-29	179.4	167.8	0	0	0	0	112.8	N341 Q343 K349	N341-V345 WeakPolarHBondContact O-CB 3.43Å; N341-V345 VanDerWaalsContact O-CG2 3.3Å; N341-V345 WeakPolarHBondContact O-CG2 3.44Å; N341-V345 PolarHBondContact O-N 3.34Å; Q343-V345 PolarHBondContact O-N 3.19Å; V345-K349 VanDerWaalsContact O-CG 3.27Å; V345-K349 WeakPolarHBondContact O-CG 3.47Å; V345-K349 PolarHBondContact O-N 3.03Å
346	A	96.4	Very high	96.1	Very high	14 Å²	14	66.1 Å²	66.1	12%	0.116	36%	0.358	C	S	.	.	H	α-helix	trans	-76.7	-40.2	174.2	0	0	0	0	0	112.8	L212 V342 Q343 M344 D348 K349 L350	L212-A346 HydrophobicContact CD1-CB 4.21Å; L212-A346 HydrophobicContact CD2-CB 3.54Å; L212-A346 HydrophobicContact CG-CB 3.43Å; L212-A346 VanDerWaalsContact CG-CB 3.43Å; V342-A346 PolarHBondContact O-N 3.16Å; Q343-A346 PolarHBondContact O-N 2.77Å; M344-A346 PolarHBondContact O-N 2.67Å; A346-D348 VanDerWaalsContact C-N 3.34Å; A346-K349 PolarHBondContact O-N 3.43Å; A346-L350 PolarHBondContact O-N 2.94Å
347	A	97.1	Very high	96	Very high	10 Å²	10	68.6 Å²	68.6	8%	0.083	37%	0.372	C	S	.	.	H	α-helix	trans	-61	-43.8	172.4	0	0	0	0	0	111.5	P210 L325 Q343 M344 K349 L350 A351	P210-A347 WeakPolarHBondContact O-CB 3.42Å; L325-A347 HydrophobicContact CD2-CB 3.42Å; L325-A347 VanDerWaalsContact CD2-CB 3.42Å; Q343-A347 PolarHBondContact O-N 3.36Å; M344-A347 WeakPolarHBondContact O-CB 2.9Å; M344-A347 PolarHBondContact O-N 2.78Å; M344-A347 VanDerWaalsContact O-N 3.11Å; A347-K349 VanDerWaalsContact C-N 3.32Å; A347-K349 PolarHBondContact O-N 2.84Å; A347-L350 PolarHBondContact O-N 2.94Å; A347-A351 WeakPolarHBondContact O-CB 3.21Å; A347-A351 PolarHBondContact O-N 3.25Å
348	D	96.9	Very high	96.1	Very high	63 Å²	63	67.7 Å²	67.7	34%	0.337	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-37.3	176.4	-65.2	-30.4	0	0	0	111.7	M344 A346 A351 Q352	M344-D348 VanDerWaalsContact O-CG 3.23Å; M344-D348 PolarHBondContact O-N 3.43Å; A346-D348 VanDerWaalsContact C-N 3.34Å; D348-A351 PolarHBondContact O-N 3.24Å; D348-Q352 WeakPolarHBondContact O-CB 3.26Å; D348-Q352 WeakPolarHBondContact O-CG 3.21Å; D348-Q352 PolarHBondContact O-N 3.17Å; D348-Q352 PolarHBondContact O-NE2 3.06Å
349	K	96.3	Very high	96.1	Very high	120 Å²	120	62 Å²	62	52%	0.522	34%	0.338	S	S	.	.	H	α-helix	trans	-66.9	-40.3	174.2	-79.1	172.7	179.2	-176.8	0	113	V345 A346 A347 Q352 C353	V345-K349 VanDerWaalsContact O-CG 3.27Å; V345-K349 WeakPolarHBondContact O-CG 3.47Å; V345-K349 PolarHBondContact O-N 3.03Å; A346-K349 PolarHBondContact O-N 3.43Å; A347-K349 VanDerWaalsContact C-N 3.32Å; A347-K349 PolarHBondContact O-N 2.84Å; K349-Q352 PolarHBondContact O-N 2.69Å; K349-C353 PolarHBondContact O-N 3.39Å; K349-C353 PolarHBondContact O-SG 3.1Å; K349-C353 VanDerWaalsContact O-SG 3.36Å
350	L	96.7	Very high	96.2	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-65.4	-41.9	174.2	-78.4	169.3	0	0	0	111.2	V208 Y316 A346 A347 Q352 C353 F358	V208-L350 HydrophobicContact CG2-CD2 4.41Å; Y316-L350 HydrophobicContact CD2-CD1 4.47Å; Y316-L350 HydrophobicContact CE2-CB 3.77Å; Y316-L350 HydrophobicContact CE2-CD1 4Å; Y316-L350 HydrophobicContact CE2-CG 4.35Å; A346-L350 PolarHBondContact O-N 2.94Å; A347-L350 PolarHBondContact O-N 2.94Å; L350-Q352 PolarHBondContact O-N 2.91Å; L350-C353 VanDerWaalsContact O-CB 3.31Å; L350-C353 WeakPolarHBondContact O-CB 3.37Å; L350-C353 PolarHBondContact O-N 2.67Å; L350-C353 VanDerWaalsContact O-N 3.1Å; L350-F358 HydrophobicContact CD2-CE1 4.24Å; L350-F358 HydrophobicContact CD2-CZ 4.21Å
351	A	95.3	Very high	96.3	Very high	71 Å²	71	59.8 Å²	59.8	59%	0.587	33%	0.329	S	S	*	.	H	α-helix	trans	-67.7	-17.7	175.4	0	0	0	0	0	114.2	A347 D348	A347-A351 WeakPolarHBondContact O-CB 3.21Å; A347-A351 PolarHBondContact O-N 3.25Å; D348-A351 PolarHBondContact O-N 3.24Å
352	Q	95.3	Very high	96.3	Very high	151 Å²	151	53.9 Å²	53.9	71%	0.706	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-6.8	172.8	-74.9	164.5	34.1	0	0	113.6	D348 K349 L350	D348-Q352 WeakPolarHBondContact O-CB 3.26Å; D348-Q352 WeakPolarHBondContact O-CG 3.21Å; D348-Q352 PolarHBondContact O-N 3.17Å; D348-Q352 PolarHBondContact O-NE2 3.06Å; K349-Q352 PolarHBondContact O-N 2.69Å; L350-Q352 PolarHBondContact O-N 2.91Å
353	C	96.2	Very high	96.3	Very high	18 Å²	18	53.7 Å²	53.7	12%	0.122	29%	0.294	C	S	.	.	S	Bend	trans	-72.1	137.1	174.5	-67.2	0	0	0	0	110.4	H301 K349 L350 L357 F358	H301-C353 PolarHBondContact NE2-SG 3.39Å; K349-C353 PolarHBondContact O-N 3.39Å; K349-C353 PolarHBondContact O-SG 3.1Å; K349-C353 VanDerWaalsContact O-SG 3.36Å; L350-C353 VanDerWaalsContact O-CB 3.31Å; L350-C353 WeakPolarHBondContact O-CB 3.37Å; L350-C353 PolarHBondContact O-N 2.67Å; L350-C353 VanDerWaalsContact O-N 3.1Å; C353-L357 HydrophobicContact CB-CD1 4.45Å; C353-F358 HydrophobicContact CB-CE2 3.64Å; C353-F358 HydrophobicContact CB-CZ 3.61Å
354	P	95.7	Very high	96.2	Very high	64 Å²	64	56.3 Å²	56.3	42%	0.416	31%	0.307	S	S	.	.			trans	-60.8	142.2	168.7	25.7	-33.1	0	0	0	109.9	E356 L357	P354-E356 PolarHBondContact O-N 3.24Å; P354-E356 VanDerWaalsContact O-N 3.14Å; P354-L357 HydrophobicContact CG-CD1 3.91Å; P354-L357 HydrophobicContact CG-CG 4.08Å; P354-L357 PolarHBondContact O-N 3.45Å; P354-L357 VanDerWaalsContact O-N 3.13Å
355	P	93.9	Very high	96.1	Very high	87 Å²	87	62.3 Å²	62.3	57%	0.565	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-61.6	-27.1	-173.3	24.4	-33.9	0	0	0	112.8	L357 F358 I361	P355-L357 PolarHBondContact O-N 2.89Å; P355-F358 PolarHBondContact O-N 3.31Å; P355-I361 HydrophobicContact CB-CD1 3.96Å
356	E	92.6	Very high	96	Very high	160 Å²	160	64.1 Å²	64.1	75%	0.748	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-57.7	-9.5	174.6	-60.5	160.4	-132.6	0	0	115.4	P354	P354-E356 PolarHBondContact O-N 3.24Å; P354-E356 VanDerWaalsContact O-N 3.14Å
357	L	93.3	Very high	95.9	Very high	73 Å²	73	67.1 Å²	67.1	38%	0.382	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-92.4	-1.5	173.5	-66.5	178	0	0	0	113.7	P302 C353 P354 P355	P302-L357 HydrophobicContact CB-CB 4.15Å; P302-L357 WeakPolarHBondContact CB-O 3.29Å; P302-L357 HydrophobicContact CG-CB 3.9Å; P302-L357 HydrophobicContact CG-CD1 4.38Å; C353-L357 HydrophobicContact CB-CD1 4.45Å; P354-L357 HydrophobicContact CG-CD1 3.91Å; P354-L357 HydrophobicContact CG-CG 4.08Å; P354-L357 PolarHBondContact O-N 3.45Å; P354-L357 VanDerWaalsContact O-N 3.13Å; P355-L357 PolarHBondContact O-N 2.89Å
358	F	96.6	Very high	95.9	Very high	20 Å²	20	72.6 Å²	72.6	9%	0.088	38%	0.38	C	S	.	.			trans	-120.2	137.6	178.3	-51.7	-65.9	0	0	0	109.5	V208 P302 I314 Y316 L350 C353 P355 I361	V208-F358 HydrophobicContact CG2-CD1 4.46Å; V208-F358 HydrophobicContact CG2-CE1 4.13Å; P302-F358 HydrophobicContact CB-CE1 4.47Å; P302-F358 HydrophobicContact CG-CD1 4.27Å; P302-F358 HydrophobicContact CG-CE1 3.69Å; P302-F358 HydrophobicContact CG-CZ 4.2Å; I314-F358 HydrophobicContact CG2-CD1 3.77Å; I314-F358 HydrophobicContact CG2-CE1 4.4Å; Y316-F358 HydrophobicContact CD1-CD1 4.41Å; Y316-F358 AromaticContact CD1-CD2 3.96Å; Y316-F358 HydrophobicContact CD1-CD2 3.96Å; Y316-F358 HydrophobicContact CD1-CE1 4.12Å; Y316-F358 AromaticContact CD1-CE2 3.66Å; Y316-F358 HydrophobicContact CD1-CE2 3.66Å; Y316-F358 HydrophobicContact CD1-CG 4.32Å; Y316-F358 AromaticContact CD1-CZ 3.74Å; Y316-F358 HydrophobicContact CD1-CZ 3.74Å; Y316-F358 HydrophobicContact CE1-CE2 4.18Å; Y316-F358 HydrophobicContact CE1-CZ 4.24Å; Y316-F358 HydrophobicContact CG-CD1 4.2Å; Y316-F358 AromaticContact CG-CE1 3.95Å; Y316-F358 HydrophobicContact CG-CE1 3.95Å; Y316-F358 HydrophobicContact CG-CE2 4.32Å; Y316-F358 HydrophobicContact CG-CG 4.47Å; Y316-F358 HydrophobicContact CG-CZ 4.01Å; L350-F358 HydrophobicContact CD2-CE1 4.24Å; L350-F358 HydrophobicContact CD2-CZ 4.21Å; C353-F358 HydrophobicContact CB-CE2 3.64Å; C353-F358 HydrophobicContact CB-CZ 3.61Å; P355-F358 PolarHBondContact O-N 3.31Å; F358-I361 HydrophobicContact CB-CD1 4.3Å; F358-I361 HydrophobicContact CB-CG1 3.82Å; F358-I361 HydrophobicContact CD2-CD1 3.99Å; F358-I361 HydrophobicContact CD2-CG1 4.18Å; F358-I361 HydrophobicContact CG-CG1 4.28Å
359	D	96.9	Very high	95.9	Very high	50 Å²	50	73.5 Å²	73.5	27%	0.267	39%	0.385	S	S	.	.	S	Bend	trans	-83	-32.9	174.7	-70.3	-91.7	0	0	0	111.7	R203 I313 I314 Y377	R203-D359 IonicContact CZ-OD1 2.7Å; R203-D359 IonicContact CZ-OD2 2.95Å; R203-D359 IonicContact NH1-OD1 3.26Å; R203-D359 PolarHBondContact NH1-OD1 3.41Å; R203-D359 IonicContact NH2-OD1 2.73Å; R203-D359 PolarHBondContact NH2-OD1 3.37Å; R203-D359 IonicContact NH2-OD2 3.17Å; R203-D359 PolarHBondContact NH2-OD2 3.25Å; I313-D359 WeakPolarHBondContact CA-OD2 3.22Å; I313-D359 HydrophobicContact CG2-CB 3.82Å; I314-D359 PolarHBondContact N-OD2 2.91Å; I314-D359 PolarHBondContact O-N 2.86Å; D359-Y377 WeakPolarHBondContact O-CE2 3.34Å
360	V	97.9	Very high	96	Very high	5 Å²	5	68.2 Å²	68.2	3%	0.03	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.2	177.4	-172.8	0	0	0	0	108.4	I314 V315 Y316 L362 Y377	I314-V360 PolarHBondContact O-N 2.91Å; V315-V360 HydrophobicContact CB-CB 4.47Å; V315-V360 HydrophobicContact CG1-CB 4.21Å; V315-V360 HydrophobicContact CG1-CG1 4.4Å; V315-V360 HydrophobicContact CG2-CB 4.17Å; V315-V360 HydrophobicContact CG2-CG2 4.28Å; Y316-V360 PolarHBondContact N-O 2.74Å; V360-L362 HydrophobicContact CG1-CD2 3.69Å; V360-L362 HydrophobicContact CG1-CG 4.13Å; V360-Y377 HydrophobicContact CG2-CD1 3.48Å; V360-Y377 VanDerWaalsContact CG2-CD1 3.48Å; V360-Y377 HydrophobicContact CG2-CD2 3.6Å; V360-Y377 HydrophobicContact CG2-CE1 3.77Å; V360-Y377 HydrophobicContact CG2-CE2 3.84Å; V360-Y377 HydrophobicContact CG2-CG 3.41Å; V360-Y377 VanDerWaalsContact CG2-CG 3.41Å
361	I	97.9	Very high	96.1	Very high	49 Å²	49	68.3 Å²	68.3	25%	0.251	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115.8	171.3	-57.2	177.2	0	0	0	107	Y316 K318 P355 F358 H373	Y316-I361 HydrophobicContact CD1-CG1 4.4Å; Y316-I361 HydrophobicContact CD1-CG2 4.06Å; K318-I361 HydrophobicContact CB-CG2 4.08Å; K318-I361 HydrophobicContact CD-CG2 3.68Å; P355-I361 HydrophobicContact CB-CD1 3.96Å; F358-I361 HydrophobicContact CB-CD1 4.3Å; F358-I361 HydrophobicContact CB-CG1 3.82Å; F358-I361 HydrophobicContact CD2-CD1 3.99Å; F358-I361 HydrophobicContact CD2-CG1 4.18Å; F358-I361 HydrophobicContact CG-CG1 4.28Å; I361-H373 PolarHBondContact O-CE1 3.4Å; I361-H373 VanDerWaalsContact O-CE1 3.31Å
362	L	97.9	Very high	96.2	Very high	5 Å²	5	71.2 Å²	71.2	3%	0.026	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	103.5	177.2	-57.5	178.1	0	0	0	107.8	L225 V315 Y316 K318 V360 E364 A370 H373 L374	L225-L362 HydrophobicContact CD1-CD1 4.22Å; L225-L362 HydrophobicContact CD2-CD1 4.34Å; V315-L362 HydrophobicContact CG1-CD1 3.69Å; V315-L362 HydrophobicContact CG1-CG 4.03Å; Y316-L362 PolarHBondContact O-N 2.82Å; K318-L362 PolarHBondContact N-O 3.37Å; V360-L362 HydrophobicContact CG1-CD2 3.69Å; V360-L362 HydrophobicContact CG1-CG 4.13Å; L362-E364 VanDerWaalsContact C-OE2 3.22Å; L362-E364 WeakPolarHBondContact CA-OE2 3.5Å; L362-E364 WeakPolarHBondContact CB-OE2 3.33Å; L362-A370 HydrophobicContact CB-CB 4.4Å; L362-A370 HydrophobicContact CD1-CB 4.49Å; L362-H373 HydrophobicContact CD2-CB 4.1Å; L362-L374 HydrophobicContact CD1-CB 4.18Å; L362-L374 HydrophobicContact CD1-CD2 4.2Å; L362-L374 HydrophobicContact CD2-CB 4.2Å
363	D	96.4	Very high	96.3	Very high	64 Å²	64	67.8 Å²	67.8	34%	0.342	35%	0.35	S	S	.	.			trans	-121.3	17.3	179.6	87.2	-12.8	0	0	0	114.7	K318 S320	K318-D363 HydrophobicContact CB-CB 3.94Å; K318-D363 HydrophobicContact CD-CB 3.76Å; K318-D363 WeakPolarHBondContact CE-OD2 3.29Å; K318-D363 HydrophobicContact CG-CB 3.97Å; K318-D363 IonicContact NZ-OD2 3.02Å; K318-D363 PolarHBondContact NZ-OD2 2.82Å; K318-D363 WeakPolarHBondContact O-CA 3.17Å; S320-D363 PolarHBondContact OG-OD2 3.21Å
364	E	96.7	Very high	96.4	Very high	55 Å²	55	66.9 Å²	66.9	26%	0.257	34%	0.344	S	S	.	.			trans	-67.3	157.9	172.2	-49.3	72	-155.6	0	0	111.5	L362 D369 A370 H373	L362-E364 VanDerWaalsContact C-OE2 3.22Å; L362-E364 WeakPolarHBondContact CA-OE2 3.5Å; L362-E364 WeakPolarHBondContact CB-OE2 3.33Å; E364-D369 HydrophobicContact CB-CB 3.78Å; E364-D369 HydrophobicContact CG-CB 3.88Å; E364-A370 HydrophobicContact CB-CB 4.24Å; E364-A370 WeakPolarHBondContact OE2-CB 3.46Å; E364-H373 IonicContact OE1-CE1 3.58Å; E364-H373 IonicContact OE1-CG 3.64Å; E364-H373 IonicContact OE1-ND1 2.82Å; E364-H373 PolarHBondContact OE1-ND1 3.05Å
365	N	94.1	Very high	96.5	Very high	150 Å²	150	64 Å²	64	80%	0.802	33%	0.325	S	S	*	.	S	Bend	trans	-100	-17.6	-175.8	-63.3	-87.2	0	0	0	113.6
366	Q	95.8	Very high	96.7	Very high	115 Å²	115	64.6 Å²	64.6	54%	0.537	32%	0.324	S	S	.	.	S	Bend	trans	-102.4	155.6	173.4	-49.8	-57.5	-16.2	0	0	110	E368 D369	Q366-E368 VanDerWaalsContact C-N 3.33Å; Q366-D369 HydrophobicContact CB-CB 4.46Å; Q366-D369 WeakPolarHBondContact CB-OD2 3.5Å; Q366-D369 WeakPolarHBondContact CG-OD2 3.44Å
367	L	94.6	Very high	97	Very high	77 Å²	77	60.2 Å²	60.2	40%	0.403	30%	0.301	S	S	.	.	H	α-helix	trans	-70.3	-38.1	176.4	175.3	62.7	0	0	0	110.5	A224 L225 A370 C371	A224-L367 HydrophobicContact CB-CD1 3.84Å; A224-L367 HydrophobicContact CB-CD2 3.9Å; L225-L367 HydrophobicContact CD2-CD1 4.16Å; L367-A370 PolarHBondContact O-N 2.85Å; L367-C371 VanDerWaalsContact O-CB 3.3Å; L367-C371 WeakPolarHBondContact O-CB 3.34Å; L367-C371 PolarHBondContact O-N 2.98Å; L367-C371 PolarHBondContact O-SG 2.9Å
368	E	96.8	Very high	97.2	Very high	125 Å²	125	56.8 Å²	56.8	58%	0.584	28%	0.283	S	S	*	.	H	α-helix	trans	-62.3	-52	-175.9	-64.2	67.6	-153.9	0	0	111	Q366 A370 C371 E372	Q366-E368 VanDerWaalsContact C-N 3.33Å; E368-A370 PolarHBondContact O-N 3.4Å; E368-C371 WeakPolarHBondContact O-CB 3.48Å; E368-C371 PolarHBondContact O-N 3.35Å; E368-C371 VanDerWaalsContact O-N 3.17Å; E368-E372 PolarHBondContact O-N 2.96Å
369	D	97.9	Very high	97.2	Very high	81 Å²	81	57.6 Å²	57.6	43%	0.433	29%	0.287	S	S	.	.	H	α-helix	trans	-56.5	-47.1	176	-51.6	-16.9	0	0	0	111.5	E364 Q366 C371 E372 H373	E364-D369 HydrophobicContact CB-CB 3.78Å; E364-D369 HydrophobicContact CG-CB 3.88Å; Q366-D369 HydrophobicContact CB-CB 4.46Å; Q366-D369 WeakPolarHBondContact CB-OD2 3.5Å; Q366-D369 WeakPolarHBondContact CG-OD2 3.44Å; D369-C371 VanDerWaalsContact C-N 3.33Å; D369-C371 PolarHBondContact O-N 2.91Å; D369-E372 PolarHBondContact O-N 3.24Å; D369-H373 PolarHBondContact O-N 3.45Å
370	A	97.8	Very high	97.2	Very high	10 Å²	10	57 Å²	57	8%	0.083	29%	0.29	C	S	.	.	H	α-helix	trans	-66.8	-33.5	178.8	0	0	0	0	0	112.6	L362 E364 L367 E368 L374	L362-A370 HydrophobicContact CB-CB 4.4Å; L362-A370 HydrophobicContact CD1-CB 4.49Å; E364-A370 HydrophobicContact CB-CB 4.24Å; E364-A370 WeakPolarHBondContact OE2-CB 3.46Å; L367-A370 PolarHBondContact O-N 2.85Å; E368-A370 PolarHBondContact O-N 3.4Å; A370-L374 VanDerWaalsContact O-CB 3.3Å; A370-L374 WeakPolarHBondContact O-CB 3.43Å; A370-L374 PolarHBondContact O-N 2.74Å; A370-L374 VanDerWaalsContact O-N 3.11Å
371	C	98	Very high	97.1	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.034	29%	0.292	C	S	.	.	H	α-helix	trans	-69.8	-39.8	174.4	-74.3	0	0	0	0	111.8	F228 L367 E368 D369 A375	F228-C371 HydrophobicContact CD1-CB 3.61Å; F228-C371 HydrophobicContact CD2-CB 3.78Å; F228-C371 HydrophobicContact CE1-CB 3.6Å; F228-C371 WeakPolarHBondContact CE1-O 3.36Å; F228-C371 HydrophobicContact CE2-CB 3.76Å; F228-C371 HydrophobicContact CG-CB 3.7Å; F228-C371 VanDerWaalsContact CG-SG 3.51Å; F228-C371 HydrophobicContact CZ-CB 3.67Å; F228-C371 WeakPolarHBondContact CZ-O 3.47Å; L367-C371 VanDerWaalsContact O-CB 3.3Å; L367-C371 WeakPolarHBondContact O-CB 3.34Å; L367-C371 PolarHBondContact O-N 2.98Å; L367-C371 PolarHBondContact O-SG 2.9Å; E368-C371 WeakPolarHBondContact O-CB 3.48Å; E368-C371 PolarHBondContact O-N 3.35Å; E368-C371 VanDerWaalsContact O-N 3.17Å; D369-C371 VanDerWaalsContact C-N 3.33Å; D369-C371 PolarHBondContact O-N 2.91Å; C371-A375 VanDerWaalsContact O-CB 3.29Å; C371-A375 WeakPolarHBondContact O-CB 3.4Å; C371-A375 PolarHBondContact O-N 3.37Å
372	E	97.8	Very high	97	Very high	132 Å²	132	57.8 Å²	57.8	62%	0.617	29%	0.289	S	S	*	.	H	α-helix	trans	-66.2	-49.3	176.8	-172.3	162.5	-134	0	0	111.4	E368 D369 L374 A375 D376	E368-E372 PolarHBondContact O-N 2.96Å; D369-E372 PolarHBondContact O-N 3.24Å; E372-L374 VanDerWaalsContact C-N 3.34Å; E372-L374 PolarHBondContact O-N 3.42Å; E372-A375 PolarHBondContact O-N 2.91Å; E372-A375 VanDerWaalsContact O-N 3.08Å; E372-D376 PolarHBondContact O-N 3.12Å
373	H	98.4	Very high	96.9	Very high	78 Å²	78	63 Å²	63	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-56.3	-45.4	175	179.6	-170.9	0	0	0	112	I361 L362 E364 D369 A375 D376 Y377	I361-H373 PolarHBondContact O-CE1 3.4Å; I361-H373 VanDerWaalsContact O-CE1 3.31Å; L362-H373 HydrophobicContact CD2-CB 4.1Å; E364-H373 IonicContact OE1-CE1 3.58Å; E364-H373 IonicContact OE1-CG 3.64Å; E364-H373 IonicContact OE1-ND1 2.82Å; E364-H373 PolarHBondContact OE1-ND1 3.05Å; D369-H373 PolarHBondContact O-N 3.45Å; H373-A375 PolarHBondContact O-N 3.31Å; H373-D376 PolarHBondContact O-N 3.48Å; H373-Y377 PolarHBondContact O-N 2.96Å
374	L	98.1	Very high	96.8	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-36.6	176.5	-176.7	57.2	0	0	0	112.7	L225 L229 V315 L362 A370 E372 L378	L225-L374 HydrophobicContact CD2-CD2 4.44Å; L229-L374 HydrophobicContact CD1-CD2 4.06Å; L229-L374 HydrophobicContact CD2-CD2 4.1Å; L229-L374 HydrophobicContact CD2-CG 4.23Å; L229-L374 HydrophobicContact CG-CD2 4.25Å; V315-L374 HydrophobicContact CG1-CD1 3.91Å; V315-L374 HydrophobicContact CG1-CD2 4.48Å; V315-L374 HydrophobicContact CG2-CD1 3.76Å; L362-L374 HydrophobicContact CD1-CB 4.18Å; L362-L374 HydrophobicContact CD1-CD2 4.2Å; L362-L374 HydrophobicContact CD2-CB 4.2Å; A370-L374 VanDerWaalsContact O-CB 3.3Å; A370-L374 WeakPolarHBondContact O-CB 3.43Å; A370-L374 PolarHBondContact O-N 2.74Å; A370-L374 VanDerWaalsContact O-N 3.11Å; E372-L374 VanDerWaalsContact C-N 3.34Å; E372-L374 PolarHBondContact O-N 3.42Å; L374-L378 HydrophobicContact CD1-CD1 4.06Å; L374-L378 HydrophobicContact CD1-CG 4.31Å; L374-L378 HydrophobicContact CG-CD1 4.11Å; L374-L378 WeakPolarHBondContact O-CB 3.43Å; L374-L378 VanDerWaalsContact O-CG 3.29Å; L374-L378 WeakPolarHBondContact O-CG 3.3Å; L374-L378 PolarHBondContact O-N 2.89Å; L374-L378 VanDerWaalsContact O-N 3.16Å
375	A	97.9	Very high	96.7	Very high	2 Å²	2	57.9 Å²	57.9	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-44.8	177	0	0	0	0	0	111.9	F228 R232 F233 C371 E372 H373 Y377 L378 E379	F228-A375 HydrophobicContact CE1-CB 4.02Å; F228-A375 HydrophobicContact CZ-CB 4Å; R232-A375 HydrophobicContact CG-CB 4.32Å; F233-A375 HydrophobicContact CE2-CB 4.27Å; F233-A375 HydrophobicContact CZ-CB 4.24Å; C371-A375 VanDerWaalsContact O-CB 3.29Å; C371-A375 WeakPolarHBondContact O-CB 3.4Å; C371-A375 PolarHBondContact O-N 3.37Å; E372-A375 PolarHBondContact O-N 2.91Å; E372-A375 VanDerWaalsContact O-N 3.08Å; H373-A375 PolarHBondContact O-N 3.31Å; A375-Y377 PolarHBondContact O-N 2.83Å; A375-L378 PolarHBondContact O-N 3.42Å; A375-E379 WeakPolarHBondContact O-CG 3.15Å; A375-E379 PolarHBondContact O-N 3.33Å
376	D	98	Very high	96.6	Very high	101 Å²	101	53 Å²	53	54%	0.54	26%	0.26	S	S	.	.	H	α-helix	trans	-63.8	-41.2	-179.6	-87.2	-0.9	0	0	0	112	E372 H373 L378 E379 A380	E372-D376 PolarHBondContact O-N 3.12Å; H373-D376 PolarHBondContact O-N 3.48Å; D376-L378 PolarHBondContact O-N 3.34Å; D376-E379 PolarHBondContact O-N 3.47Å; D376-A380 WeakPolarHBondContact O-CB 3.28Å; D376-A380 PolarHBondContact O-N 3.46Å
377	Y	98.2	Very high	96	Very high	68 Å²	68	48.4 Å²	48.4	27%	0.267	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-45	172.1	-177.3	-84	0	0	0	111.7	I313 D359 V360 H373 A375 A380 Y381	I313-Y377 HydrophobicContact CD1-CE1 4.36Å; I313-Y377 HydrophobicContact CG2-CE1 3.9Å; D359-Y377 WeakPolarHBondContact O-CE2 3.34Å; V360-Y377 HydrophobicContact CG2-CD1 3.48Å; V360-Y377 VanDerWaalsContact CG2-CD1 3.48Å; V360-Y377 HydrophobicContact CG2-CD2 3.6Å; V360-Y377 HydrophobicContact CG2-CE1 3.77Å; V360-Y377 HydrophobicContact CG2-CE2 3.84Å; V360-Y377 HydrophobicContact CG2-CG 3.41Å; V360-Y377 VanDerWaalsContact CG2-CG 3.41Å; H373-Y377 PolarHBondContact O-N 2.96Å; A375-Y377 PolarHBondContact O-N 2.83Å; Y377-A380 PolarHBondContact O-N 2.65Å; Y377-Y381 WeakPolarHBondContact O-CB 3.22Å; Y377-Y381 PolarHBondContact O-N 3.33Å
378	L	97.8	Very high	95	Very high	1 Å²	1	50 Å²	50	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-72.7	-28.8	-178.7	-69.5	174.4	0	0	0	113.1	V205 L229 F233 I313 L374 A375 D376 W382	V205-L378 HydrophobicContact CG2-CD2 3.79Å; L229-L378 HydrophobicContact CD2-CD1 3.58Å; F233-L378 HydrophobicContact CE1-CB 4.25Å; F233-L378 HydrophobicContact CE2-CB 4.29Å; F233-L378 HydrophobicContact CE2-CD1 4.28Å; F233-L378 HydrophobicContact CZ-CB 3.72Å; I313-L378 HydrophobicContact CD1-CD2 4.47Å; L374-L378 HydrophobicContact CD1-CD1 4.06Å; L374-L378 HydrophobicContact CD1-CG 4.31Å; L374-L378 HydrophobicContact CG-CD1 4.11Å; L374-L378 WeakPolarHBondContact O-CB 3.43Å; L374-L378 VanDerWaalsContact O-CG 3.29Å; L374-L378 WeakPolarHBondContact O-CG 3.3Å; L374-L378 PolarHBondContact O-N 2.89Å; L374-L378 VanDerWaalsContact O-N 3.16Å; A375-L378 PolarHBondContact O-N 3.42Å; D376-L378 PolarHBondContact O-N 3.34Å; L378-W382 VanDerWaalsContact O-CB 3.31Å; L378-W382 WeakPolarHBondContact O-CB 3.34Å; L378-W382 PolarHBondContact O-N 2.87Å
379	E	96.6	Very high	93.3	Very high	36 Å²	36	46 Å²	46	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-73.4	-36.2	170.8	-70.7	-71.9	-166.8	0	0	112.1	F233 R236 A375 D376 W382 K383	F233-E379 HydrophobicContact CE1-CG 3.88Å; F233-E379 HydrophobicContact CZ-CG 4.1Å; R236-E379 IonicContact CZ-OE1 2.77Å; R236-E379 IonicContact CZ-OE2 3.17Å; R236-E379 IonicContact NH1-OE1 3.92Å; R236-E379 PolarHBondContact NH1-OE1 3Å; R236-E379 IonicContact NH1-OE2 3.41Å; R236-E379 PolarHBondContact NH1-OE2 2.81Å; R236-E379 IonicContact NH2-OE1 3.38Å; R236-E379 PolarHBondContact NH2-OE1 2.88Å; R236-E379 IonicContact NH2-OE2 3.88Å; A375-E379 WeakPolarHBondContact O-CG 3.15Å; A375-E379 PolarHBondContact O-N 3.33Å; D376-E379 PolarHBondContact O-N 3.47Å; E379-W382 WeakPolarHBondContact O-CB 3.25Å; E379-W382 PolarHBondContact O-N 3.44Å; E379-K383 WeakPolarHBondContact O-CD 3.37Å; E379-K383 VanDerWaalsContact O-CG 3.26Å; E379-K383 WeakPolarHBondContact O-CG 3.37Å; E379-K383 PolarHBondContact O-N 2.84Å
380	A	96	Very high	91.3	Very high	39 Å²	39	45.1 Å²	45.1	32%	0.322	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-43.3	169.4	0	0	0	0	0	111.3	D376 Y377 W382 K383 A384	D376-A380 WeakPolarHBondContact O-CB 3.28Å; D376-A380 PolarHBondContact O-N 3.46Å; Y377-A380 PolarHBondContact O-N 2.65Å; A380-W382 VanDerWaalsContact C-N 3.34Å; A380-W382 PolarHBondContact O-N 3.38Å; A380-K383 PolarHBondContact O-N 3.38Å; A380-A384 VanDerWaalsContact O-CB 3.27Å; A380-A384 WeakPolarHBondContact O-CB 3.45Å; A380-A384 PolarHBondContact O-N 2.95Å
381	Y	97.1	Very high	88.8	Confident	23 Å²	23	48.5 Å²	48.5	9%	0.09	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-36.9	173.2	-176.3	-116.1	0	0	0	112.5	V109 M202 R203 L291 I313 Y377 A384 T385	V109-Y381 HydrophobicContact CG1-CE2 4.21Å; M202-Y381 HydrophobicContact CE-CD1 4.34Å; M202-Y381 HydrophobicContact CE-CE1 3.79Å; M202-Y381 HydrophobicContact SD-CE1 4.43Å; R203-Y381 WeakPolarHBondContact CG-OH 3.48Å; R203-Y381 PolarHBondContact N-OH 2.75Å; L291-Y381 HydrophobicContact CD2-CD1 4.09Å; L291-Y381 HydrophobicContact CD2-CE1 4.49Å; I313-Y381 HydrophobicContact CD1-CD1 3.63Å; I313-Y381 HydrophobicContact CD1-CD2 4.35Å; I313-Y381 HydrophobicContact CD1-CE1 3.68Å; I313-Y381 HydrophobicContact CD1-CE2 4.42Å; I313-Y381 HydrophobicContact CD1-CG 4Å; Y377-Y381 WeakPolarHBondContact O-CB 3.22Å; Y377-Y381 PolarHBondContact O-N 3.33Å; Y381-A384 PolarHBondContact O-N 2.96Å; Y381-T385 HydrophobicContact CD2-CG2 4.26Å; Y381-T385 HydrophobicContact CE1-CG2 4.14Å; Y381-T385 HydrophobicContact CE2-CG2 3.69Å; Y381-T385 WeakPolarHBondContact O-CB 3.44Å; Y381-T385 WeakPolarHBondContact O-CG2 3.46Å; Y381-T385 PolarHBondContact O-N 2.7Å; Y381-T385 PolarHBondContact O-OG1 2.91Å
382	W	95.8	Very high	86	Confident	47 Å²	47	54.9 Å²	54.9	18%	0.178	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-46.9	174.4	-175.1	-95.3	0	0	0	111.9	M202 R236 L289 L291 L378 E379 A380 T385 H386	M202-W382 HydrophobicContact CE-CE3 4.27Å; M202-W382 HydrophobicContact CE-CZ3 4.42Å; R236-W382 HydrophobicContact CB-CH2 3.9Å; R236-W382 HydrophobicContact CB-CZ2 4.36Å; R236-W382 HydrophobicContact CB-CZ3 4.06Å; R236-W382 HydrophobicContact CG-CH2 3.91Å; R236-W382 HydrophobicContact CG-CZ2 3.91Å; L289-W382 WeakPolarHBondContact O-CZ3 3.22Å; L291-W382 HydrophobicContact CD1-CE3 4.31Å; L291-W382 HydrophobicContact CD2-CE3 4.14Å; L291-W382 HydrophobicContact CG-CE3 3.8Å; L291-W382 HydrophobicContact CG-CZ3 4.07Å; L378-W382 VanDerWaalsContact O-CB 3.31Å; L378-W382 WeakPolarHBondContact O-CB 3.34Å; L378-W382 PolarHBondContact O-N 2.87Å; E379-W382 WeakPolarHBondContact O-CB 3.25Å; E379-W382 PolarHBondContact O-N 3.44Å; A380-W382 VanDerWaalsContact C-N 3.34Å; A380-W382 PolarHBondContact O-N 3.38Å; W382-T385 WeakPolarHBondContact CA-OG1 3.22Å; W382-T385 PolarHBondContact O-N 3.19Å; W382-T385 PolarHBondContact O-OG1 3.29Å; W382-H386 AromaticContact CD2-CE1 3.71Å; W382-H386 AromaticContact CD2-ND1 3.6Å; W382-H386 AromaticContact CE2-CE1 3.65Å; W382-H386 AromaticContact CE2-CG 3.98Å; W382-H386 AromaticContact CE2-ND1 3.6Å; W382-H386 AromaticContact CE3-CE1 3.6Å; W382-H386 AromaticContact CE3-ND1 3.9Å; W382-H386 AromaticContact CH2-CE1 3.43Å; W382-H386 VanDerWaalsContact CH2-CE1 3.43Å; W382-H386 WeakPolarHBondContact CH2-CE1 3.44Å; W382-H386 AromaticContact CH2-NE2 3.59Å; W382-H386 AromaticContact CZ2-CE1 3.53Å; W382-H386 AromaticContact CZ2-ND1 3.92Å; W382-H386 AromaticContact CZ2-NE2 3.59Å; W382-H386 AromaticContact CZ3-CE1 3.47Å; W382-H386 VanDerWaalsContact CZ3-CE1 3.47Å; W382-H386 WeakPolarHBondContact CZ3-CE1 3.3Å; W382-H386 AromaticContact NE1-ND1 4Å; W382-H386 VanDerWaalsContact O-CB 3.31Å; W382-H386 WeakPolarHBondContact O-CB 3.28Å; W382-H386 PolarHBondContact O-N 3.35Å; W382-H386 PolarHBondContact O-ND1 2.6Å
383	K	94.4	Very high	83.3	Confident	113 Å²	113	54 Å²	54	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-64.6	-41.4	174.5	-65.5	157.9	-171.4	166	0	112.2	E111 E379 A380 T385 H386	E111-K383 HydrophobicContact CG-CB 3.98Å; E111-K383 VanDerWaalsContact OE1-CB 3.29Å; E111-K383 WeakPolarHBondContact OE1-CB 3.34Å; E111-K383 WeakPolarHBondContact OE1-CD 3.33Å; E379-K383 WeakPolarHBondContact O-CD 3.37Å; E379-K383 VanDerWaalsContact O-CG 3.26Å; E379-K383 WeakPolarHBondContact O-CG 3.37Å; E379-K383 PolarHBondContact O-N 2.84Å; A380-K383 PolarHBondContact O-N 3.38Å; K383-T385 PolarHBondContact O-N 3.07Å; K383-H386 CarbonylContact O-C 3.5Å; K383-H386 PolarHBondContact O-N 2.94Å
384	A	94.6	Very high	80.5	Confident	10 Å²	10	55.3 Å²	55.3	8%	0.083	31%	0.312	C	S	.	.	H	α-helix	trans	-62.6	-27.8	177.1	0	0	0	0	0	112.7	R107 E111 A380 Y381	R107-A384 PolarHBondContact NH1-O 3.43Å; R107-A384 PolarHBondContact NH2-O 3.49Å; E111-A384 HydrophobicContact CG-CB 4.25Å; A380-A384 VanDerWaalsContact O-CB 3.27Å; A380-A384 WeakPolarHBondContact O-CB 3.45Å; A380-A384 PolarHBondContact O-N 2.95Å; Y381-A384 PolarHBondContact O-N 2.96Å
385	T	94.5	Very high	78.1	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-91.6	-29.5	176.2	47.8	0	0	0	0	113.6	V109 M202 Y381 W382 K383 P387	V109-T385 HydrophobicContact CG1-CG2 3.48Å; V109-T385 VanDerWaalsContact CG1-CG2 3.48Å; M202-T385 HydrophobicContact CE-CG2 4.09Å; M202-T385 HydrophobicContact SD-CG2 3.57Å; M202-T385 VanDerWaalsContact SD-CG2 3.57Å; Y381-T385 HydrophobicContact CD2-CG2 4.26Å; Y381-T385 HydrophobicContact CE1-CG2 4.14Å; Y381-T385 HydrophobicContact CE2-CG2 3.69Å; Y381-T385 WeakPolarHBondContact O-CB 3.44Å; Y381-T385 WeakPolarHBondContact O-CG2 3.46Å; Y381-T385 PolarHBondContact O-N 2.7Å; Y381-T385 PolarHBondContact O-OG1 2.91Å; W382-T385 WeakPolarHBondContact CA-OG1 3.22Å; W382-T385 PolarHBondContact O-N 3.19Å; W382-T385 PolarHBondContact O-OG1 3.29Å; K383-T385 PolarHBondContact O-N 3.07Å; T385-P387 WeakPolarHBondContact O-CD 3.47Å
386	H	92	Very high	75.7	Confident	49 Å²	49	65.6 Å²	65.6	23%	0.227	37%	0.371	C	S	.	.	S	Bend	trans	-111.1	82.4	-178.2	-63.5	79.3	0	0	0	112.2	L289 W382 K383	L289-H386 PolarHBondContact O-CE1 3.4Å; L289-H386 PolarHBondContact O-NE2 3.31Å; W382-H386 AromaticContact CD2-CE1 3.71Å; W382-H386 AromaticContact CD2-ND1 3.6Å; W382-H386 AromaticContact CE2-CE1 3.65Å; W382-H386 AromaticContact CE2-CG 3.98Å; W382-H386 AromaticContact CE2-ND1 3.6Å; W382-H386 AromaticContact CE3-CE1 3.6Å; W382-H386 AromaticContact CE3-ND1 3.9Å; W382-H386 AromaticContact CH2-CE1 3.43Å; W382-H386 VanDerWaalsContact CH2-CE1 3.43Å; W382-H386 WeakPolarHBondContact CH2-CE1 3.44Å; W382-H386 AromaticContact CH2-NE2 3.59Å; W382-H386 AromaticContact CZ2-CE1 3.53Å; W382-H386 AromaticContact CZ2-ND1 3.92Å; W382-H386 AromaticContact CZ2-NE2 3.59Å; W382-H386 AromaticContact CZ3-CE1 3.47Å; W382-H386 VanDerWaalsContact CZ3-CE1 3.47Å; W382-H386 WeakPolarHBondContact CZ3-CE1 3.3Å; W382-H386 AromaticContact NE1-ND1 4Å; W382-H386 VanDerWaalsContact O-CB 3.31Å; W382-H386 WeakPolarHBondContact O-CB 3.28Å; W382-H386 PolarHBondContact O-N 3.35Å; W382-H386 PolarHBondContact O-ND1 2.6Å; K383-H386 CarbonylContact O-C 3.5Å; K383-H386 PolarHBondContact O-N 2.94Å
387	P	83.6	Confident	73.2	Confident	18 Å²	18	66.4 Å²	66.4	12%	0.117	37%	0.374	C	S	.	.			trans	-65.5	145.5	176.8	29.3	-35.5	0	0	0	110.9	T385 S389 S390	T385-P387 WeakPolarHBondContact O-CD 3.47Å; P387-S389 PolarHBondContact O-N 2.95Å; P387-S390 WeakPolarHBondContact O-CB 3.32Å; P387-S390 PolarHBondContact O-N 3.39Å; P387-S390 PolarHBondContact O-OG 3.12Å
388	P	73.6	Confident	70.6	Confident	110 Å²	110	66.8 Å²	66.8	71%	0.714	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-64.8	-17.9	-174.1	24.4	-34.3	0	0	0	114.2	S390 S391	P388-S390 PolarHBondContact O-N 2.94Å; P388-S391 PolarHBondContact O-N 3.16Å; P388-S391 PolarHBondContact O-OG 2.79Å
389	S	61.1	Low	68.1	Low	42 Å²	42	75.6 Å²	75.6	29%	0.294	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-71.5	-13.8	172	51.9	0	0	0	0	113.9	P387	P387-S389 PolarHBondContact O-N 2.95Å
390	S	56.3	Low	65.5	Low	61 Å²	61	78.4 Å²	78.4	43%	0.427	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-85.7	-19.6	171.9	67.3	0	0	0	0	113.4	P387 P388 L392	P387-S390 WeakPolarHBondContact O-CB 3.32Å; P387-S390 PolarHBondContact O-N 3.39Å; P387-S390 PolarHBondContact O-OG 3.12Å; P388-S390 PolarHBondContact O-N 2.94Å; S390-L392 PolarHBondContact O-N 2.88Å
391	S	45.4	Very low	63.1	Low	81 Å²	81	83.4 Å²	83.4	57%	0.566	46%	0.46	S	S	*	.			trans	-99.7	40.9	-176.4	57.8	0	0	0	0	113.6	P388 P393	P388-S391 PolarHBondContact O-N 3.16Å; P388-S391 PolarHBondContact O-OG 2.79Å; S391-P393 WeakPolarHBondContact O-CD 3.29Å
392	L	38.5	Very low	60.6	Low	140 Å²	140	85.7 Å²	85.7	73%	0.733	48%	0.484	S	S	*	.			trans	-94.2	92.6	166.5	-74	175.6	0	0	0	109.6	S390 N394	S390-L392 PolarHBondContact O-N 2.88Å; L392-N394 PolarHBondContact O-N 3.32Å; L392-N394 VanDerWaalsContact O-N 3.12Å
393	P	41.8	Very low	58	Low	112 Å²	112	88.4 Å²	88.4	73%	0.727	51%	0.506	S	S	*	.			trans	-65.1	114.8	171.5	27.9	-34.1	0	0	0	108.9	S391 P395	S391-P393 WeakPolarHBondContact O-CD 3.29Å; P393-P395 VanDerWaalsContact O-CD 3.24Å; P393-P395 WeakPolarHBondContact O-CD 3.45Å
394	N	40	Very low	55.4	Low	106 Å²	106	88 Å²	88	57%	0.567	52%	0.518	S	S	*	.			trans	-56.2	110.6	180	-118.8	-32.6	0	0	0	109.9	L392 L396 L397	L392-N394 PolarHBondContact O-N 3.32Å; L392-N394 VanDerWaalsContact O-N 3.12Å; N394-L396 PolarHBondContact O-N 3.02Å; N394-L397 HydrophobicContact CB-CD1 4.07Å; N394-L397 HydrophobicContact CB-CG 4.2Å; N394-L397 PolarHBondContact O-N 2.96Å
395	P	46.5	Very low	52.8	Low	90 Å²	90	91.9 Å²	91.9	58%	0.584	54%	0.544	S	S	*	.	H	α-helix	trans	-69.7	-6.3	-169.6	27.8	-35.3	0	0	0	113.7	P393 S398	P393-P395 VanDerWaalsContact O-CD 3.24Å; P393-P395 WeakPolarHBondContact O-CD 3.45Å; P395-S398 PolarHBondContact O-OG 3.4Å
396	L	47.2	Very low	50.2	Low	128 Å²	128	99.6 Å²	99.6	67%	0.67	58%	0.584	S	S	*	*	H	α-helix	trans	-80.5	-27.7	173.5	-57.4	178.7	0	0	0	112.5	N394 T400	N394-L396 PolarHBondContact O-N 3.02Å; L396-T400 PolarHBondContact O-OG1 2.94Å
397	L	46.8	Very low	47.4	Very low	118 Å²	118	102.9 Å²	102.9	62%	0.618	61%	0.61	S	S	*	*	H	α-helix	trans	-78.3	-42	179.2	-66.7	177.1	0	0	0	111.8	N394 R399 T400 L401	N394-L397 HydrophobicContact CB-CD1 4.07Å; N394-L397 HydrophobicContact CB-CG 4.2Å; N394-L397 PolarHBondContact O-N 2.96Å; L397-R399 VanDerWaalsContact C-N 3.31Å; L397-R399 PolarHBondContact O-N 3.24Å; L397-T400 PolarHBondContact O-N 3.44Å; L397-L401 PolarHBondContact O-N 3.37Å
398	S	43.6	Very low	45	Very low	76 Å²	76	110.4 Å²	110.4	53%	0.531	65%	0.648	S	S	.	*	H	α-helix	trans	-64.3	-33.3	176.4	49.3	0	0	0	0	112.8	P395 A402	P395-S398 PolarHBondContact O-OG 3.4Å; S398-A402 WeakPolarHBondContact O-CB 3.33Å; S398-A402 PolarHBondContact O-N 2.88Å
399	R	45.6	Very low	43	Very low	187 Å²	187	110.6 Å²	110.6	71%	0.706	65%	0.652	S	S	*	*	H	α-helix	trans	-63.2	-44.2	172.8	-176	169.6	-70.5	-142.1	-2.5	112	L397 L401 A402 T403	L397-R399 VanDerWaalsContact C-N 3.31Å; L397-R399 PolarHBondContact O-N 3.24Å; R399-L401 VanDerWaalsContact C-N 3.33Å; R399-L401 PolarHBondContact O-N 2.87Å; R399-A402 PolarHBondContact O-N 3.08Å; R399-A402 VanDerWaalsContact O-N 3.16Å; R399-T403 HydrophobicContact CG-CG2 4.41Å; R399-T403 WeakPolarHBondContact O-CG2 3.44Å; R399-T403 PolarHBondContact O-N 3.31Å; R399-T403 PolarHBondContact O-OG1 3.23Å; R399-T403 VanDerWaalsContact O-OG1 3.13Å
400	T	40.9	Very low	42.1	Very low	95 Å²	95	113.9 Å²	113.9	58%	0.583	67%	0.673	S	S	*	*	H	α-helix	trans	-64.1	-36.1	-174.7	-53.9	0	0	0	0	112.6	L396 L397 T403	L396-T400 PolarHBondContact O-OG1 2.94Å; L397-T400 PolarHBondContact O-N 3.44Å; T400-T403 PolarHBondContact O-OG1 2.9Å
401	L	46.3	Very low	40.7	Very low	143 Å²	143	117.2 Å²	117.2	75%	0.749	69%	0.69	S	S	*	*	H	α-helix	trans	-77.4	-25.2	176.1	-67.4	175.4	0	0	0	113.4	L397 R399	L397-L401 PolarHBondContact O-N 3.37Å; R399-L401 VanDerWaalsContact C-N 3.33Å; R399-L401 PolarHBondContact O-N 2.87Å
402	A	43	Very low	40.1	Very low	72 Å²	72	121.2 Å²	121.2	60%	0.595	71%	0.705	S	S	*	*	H	α-helix	trans	-81.2	-12.4	178.5	0	0	0	0	0	114	S398 R399	S398-A402 WeakPolarHBondContact O-CB 3.33Å; S398-A402 PolarHBondContact O-N 2.88Å; R399-A402 PolarHBondContact O-N 3.08Å; R399-A402 VanDerWaalsContact O-N 3.16Å
403	T	42.2	Very low	39.7	Very low	104 Å²	104	119 Å²	119	64%	0.638	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	6.8	-174	49	0	0	0	0	115.3	R399 T400	R399-T403 HydrophobicContact CG-CG2 4.41Å; R399-T403 WeakPolarHBondContact O-CG2 3.44Å; R399-T403 PolarHBondContact O-N 3.31Å; R399-T403 PolarHBondContact O-OG1 3.23Å; R399-T403 VanDerWaalsContact O-OG1 3.13Å; T400-T403 PolarHBondContact O-OG1 2.9Å
404	S	38.8	Very low	39.2	Very low	105 Å²	105	118.9 Å²	118.9	73%	0.734	71%	0.709	S	S	*	*	S	Bend	trans	-88.1	-7.7	178.1	61.6	0	0	0	0	114.3
405	S	40.1	Very low	38.6	Very low	90 Å²	90	120.8 Å²	120.8	63%	0.629	72%	0.719	S	S	*	*	S	Bend	trans	-125.6	81.5	-176.4	62.2	0	0	0	0	113.1
406	L	39.8	Very low	37.9	Very low	164 Å²	164	121.6 Å²	121.6	86%	0.859	73%	0.727	S	S	*	*			trans	-179.3	144	141.7	-98.7	167.9	0	0	0	110.1
407	P	34.4	Very low	37.1	Very low	118 Å²	118	125 Å²	125	77%	0.766	74%	0.739	S	S	*	*			trans	-72.9	149.5	178.5	-16.8	31.7	0	0	0	113.6
408	L	33.3	Very low	36.2	Very low	176 Å²	176	123.1 Å²	123.1	92%	0.921	75%	0.748	S	S	*	*			trans	-78.8	132.1	171.5	-69.5	168	0	0	0	111.4
409	S	31.2	Very low	35.6	Very low	115 Å²	115	124.2 Å²	124.2	80%	0.804	76%	0.756	S	S	*	*			trans	-121.3	128.7	164.6	-68.2	0	0	0	0	109.3
410	P	41.6	Very low	34.9	Very low	111 Å²	111	124.5 Å²	124.5	72%	0.721	77%	0.765	S	S	*	*			trans	-91.8	176.3	-175.7	37	-36.6	0	0	0	113.4
411	T	28.5	Very low	34.4	Very low	130 Å²	130	123.4 Å²	123.4	80%	0.798	77%	0.773	S	S	*	*			trans	73	146.9	173.2	72.9	0	0	0	0	115.7
412	L	31.6	Very low	33.7	Very low	165 Å²	165	123 Å²	123	86%	0.864	77%	0.771	S	S	*	*			cis	-154.4	162.1	-7.8	-123.9	168	0	0	0	109.1
413	A	30.3	Very low	33.3	Very low	93 Å²	93	125.6 Å²	125.6	77%	0.769	77%	0.772	S	S	*	*			trans	-150.5	116.8	172.6	0	0	0	0	0	112.9
414	S	30.5	Very low	32.8	Very low	111 Å²	111	130.1 Å²	130.1	78%	0.776	78%	0.777	S	S	*	*			trans	-175.4	147.2	143.7	-164.5	0	0	0	0	111.8
415	N	29.5	Very low	32.5	Very low	146 Å²	146	130.5 Å²	130.5	78%	0.781	78%	0.775	S	S	*	*			trans	-13.2	145.5	165.3	-54	-20.2	0	0	0	118.1
416	S	30.7	Very low	32	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	78%	0.779	S	S	*	*				-176.5	161	65	39.9	0	0	0	0	115.3
417	Q	31.1	Very low	31.6	Very low	198 Å²	198	134.8 Å²	134.8	93%	0.925	78%	0.776	S	S	*	*			trans	14.6	125.6	158.2	-62.2	173.2	-54.1	0	0	121
418	G	27.9	Very low	31.3	Very low	79 Å²	79	134.2 Å²	134.2	81%	0.814	78%	0.775	S	S	*	*			trans	-177.1	90.2	166.7	0	0	0	0	0	118.1
419	S	30	Very low	31.2	Very low	99 Å²	99	130 Å²	130	69%	0.692	77%	0.765	S	S	*	*			trans	17.7	130.7	151.2	-157.5	0	0	0	0	124.1
420	Q	30.7	Very low	32.4	Very low	193 Å²	193	129.9 Å²	129.9	90%	0.902	76%	0.762	S	S	*	*			trans	64.9	157.2	142.8	-73	172.9	-0.7	0	0	122.1
421	G	30.6	Very low	31.9	Very low	73 Å²	73	130.6 Å²	130.6	75%	0.753	76%	0.758	S	S	*	*			trans	93.6	82.8	170.6	0	0	0	0	0	114.3
422	D	32.4	Very low	32.1	Very low	133 Å²	133	134.8 Å²	134.8	71%	0.711	76%	0.759	S	S	*	*				81.8	117.3	52.6	-164.8	49.5	0	0	0	114.8
423	Q	34.8	Very low	32	Very low	128 Å²	128	132 Å²	132	60%	0.598	75%	0.753	S	S	*	*			trans	63.5	153.5	170.7	-63.9	178	89.6	0	0	116.8
424	R	31.9	Very low	31.9	Very low	199 Å²	199	132.1 Å²	132.1	75%	0.751	75%	0.754	S	S	*	*			cis	-167	166.9	-12.1	-114.3	177.2	-170.3	173.3	10.9	109.5
425	T	32.2	Very low	31.9	Very low	113 Å²	113	132 Å²	132	69%	0.693	75%	0.753	S	S	*	*			trans	29.8	142.9	144.9	62.7	0	0	0	0	121.6
426	D	29.8	Very low	31.9	Very low	132 Å²	132	134 Å²	134	71%	0.706	76%	0.758	S	S	*	*			cis	-161.8	172.4	-0.4	-133.2	-46	0	0	0	113.6
427	R	30.5	Very low	31.8	Very low	212 Å²	212	132.8 Å²	132.8	80%	0.8	76%	0.755	S	S	*	*			trans	-11.4	149.5	154.5	-80.8	165.2	151.1	-168.4	-7	122.4
428	S	28.9	Very low	31.9	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	75%	0.753	S	S	*	*			trans	73.1	129.4	139.2	-65	0	0	0	0	117.6
429	A	31.3	Very low	31.9	Very low	88 Å²	88	137.6 Å²	137.6	73%	0.727	76%	0.756	S	S	*	*			cis	65.3	153.8	32	0	0	0	0	0	114.4
430	P	55.8	Low	32	Very low	112 Å²	112	140.2 Å²	140.2	73%	0.727	76%	0.757	S	S	*	*			cis	-132.8	-143.7	-9.3	25.9	1.1	0	0	0	111.4
431	I	30.6	Very low	32.5	Very low	125 Å²	125	136.6 Å²	136.6	64%	0.641	75%	0.751	S	S	*	*			trans	102.4	104.6	144.7	-78.9	165.1	0	0	0	120.7
432	R	33.9	Very low	32.2	Very low	219 Å²	219	137.4 Å²	137.4	83%	0.826	74%	0.744	S	S	*	*			trans	67.7	164.3	137.6	-67.1	-178.9	-170.9	156.5	-0.5	121.1
433	S	28.7	Very low	32.3	Very low	105 Å²	105	138 Å²	138	73%	0.734	75%	0.753	S	S	*	*			cis	178.1	144.5	-37.7	-88.9	0	0	0	0	109.6
434	A	28	Very low	32.1	Very low	96 Å²	96	139 Å²	139	79%	0.793	76%	0.757	S	S	*	*			trans	65.3	164	168.8	0	0	0	0	0	115.6
435	S	30.2	Very low	32.6	Very low	108 Å²	108	135.3 Å²	135.3	76%	0.755	76%	0.759	S	S	*	*			cis	-152.9	170.9	3.9	-7.7	0	0	0	0	112.9
436	Q	29.1	Very low	32.5	Very low	190 Å²	190	134.4 Å²	134.4	89%	0.888	75%	0.753	S	S	*	*			trans	-29	162.8	154.9	-70.8	159.9	-62.4	0	0	117.9
437	A	30.2	Very low	32.5	Very low	81 Å²	81	137.3 Å²	137.3	67%	0.669	76%	0.76	S	S	*	*			cis	-174.2	175.2	-14	0	0	0	0	0	111.2
438	E	31.6	Very low	32.5	Very low	191 Å²	191	136.7 Å²	136.7	89%	0.893	76%	0.763	S	S	*	*			trans	67.7	159.3	167.6	-44	-160.5	145	0	0	115.4
439	E	29.1	Very low	32.5	Very low	186 Å²	186	137 Å²	137	87%	0.869	77%	0.765	S	S	*	*			cis	-144.5	170.9	14.5	-161.6	-178.3	164.2	0	0	111.4
440	E	32.8	Very low	32.5	Very low	154 Å²	154	140.2 Å²	140.2	72%	0.72	77%	0.765	S	S	*	*			trans	-86.2	158	177.6	-110.1	-85.6	134.8	0	0	112.3	S442	E440-S442 PolarHBondContact OE2-N 3.03Å
441	P	40.3	Very low	31.3	Very low	118 Å²	118	142.1 Å²	142.1	77%	0.766	76%	0.763	S	S	*	*				-157.3	132.2	91	37.6	-16.1	0	0	0	119.4
442	S	24.8	Very low	31.2	Very low	89 Å²	89	146.7 Å²	146.7	62%	0.622	77%	0.773	S	S	*	*				35	124.5	127.5	-172.6	0	0	0	0	122.3	E440	E440-S442 PolarHBondContact OE2-N 3.03Å
443	V	33.2	Very low	31.1	Very low	147 Å²	147	141.4 Å²	141.4	89%	0.891	77%	0.77	S	S	*	*				-162.5	145.9	120.9	-99	0	0	0	0	113.2
444	E	31.2	Very low	31.1	Very low	148 Å²	148	142.1 Å²	142.1	69%	0.692	77%	0.774	S	S	*	*			trans	-104.3	167.5	167.8	-156	-149.8	-127.5	0	0	110.3	V446	E444-V446 WeakPolarHBondContact OE2-CG2 3.42Å; E444-V446 PolarHBondContact OE2-N 2.93Å
445	P	42.4	Very low	31.1	Very low	121 Å²	121	142.6 Å²	142.6	79%	0.786	77%	0.772	S	S	*	*				-153.8	135.7	106	36.1	-16.9	0	0	0	119.4
446	V	30.8	Very low	31.1	Very low	94 Å²	94	143.6 Å²	143.6	57%	0.57	78%	0.779	S	S	*	*			trans	-6.6	133.3	146.3	-148.6	0	0	0	0	121	E444	E444-V446 WeakPolarHBondContact OE2-CG2 3.42Å; E444-V446 PolarHBondContact OE2-N 2.93Å
447	K	29.8	Very low	31.3	Very low	194 Å²	194	139 Å²	139	84%	0.843	77%	0.773	S	S	*	*				160.5	126.3	118.9	-83.6	154.8	-169.4	170.9	0	111.8
448	K	30.4	Very low	32.1	Very low	199 Å²	199	140.5 Å²	140.5	87%	0.865	78%	0.776	S	S	*	*				86.9	142.1	51.4	-105.5	-176.5	177.3	175.6	0	115.8
449	S	27.5	Very low	32.1	Very low	111 Å²	111	139.4 Å²	139.4	78%	0.776	77%	0.771	S	S	*	*			trans	99.9	146.7	172.1	-162.1	0	0	0	0	116.8
450	Q	31.5	Very low	32.2	Very low	156 Å²	156	139.7 Å²	139.7	73%	0.729	77%	0.772	S	S	*	*			cis	-166	144.9	-48.8	-116.6	-179.6	-35.8	0	0	112.3
451	H	30.3	Very low	32.2	Very low	152 Å²	152	138.3 Å²	138.3	70%	0.704	77%	0.769	S	S	*	*			trans	51.1	134	148	-69.8	-49.9	0	0	0	127
452	R	29.6	Very low	31.8	Very low	221 Å²	221	140.8 Å²	140.8	83%	0.834	77%	0.77	S	S	*	*			trans	88.3	101.7	131.7	-80.4	-179.9	178.3	-139.5	-0.4	123.4
453	S	30.8	Very low	32	Very low	109 Å²	109	148.4 Å²	148.4	76%	0.762	79%	0.785	S	S	*	*				60.7	110.5	110.4	-53	0	0	0	0	123
454	S	29.6	Very low	31.9	Very low	119 Å²	119	146.9 Å²	146.9	83%	0.832	78%	0.782	S	S	*	*			trans	162.8	161.1	138.7	41.5	0	0	0	0	109.9
455	S	28.7	Very low	31.8	Very low	107 Å²	107	143 Å²	143	75%	0.748	78%	0.781	S	S	*	*			cis	-178.3	128.5	-36.1	53.4	0	0	0	0	109
456	S	29.9	Very low	31.2	Very low	129 Å²	129	143.7 Å²	143.7	90%	0.902	78%	0.783	S	S	*	*			trans	-177.8	144.7	156.6	46.2	0	0	0	0	114.9
457	A	32.8	Very low	31.2	Very low	93 Å²	93	144 Å²	144	77%	0.769	79%	0.79	S	S	*	*			trans	-139.5	162.6	155.3	0	0	0	0	0	106.8
458	P	47.1	Very low	31.2	Very low	112 Å²	112	146.7 Å²	146.7	73%	0.727	79%	0.794	S	S	*	*				-152.8	149.9	106.8	34.1	-14.7	0	0	0	118
459	H	30.8	Very low	31.2	Very low	168 Å²	168	140.5 Å²	140.5	78%	0.778	79%	0.787	S	S	*	*			trans	25.7	135.9	141.2	-54.5	-70.9	0	0	0	124
460	H	32.4	Very low	31.6	Very low	192 Å²	192	143.9 Å²	143.9	89%	0.889	80%	0.796	S	S	*	*				-168.6	169.4	117.8	-98.1	-67.1	0	0	0	110.9
461	N	32.3	Very low	31.5	Very low	125 Å²	125	141.6 Å²	141.6	67%	0.668	80%	0.797	S	S	*	*				-144	166.9	-90.7	-152	19.7	0	0	0	111.3
462	H	32.7	Very low	31.6	Very low	170 Å²	170	144.3 Å²	144.3	79%	0.787	80%	0.801	S	S	*	*			trans	-52	156.1	-172	-47.5	-88	0	0	0	119.4
463	R	28.6	Very low	31.7	Very low	249 Å²	249	140 Å²	140	94%	0.94	79%	0.79	S	S	*	*				-158.8	171.2	118.7	-131.5	179.6	177.7	166.3	0.6	114.4
464	S	30.6	Very low	31.6	Very low	116 Å²	116	142.5 Å²	142.5	81%	0.811	79%	0.79	S	S	*	*			trans	-140.7	163.9	-172	52.1	0	0	0	0	111.9
465	G	29.1	Very low	31.6	Very low	66 Å²	66	142.1 Å²	142.1	68%	0.68	78%	0.782	S	S	*	*			trans	129.7	104.5	153.9	0	0	0	0	0	120.2
466	T	31	Very low	31.6	Very low	135 Å²	135	145.8 Å²	145.8	83%	0.828	79%	0.785	S	S	*	*			trans	56.1	111.6	132.5	47.3	0	0	0	0	124.3
467	S	29.8	Very low	31.8	Very low	101 Å²	101	145.2 Å²	145.2	71%	0.706	77%	0.772	S	S	*	*				98.7	149	114.6	79.8	0	0	0	0	123.2
468	R	30.9	Very low	31.9	Very low	250 Å²	250	146.4 Å²	146.4	94%	0.943	78%	0.775	S	S	*	*			trans	73.2	136	169.9	-57.5	175.7	175.4	166.5	-1.5	117.3
469	G	29	Very low	31.3	Very low	69 Å²	69	149.3 Å²	149.3	71%	0.711	78%	0.778	S	S	*	*			cis	172.8	141.1	-13.2	0	0	0	0	0	117.3
470	L	35.7	Very low	31.6	Very low	183 Å²	183	146.9 Å²	146.9	96%	0.958	78%	0.776	S	S	*	*			trans	60.8	126.7	138.7	-57.4	175.8	0	0	0	124.2
471	S	29.2	Very low	31.7	Very low	107 Å²	107	145.6 Å²	145.6	75%	0.748	77%	0.77	S	S	*	*			trans	-164.5	104.4	136.3	-164.8	0	0	0	0	109.5
472	R	32.3	Very low	31.7	Very low	210 Å²	210	145 Å²	145	79%	0.792	76%	0.763	S	S	*	*				72	139.4	103.8	-69	-173.8	80.8	177.9	2.7	116
473	Q	31.6	Very low	31.8	Very low	131 Å²	131	142.9 Å²	142.9	61%	0.612	77%	0.767	S	S	*	*			cis	-168.1	174.8	-12.3	-172.5	172.9	-14.3	0	0	110.5
474	E	29.7	Very low	32.1	Very low	161 Å²	161	141.1 Å²	141.1	75%	0.752	76%	0.761	S	S	*	*			trans	100.1	133.2	154.6	-55.5	-167.6	166.4	0	0	117.1
475	T	28.7	Very low	32	Very low	110 Å²	110	143.3 Å²	143.3	68%	0.675	76%	0.763	S	S	*	*			cis	-161.5	153.4	-10.5	12.1	0	0	0	0	111.8
476	F	29.8	Very low	32.3	Very low	185 Å²	185	145.2 Å²	145.2	81%	0.811	77%	0.767	S	S	*	*			trans	23.8	150.8	140	-88.1	-120.1	0	0	0	122
477	D	34.3	Very low	32.4	Very low	117 Å²	117	143.9 Å²	143.9	63%	0.626	77%	0.769	S	S	*	*			cis	-177.8	169.8	-23.6	-137.4	-23.5	0	0	0	110.6
478	S	34.9	Very low	32.4	Very low	118 Å²	118	148.6 Å²	148.6	83%	0.825	77%	0.773	S	S	*	*			trans	165.5	131.3	140.2	-78.9	0	0	0	0	114.2
479	E	34.3	Very low	32.6	Very low	172 Å²	172	143.5 Å²	143.5	80%	0.804	77%	0.769	S	S	*	*			trans	-96.3	165.3	176.9	-59.9	176.9	113.3	0	0	112.3
480	T	37.6	Very low	32.9	Very low	118 Å²	118	146.1 Å²	146.1	72%	0.724	76%	0.763	S	S	*	*				161.8	173	91.2	41.4	0	0	0	0	106.7
481	Q	33.1	Very low	33.1	Very low	164 Å²	164	143.3 Å²	143.3	77%	0.766	76%	0.756	S	S	*	*			cis	-168.8	172.3	-26.9	-103	-170	-79.9	0	0	103.8
482	E	31.9	Very low	33.3	Very low	113 Å²	113	146.9 Å²	146.9	53%	0.528	76%	0.758	S	S	.	*			cis	-163.7	143.8	-31	170.4	179.4	158.7	0	0	105.1	R484	E482-R484 IonicContact OE1-CZ 3.74Å; E482-R484 IonicContact OE1-NH1 2.77Å; E482-R484 PolarHBondContact OE1-NH1 2.9Å
483	S	35.1	Very low	33.4	Very low	125 Å²	125	145.1 Å²	145.1	87%	0.874	76%	0.759	S	S	*	*			trans	-158.4	136.7	157.7	-84.7	0	0	0	0	111.9
484	R	35.5	Very low	33.5	Very low	213 Å²	213	146.7 Å²	146.7	80%	0.804	77%	0.771	S	S	*	*			trans	-103.2	141.4	170.8	-63.1	169.5	163.8	99.1	-10.5	109.1	E482	E482-R484 IonicContact OE1-CZ 3.74Å; E482-R484 IonicContact OE1-NH1 2.77Å; E482-R484 PolarHBondContact OE1-NH1 2.9Å
485	D	28.7	Very low	33.7	Very low	161 Å²	161	148.4 Å²	148.4	86%	0.861	77%	0.772	S	S	*	*				-159.1	179.2	118.3	-144.6	-24.5	0	0	0	110.4
486	S	35.5	Very low	33.9	Very low	107 Å²	107	148.2 Å²	148.2	75%	0.748	78%	0.775	S	S	*	*			trans	-136.5	138.2	-160.6	55.8	0	0	0	0	113.6
487	A	32.2	Very low	34	Very low	107 Å²	107	146.8 Å²	146.8	88%	0.884	77%	0.771	S	S	*	*			trans	-148.5	137.3	169.7	0	0	0	0	0	111.4
488	Y	30.3	Very low	33.9	Very low	200 Å²	200	146.5 Å²	146.5	78%	0.784	77%	0.769	S	S	*	*			trans	-89.7	140.6	-167	-153.5	-100.5	0	0	0	112.4
489	V	35.9	Very low	33.9	Very low	143 Å²	143	148.2 Å²	148.2	87%	0.867	76%	0.764	S	S	*	*			trans	-157.2	134.7	133.3	173	0	0	0	0	108.4
490	E	35.4	Very low	33.8	Very low	123 Å²	123	145.8 Å²	145.8	58%	0.575	76%	0.76	S	S	*	*			trans	-120.5	136	175	176.4	-175.4	-112.2	0	0	109.4
491	P	39.8	Very low	33.4	Very low	125 Å²	125	146.6 Å²	146.6	81%	0.812	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-87.9	130.6	169.2	5	13.9	0	0	0	110.8
492	K	33.5	Very low	33.4	Very low	182 Å²	182	146.4 Å²	146.4	79%	0.791	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-96.6	143	173.5	-77.6	-167	171.6	-168.7	0	113.1
493	E	34.2	Very low	33.4	Very low	173 Å²	173	151.9 Å²	151.9	81%	0.808	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-85.9	159.1	159.2	-57.1	178.3	144.7	0	0	110.1
494	D	33.8	Very low	33.3	Very low	163 Å²	163	150.2 Å²	150.2	87%	0.872	77%	0.77	S	S	*	*			trans	-149.5	160.9	163.8	-125.4	-37.8	0	0	0	111
495	Y	32.7	Very low	33	Very low	197 Å²	197	144 Å²	144	77%	0.773	76%	0.76	S	S	*	*			trans	-113.2	157.1	-149.1	-104	-102.3	0	0	0	117.9
496	S	33.1	Very low	33.4	Very low	106 Å²	106	144.5 Å²	144.5	74%	0.741	76%	0.756	S	S	*	*			trans	68.1	158	156	-56.9	0	0	0	0	117.7
497	H	33.2	Very low	33.2	Very low	155 Å²	155	148.9 Å²	148.9	72%	0.718	76%	0.757	S	S	*	*			cis	-161.7	149	27.1	-161.7	21.7	0	0	0	111
498	D	30.8	Very low	33.2	Very low	111 Å²	111	149 Å²	149	59%	0.594	74%	0.742	S	S	*	*			trans	27.1	153.5	140	-62.7	30.2	0	0	0	121.9
499	H	35.3	Very low	33.5	Very low	155 Å²	155	149.2 Å²	149.2	72%	0.718	75%	0.75	S	S	*	*			cis	-171.5	154.7	-3.3	-119.1	-49.2	0	0	0	108
500	V	31.6	Very low	33.3	Very low	120 Å²	120	149.2 Å²	149.2	73%	0.727	75%	0.745	S	S	*	*			trans	65	143.5	141.9	167	0	0	0	0	118.1
501	D	30.1	Very low	33.3	Very low	136 Å²	136	151.2 Å²	151.2	73%	0.727	75%	0.754	S	S	*	*			cis	-147.3	-179.1	8.7	-141.2	-16.2	0	0	0	115.4
502	H	32.1	Very low	32.9	Very low	159 Å²	159	154.7 Å²	154.7	74%	0.736	75%	0.751	S	S	*	*			trans	-60.3	174.3	-177.1	-75.1	-72.3	0	0	0	121.7
503	Y	33	Very low	32.8	Very low	228 Å²	228	152.7 Å²	152.7	89%	0.894	75%	0.749	S	S	*	*			trans	99.5	157.2	151.8	-83.3	-72.8	0	0	0	119.7
504	A	32.3	Very low	32.7	Very low	90 Å²	90	152 Å²	152	74%	0.744	75%	0.746	S	S	*	*			trans	-142	170.3	-161.2	0	0	0	0	0	110.9
505	S	30.2	Very low	32.6	Very low	83 Å²	83	149.7 Å²	149.7	58%	0.58	74%	0.738	S	S	*	*				161.9	158.6	111.9	-160.7	0	0	0	0	113.5
506	H	35.4	Very low	32.7	Very low	171 Å²	171	149.5 Å²	149.5	79%	0.792	74%	0.744	S	S	*	*			trans	65.1	167.6	158.6	-57.2	-44.7	0	0	0	120
507	R	33	Very low	32.5	Very low	200 Å²	200	147.6 Å²	147.6	76%	0.755	74%	0.741	S	S	*	*			cis	-172.7	148.9	-43.4	-177.1	163.1	-178.9	178.3	-0.3	109.4
508	D	31.5	Very low	32.3	Very low	109 Å²	109	146 Å²	146	58%	0.583	75%	0.747	S	S	*	*			trans	6.9	127.3	162.1	-44.3	-22.9	0	0	0	119.5
509	H	35.8	Very low	32.3	Very low	205 Å²	205	145 Å²	145	95%	0.949	75%	0.749	S	S	*	*			trans	-144.9	161.6	143.2	-99.9	9	0	0	0	112
510	N	32	Very low	32.1	Very low	143 Å²	143	143.4 Å²	143.4	77%	0.765	75%	0.746	S	S	*	*			trans	-137.8	-179.2	-159.9	-142	-22.3	0	0	0	110.2
511	H	35.4	Very low	32.2	Very low	164 Å²	164	145.7 Å²	145.7	76%	0.759	75%	0.748	S	S	*	*			trans	76.5	154.9	171	-61.9	-50.3	0	0	0	118.2
512	R	31.8	Very low	32.4	Very low	198 Å²	198	149.7 Å²	149.7	75%	0.747	75%	0.753	S	S	*	*			cis	-173.5	131.7	-20.9	171	176.7	-177.9	-177.3	-3.1	111.4
513	D	32.3	Very low	32.4	Very low	141 Å²	141	151 Å²	151	75%	0.754	76%	0.759	S	S	*	*			trans	41.5	166.9	136.6	-140.4	-4.7	0	0	0	124.7
514	E	30.3	Very low	32.1	Very low	158 Å²	158	151.9 Å²	151.9	74%	0.738	76%	0.761	S	S	*	*			trans	86	171.2	163.5	-59.8	-161.7	103.6	0	0	121.6
515	T	33.5	Very low	32.1	Very low	115 Å²	115	155 Å²	155	71%	0.706	76%	0.76	S	S	*	*			trans	-140.5	-171.5	-141.7	63.9	0	0	0	0	115.8
516	H	33.4	Very low	32	Very low	193 Å²	193	156.9 Å²	156.9	89%	0.894	77%	0.773	S	S	*	*			trans	108.7	148.8	178	-59.6	-59.1	0	0	0	115
517	G	29	Very low	31.8	Very low	66 Å²	66	157.5 Å²	157.5	68%	0.68	77%	0.768	S	S	*	*			cis	164.4	146.3	-10.2	0	0	0	0	0	114
518	S	30.5	Very low	31.8	Very low	122 Å²	122	155.2 Å²	155.2	85%	0.853	77%	0.766	S	S	*	*			trans	65.4	161	175	-105.7	0	0	0	0	118
519	S	29.2	Very low	31.6	Very low	90 Å²	90	160.7 Å²	160.7	63%	0.629	78%	0.779	S	S	*	*			cis	-153.6	158	-3.8	-127.8	0	0	0	0	113.7
520	D	31.6	Very low	31.3	Very low	121 Å²	121	155.9 Å²	155.9	65%	0.647	77%	0.768	S	S	*	*			trans	38.3	133.3	149.5	-67.2	-86.9	0	0	0	124.5
521	H	34.8	Very low	31.2	Very low	167 Å²	167	159.6 Å²	159.6	77%	0.773	77%	0.771	S	S	*	*				-174.4	108.7	105.5	-90.4	-16.1	0	0	0	116
522	R	32.9	Very low	30.9	Very low	220 Å²	220	158.1 Å²	158.1	83%	0.83	77%	0.769	S	S	*	*			trans	49.1	130.5	138.2	-58.9	-176.6	179.5	-177.8	1.2	124
523	H	31.7	Very low	31	Very low	188 Å²	188	154.8 Å²	154.8	87%	0.87	77%	0.77	S	S	*	*			trans	-16.3	153.1	150.5	-60.2	-79.6	0	0	0	118.8
524	R	28.4	Very low	31.1	Very low	245 Å²	245	153.3 Å²	153.3	93%	0.925	76%	0.762	S	S	*	*				-170.1	153.2	64.7	-167.1	176.7	-170.3	164.3	3	114.3
525	E	30.7	Very low	31.2	Very low	156 Å²	156	154.8 Å²	154.8	73%	0.729	76%	0.761	S	S	*	*			trans	-77	156.8	173.9	-68.7	176.8	90.2	0	0	114.7
526	S	28.6	Very low	31.2	Very low	122 Å²	122	157.1 Å²	157.1	85%	0.853	76%	0.764	S	S	*	*			trans	-156.5	172.7	135.3	-163.4	0	0	0	0	111.4
527	R	32.1	Very low	31.3	Very low	184 Å²	184	156.8 Å²	156.8	69%	0.694	76%	0.763	S	S	*	*			trans	-130.6	169.3	-169.9	-61.4	178.4	-176.2	171.5	1.2	113.3
528	H	31.8	Very low	31.3	Very low	152 Å²	152	159.9 Å²	159.9	70%	0.704	76%	0.764	S	S	*	*			trans	92	108.1	151.7	-62.7	-60.1	0	0	0	121.9
529	R	28.5	Very low	31.7	Very low	225 Å²	225	161.6 Å²	161.6	85%	0.849	76%	0.758	S	S	*	*				63.5	121.9	120.9	-84.7	-172.9	176	171.8	-1.9	122.7
530	S	29.5	Very low	32.2	Very low	103 Å²	103	163.6 Å²	163.6	72%	0.72	76%	0.761	S	S	*	*				110.4	137.2	112.8	-78.9	0	0	0	0	121.8
531	R	28.5	Very low	32.4	Very low	221 Å²	221	162.8 Å²	162.8	83%	0.834	75%	0.754	S	S	*	*			trans	83	100.9	153.7	-73.3	-172.3	161.9	164.5	-3.6	121.6
532	D	30.3	Very low	32.2	Very low	133 Å²	133	160.4 Å²	160.4	71%	0.711	76%	0.755	S	S	*	*				53.4	150	108.8	-44.2	-29.4	0	0	0	123.3
533	V	34.5	Very low	32.2	Very low	128 Å²	128	154.5 Å²	154.5	78%	0.776	74%	0.74	S	S	*	*			trans	80.8	127.4	166.2	-169.6	0	0	0	0	113.7
534	D	32.8	Very low	32.2	Very low	110 Å²	110	152.6 Å²	152.6	59%	0.588	73%	0.729	S	S	*	*			cis	-151.5	168.2	37.1	-141.1	-17.5	0	0	0	116.6
535	R	33.6	Very low	32.5	Very low	190 Å²	190	149.5 Å²	149.5	72%	0.717	73%	0.725	S	S	*	*			trans	10.7	157.1	155.1	-76.9	154.9	-176.1	110.8	2.1	122.7
536	E	32.8	Very low	32.4	Very low	163 Å²	163	153.3 Å²	153.3	76%	0.762	73%	0.733	S	S	*	*			cis	151.5	131	-18.3	-103.8	-178.9	154.5	0	0	106.6
537	Q	35.5	Very low	32.4	Very low	186 Å²	186	151.6 Å²	151.6	87%	0.869	72%	0.721	S	S	*	*			trans	-160.8	117.4	155	-143.5	158.7	73.8	0	0	112.4
538	D	29.8	Very low	32.4	Very low	131 Å²	131	153 Å²	153	70%	0.701	73%	0.726	S	S	*	*			trans	28	133.1	158.3	-54.4	-45.5	0	0	0	123
539	H	38	Very low	32.4	Very low	158 Å²	158	153 Å²	153	73%	0.731	73%	0.726	S	S	*	*			cis	78.3	147.6	43.2	-68	-63.7	0	0	0	115
540	N	39.6	Very low	32.5	Very low	132 Å²	132	151.2 Å²	151.2	71%	0.706	72%	0.724	S	S	*	*			cis	-159.4	169.2	5.1	-129.4	4.2	0	0	0	112.1
541	E	36.9	Very low	32.5	Very low	104 Å²	104	151.7 Å²	151.7	49%	0.486	73%	0.728	S	S	.	*			cis	-127.1	-93.1	-15.2	-165.9	-145	118.6	0	0	112.3	N543 K544	E541-N543 WeakPolarHBondContact OE1-CA 3.05Å; E541-K544 IonicContact OE1-NZ 3.8Å; E541-K544 PolarHBondContact OE1-NZ 2.81Å; E541-K544 IonicContact OE2-NZ 3.33Å; E541-K544 PolarHBondContact OE2-NZ 2.85Å
542	C	30.3	Very low	32.4	Very low	118 Å²	118	149.6 Å²	149.6	80%	0.797	73%	0.725	S	S	*	*			cis	-165.3	142.5	-3.9	179	0	0	0	0	110.9
543	N	31.4	Very low	32.5	Very low	96 Å²	96	147.3 Å²	147.3	51%	0.513	71%	0.713	S	S	.	*			cis	-160.4	77.8	-25.1	-176.4	2.1	0	0	0	112.6	E541	E541-N543 WeakPolarHBondContact OE1-CA 3.05Å
544	K	33.6	Very low	32.4	Very low	148 Å²	148	151.4 Å²	151.4	64%	0.643	71%	0.714	S	S	*	*			trans	68.9	172.4	153.6	-52.2	178.3	-163.3	75.4	0	114.8	E541	E541-K544 IonicContact OE1-NZ 3.8Å; E541-K544 PolarHBondContact OE1-NZ 2.81Å; E541-K544 IonicContact OE2-NZ 3.33Å; E541-K544 PolarHBondContact OE2-NZ 2.85Å
545	Q	32.9	Very low	32.1	Very low	179 Å²	179	156.2 Å²	156.2	84%	0.836	73%	0.725	S	S	*	*			cis	-137.1	152.4	24.9	-61	168.4	-22.7	0	0	111
546	R	29.6	Very low	31.9	Very low	236 Å²	236	151.6 Å²	151.6	89%	0.891	72%	0.721	S	S	*	*				68	132.4	55.8	-125.9	-171.2	-169.6	-148.9	6.6	112.5
547	S	28.1	Very low	31.7	Very low	86 Å²	86	151.7 Å²	151.7	60%	0.601	72%	0.722	S	S	*	*			cis	-153	154.7	1.8	-157.7	0	0	0	0	108.9
548	R	32.2	Very low	31.4	Very low	215 Å²	215	151.4 Å²	151.4	81%	0.811	72%	0.717	S	S	*	*			cis	86.5	99.8	22.3	173.4	-132.7	-172.6	-135.9	9.8	116.2
549	H	31.5	Very low	31.3	Very low	150 Å²	150	152.3 Å²	152.3	69%	0.694	72%	0.722	S	S	*	*			trans	-170.2	134.9	151.1	-96	83.6	0	0	0	109.5
550	K	31.6	Very low	30.9	Very low	188 Å²	188	148.6 Å²	148.6	82%	0.817	73%	0.727	S	S	*	*				52.2	135.7	91	-67.8	-171.6	173.5	-178	0	115
551	S	28.1	Very low	30.4	Very low	114 Å²	114	151.1 Å²	151.1	80%	0.797	73%	0.734	S	S	*	*			cis	-148.2	164.9	27.5	-59.3	0	0	0	0	110.2
552	K	28.1	Very low	30.1	Very low	176 Å²	176	151.4 Å²	151.4	77%	0.765	74%	0.743	S	S	*	*			cis	85	91.6	32.6	-158.7	-114.6	179.2	-148	0	117.3
553	D	31.4	Very low	30.1	Very low	86 Å²	86	153.8 Å²	153.8	46%	0.46	75%	0.746	S	S	.	*				167.1	141.2	129.2	-105.9	11.2	0	0	0	116.2
554	R	31.8	Very low	30.1	Very low	213 Å²	213	154.3 Å²	154.3	80%	0.804	76%	0.757	S	S	*	*			trans	67.1	159.5	151.8	-61.7	169.5	-136.7	-160.4	5.3	118.6
555	Y	26.7	Very low	30	Very low	211 Å²	211	157.6 Å²	157.6	83%	0.827	77%	0.771	S	S	*	*			cis	-139.4	-170.1	1.4	-158.9	-111	0	0	0	112.2
556	C	29.2	Very low	30	Very low	93 Å²	93	158.3 Å²	158.3	63%	0.628	77%	0.772	S	S	*	*			trans	-110.8	175.9	-165	-54.6	0	0	0	0	116.4
557	E	29.1	Very low	29.9	Very low	166 Å²	166	156.3 Å²	156.3	78%	0.776	76%	0.764	S	S	*	*			trans	71.7	150.5	162.2	-68.3	178	173.9	0	0	117.1
558	K	28.6	Very low	29.9	Very low	179 Å²	179	158.8 Å²	158.8	78%	0.778	77%	0.771	S	S	*	*			cis	-154.1	-179.9	32.1	-149.9	161	-171.7	174.3	0	115.2
559	D	29.1	Very low	29.7	Very low	151 Å²	151	155.9 Å²	155.9	81%	0.807	77%	0.767	S	S	*	*			trans	-77.4	170.7	-169.3	-41.8	-92.4	0	0	0	116.8
560	G	28.4	Very low	29.5	Very low	80 Å²	80	153.6 Å²	153.6	83%	0.825	77%	0.774	S	S	*	*			trans	-175.7	95.6	174.3	0	0	0	0	0	115.5
561	E	30.3	Very low	29.3	Very low	184 Å²	184	148.4 Å²	148.4	86%	0.86	77%	0.773	S	S	*	*			trans	-60.9	137.2	179.8	-89.2	-173.2	113.8	0	0	115.9
562	V	30.1	Very low	29.1	Very low	110 Å²	110	152.2 Å²	152.2	67%	0.667	78%	0.778	S	S	*	*				68.1	127.9	94.9	177.3	0	0	0	0	116.5
563	I	30.7	Very low	29.1	Very low	168 Å²	168	155.4 Å²	155.4	86%	0.862	79%	0.786	S	S	*	*			trans	-166.9	143.1	133.4	-102.1	157.3	0	0	0	110.6
564	S	31	Very low	28.9	Very low	107 Å²	107	159 Å²	159	75%	0.748	81%	0.805	S	S	*	*			trans	-103	161.4	-178.4	-44.3	0	0	0	0	112.8
565	K	31.5	Very low	29.1	Very low	217 Å²	217	158.2 Å²	158.2	94%	0.943	80%	0.802	S	S	*	*			trans	-145.8	142.7	154.6	-114	168.8	-173.7	173.9	0	111.7
566	K	33.1	Very low	29.4	Very low	194 Å²	194	155.6 Å²	155.6	84%	0.843	80%	0.803	S	S	*	*			trans	-145.5	131.9	-173.8	173.3	-172.4	178.2	-176.6	0	108.5
567	R	27.3	Very low	29.6	Very low	194 Å²	194	156.2 Å²	156.2	73%	0.732	80%	0.803	S	S	*	*			trans	-155.1	134.9	159.1	-175.9	164.6	179.3	168.3	-6.3	109.4	E569	R567-E569 IonicContact CZ-OE1 2.68Å; R567-E569 IonicContact CZ-OE2 2.9Å; R567-E569 IonicContact NE-OE1 2.72Å; R567-E569 PolarHBondContact NE-OE1 2.59Å; R567-E569 IonicContact NE-OE2 2.64Å; R567-E569 VanDerWaalsContact NH2-CD 3.28Å; R567-E569 IonicContact NH2-OE1 2.72Å; R567-E569 PolarHBondContact NH2-OE1 3.47Å; R567-E569 IonicContact NH2-OE2 2.7Å; R567-E569 PolarHBondContact NH2-OE2 2.92Å
568	N	27.3	Very low	29.7	Very low	138 Å²	138	159.7 Å²	159.7	74%	0.738	81%	0.811	S	S	*	*			trans	-93.4	149.5	162.9	-70.1	8.7	0	0	0	108.1
569	E	27.6	Very low	30.1	Very low	155 Å²	155	158.2 Å²	158.2	72%	0.724	81%	0.81	S	S	*	*			trans	-147.1	165.9	148.3	-128.1	124.4	-100.8	0	0	107.6	R567	R567-E569 IonicContact CZ-OE1 2.68Å; R567-E569 IonicContact CZ-OE2 2.9Å; R567-E569 IonicContact NE-OE1 2.72Å; R567-E569 PolarHBondContact NE-OE1 2.59Å; R567-E569 IonicContact NE-OE2 2.64Å; R567-E569 VanDerWaalsContact NH2-CD 3.28Å; R567-E569 IonicContact NH2-OE1 2.72Å; R567-E569 PolarHBondContact NH2-OE1 3.47Å; R567-E569 IonicContact NH2-OE2 2.7Å; R567-E569 PolarHBondContact NH2-OE2 2.92Å
570	A	29.1	Very low	30.6	Very low	102 Å²	102	160.5 Å²	160.5	84%	0.843	81%	0.807	S	S	*	*			trans	-132.2	159.7	-166.3	0	0	0	0	0	112.9
571	G	26.1	Very low	30.8	Very low	79 Å²	79	166.9 Å²	166.9	81%	0.814	82%	0.816	S	S	*	*			trans	98.5	138.8	-162.2	0	0	0	0	0	109.7
572	E	25.2	Very low	30.9	Very low	193 Å²	193	166.1 Å²	166.1	90%	0.902	81%	0.814	S	S	*	*			cis	-145.1	143.3	11.5	-166.5	163.9	-135.9	0	0	109.6	N574	E572-N574 PolarHBondContact O-N 2.77Å
573	W	27.8	Very low	30.9	Very low	244 Å²	244	169 Å²	169	92%	0.924	82%	0.821	S	S	*	*			trans	-82.3	83.8	-173.9	-81.5	66.8	0	0	0	111.5	R575	W573-R575 PolarHBondContact O-N 3.38Å
574	N	27.3	Very low	30.9	Very low	162 Å²	162	169.1 Å²	169.1	87%	0.866	82%	0.819	S	S	*	*			trans	-75.4	121.4	170.2	-152.4	-2.3	0	0	0	110	E572	E572-N574 PolarHBondContact O-N 2.77Å
575	R	35.3	Very low	30.9	Very low	196 Å²	196	172.7 Å²	172.7	74%	0.74	82%	0.823	S	S	*	*			trans	-84.8	-174	175.2	-64.1	-176.6	179.3	-177.2	-1.2	109.7	W573	W573-R575 PolarHBondContact O-N 3.38Å
576	D	34	Very low	30.9	Very low	156 Å²	156	169.9 Å²	169.9	83%	0.834	82%	0.816	S	S	*	*			trans	72.6	41.8	160.3	-47	-25.5	0	0	0	118.7
577	V	32.5	Very low	30.7	Very low	106 Å²	106	168.3 Å²	168.3	64%	0.642	81%	0.814	S	S	*	*			trans	-139.1	72.9	158.8	-165.2	0	0	0	0	113.2
578	Y	31.4	Very low	30.9	Very low	238 Å²	238	166.5 Å²	166.5	93%	0.933	82%	0.82	S	S	*	*			trans	-144.9	59.5	167.3	-92.7	-69.6	0	0	0	114.5
579	I	36.7	Very low	31.2	Very low	148 Å²	148	168.7 Å²	168.7	76%	0.759	83%	0.826	S	S	*	*			trans	-132.3	124.7	143.3	-60.7	-175.7	0	0	0	107.5
580	R	39.2	Very low	31.5	Very low	200 Å²	200	169.8 Å²	169.8	76%	0.755	83%	0.834	S	S	*	*			trans	-165.1	149.9	-178.2	-98.4	-160	-170.4	-154.2	14.2	108.6
581	Q	33.8	Very low	31.8	Very low	214 Å²	214	176 Å²	176	100%	1	83%	0.834	S	S	*	*			cis	-158.3	0	-12.2	-155.5	169.1	-5.8	0	0	109.4

Retrieved 581 of 581 residues in 358.2 ms (Link to these results)

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