A0A096MKT4_PAPAN Loading...

Divergent protein kinase domain 1A

AlphaFold DB (A0A0D9S6R3), UniProt , Accession A0A096MKT4, Species PAPAN (Papio anubis, Olive baboon), Gene DIPK1A, Length 428 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	34.1	Very low	39.2	Very low	242 Å²	242	153.8 Å²	153.8	100%	1.192	87%	0.868	S	S	*	*				0	132	0	-74	177.8	-167.3	0	0	108.8
2	A	35.6	Very low	39.6	Very low	87 Å²	87	161.6 Å²	161.6	72%	0.719	87%	0.873	S	S	*	*			trans	53.5	111.6	160.4	0	0	0	0	0	120.3
3	R	36.6	Very low	40.2	Very low	249 Å²	249	164.2 Å²	164.2	94%	0.94	87%	0.872	S	S	*	*				81.9	135	100	-75	-178.3	175.8	-178.8	-1	112.4
4	S	33.7	Very low	40.9	Very low	102 Å²	102	159.1 Å²	159.1	71%	0.713	85%	0.852	S	S	*	*			cis	-167.8	135.6	30.5	52.5	0	0	0	0	110.6
5	L	38	Very low	41.5	Very low	162 Å²	162	162.6 Å²	162.6	85%	0.848	85%	0.851	S	S	*	*				60.8	106	104.3	-78.5	152.7	0	0	0	119.9
6	C	37.3	Very low	41.9	Very low	118 Å²	118	164.7 Å²	164.7	80%	0.797	85%	0.846	S	S	*	*				13.9	178.6	127.8	-61.9	0	0	0	0	122.3
7	P	51.8	Low	42.2	Very low	124 Å²	124	162.2 Å²	162.2	81%	0.805	83%	0.834	S	S	*	*				-141.8	-179.1	-60.6	42.7	-25.3	0	0	0	113.4
8	G	37.2	Very low	42.5	Very low	81 Å²	81	161.9 Å²	161.9	84%	0.835	83%	0.828	S	S	*	*			trans	95.6	114.5	137.3	0	0	0	0	0	120.2
9	A	36.3	Very low	42.9	Very low	102 Å²	102	156.9 Å²	156.9	84%	0.843	81%	0.814	S	S	*	*			trans	-139.2	113.5	157.3	0	0	0	0	0	110.1
10	W	41.9	Very low	43.3	Very low	255 Å²	255	159 Å²	159	97%	0.966	81%	0.81	S	S	*	*			trans	-110.2	132.9	168	-105.3	65.3	0	0	0	109.3
11	L	49.3	Very low	43.5	Very low	170 Å²	170	159 Å²	159	89%	0.89	81%	0.805	S	S	*	*			trans	-67	132.4	-177	-74.5	129.3	0	0	0	113.1
12	R	44	Very low	44.6	Very low	247 Å²	247	151.1 Å²	151.1	93%	0.932	77%	0.774	S	S	*	*			trans	-122.1	120.4	153.7	-86.8	-172.5	174.3	-172	-0.5	109.5
13	K	47.1	Very low	45.7	Very low	196 Å²	196	153.9 Å²	153.9	85%	0.852	77%	0.767	S	S	*	*			trans	-67.4	143.5	169.8	-93.5	178.3	174	176.4	0	110.5
14	P	49.4	Very low	46.9	Very low	92 Å²	92	145.2 Å²	145.2	60%	0.597	74%	0.741	S	S	*	*			trans	-91.6	122.8	-172.2	33.9	-30.8	0	0	0	112.9	Y16	P14-Y16 PolarHBondContact O-N 2.96Å; P14-Y16 VanDerWaalsContact O-N 3.11Å
15	Y	50	Low	48.5	Very low	212 Å²	212	149.3 Å²	149.3	83%	0.831	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-1.1	169.9	-85.8	-99	0	0	0	114.5
16	Y	48.3	Very low	50.2	Low	196 Å²	196	148 Å²	148	77%	0.769	73%	0.732	S	S	*	*	H	α-helix	trans	-78.3	-25.1	-171.2	-124.8	-94.7	0	0	0	114.4	P14	P14-Y16 PolarHBondContact O-N 2.96Å; P14-Y16 VanDerWaalsContact O-N 3.11Å
17	L	47.5	Very low	52.1	Low	123 Å²	123	147.1 Å²	147.1	64%	0.644	72%	0.715	S	S	*	*	H	α-helix	trans	-75.1	-28.4	-179.7	-97.4	133.9	0	0	0	113.2
18	Q	47	Very low	53.6	Low	157 Å²	157	149.3 Å²	149.3	73%	0.734	71%	0.708	S	S	*	*	H	α-helix	trans	-77.3	-32.9	-176.7	-163.1	157	-8.7	0	0	112.7	S22	Q18-S22 PolarHBondContact O-N 3.5Å
19	A	49.5	Very low	55.8	Low	67 Å²	67	150.7 Å²	150.7	55%	0.554	70%	0.696	S	S	*	*	H	α-helix	trans	-71.8	-36.7	177.3	0	0	0	0	0	113.2	S22 Y23	A19-S22 PolarHBondContact O-N 3.18Å; A19-Y23 PolarHBondContact O-N 2.98Å; A19-Y23 VanDerWaalsContact O-N 3.17Å
20	R	51.2	Low	58.2	Low	197 Å²	197	151.3 Å²	151.3	74%	0.743	68%	0.68	S	S	*	*	H	α-helix	trans	-65	-39.5	175.9	-105.3	-176.7	175.6	-179.6	-0.5	112.4	S22 Y23 V24	R20-S22 VanDerWaalsContact C-N 3.33Å; R20-S22 PolarHBondContact O-N 3.02Å; R20-Y23 PolarHBondContact O-N 2.94Å; R20-V24 VanDerWaalsContact O-CG2 3.26Å; R20-V24 WeakPolarHBondContact O-CG2 3.37Å; R20-V24 PolarHBondContact O-N 3.29Å; R20-V24 VanDerWaalsContact O-N 3.15Å
21	F	48.5	Very low	60.4	Low	161 Å²	161	145.2 Å²	145.2	71%	0.706	66%	0.66	S	S	*	*	H	α-helix	trans	-63.7	-37.6	174.8	-107.9	-87.1	0	0	0	112.3	R25	F21-R25 VanDerWaalsContact O-CB 3.31Å; F21-R25 WeakPolarHBondContact O-CB 3.45Å; F21-R25 PolarHBondContact O-N 3.23Å
22	S	57.2	Low	62.2	Low	75 Å²	75	140.5 Å²	140.5	52%	0.524	64%	0.641	S	S	.	*	H	α-helix	trans	-69	-38.6	179.7	-155.2	0	0	0	0	113	Q18 A19 R20 M26	Q18-S22 PolarHBondContact O-N 3.5Å; A19-S22 PolarHBondContact O-N 3.18Å; R20-S22 VanDerWaalsContact C-N 3.33Å; R20-S22 PolarHBondContact O-N 3.02Å; S22-M26 WeakPolarHBondContact O-CB 3.46Å; S22-M26 PolarHBondContact O-N 3.46Å
23	Y	58.1	Low	64.5	Low	146 Å²	146	136.1 Å²	136.1	57%	0.573	63%	0.625	S	S	*	*	H	α-helix	trans	-71.6	-38.5	177.9	-174.1	-107.2	0	0	0	112.6	A19 R20 M26 K27	A19-Y23 PolarHBondContact O-N 2.98Å; A19-Y23 VanDerWaalsContact O-N 3.17Å; R20-Y23 PolarHBondContact O-N 2.94Å; Y23-M26 PolarHBondContact O-N 3.44Å; Y23-K27 HydrophobicContact CD1-CD 4.34Å; Y23-K27 HydrophobicContact CE1-CD 3.95Å; Y23-K27 HydrophobicContact CE1-CG 4.47Å; Y23-K27 VanDerWaalsContact CZ-CE 3.45Å; Y23-K27 PolarHBondContact O-N 3.24Å; Y23-K27 VanDerWaalsContact OH-CE 3.31Å; Y23-K27 WeakPolarHBondContact OH-CE 3.41Å
24	V	61.6	Low	66.6	Low	67 Å²	67	129.9 Å²	129.9	41%	0.406	60%	0.601	S	S	.	*	H	α-helix	trans	-64.6	-43	174.1	172.1	0	0	0	0	110.6	R20 M26 K27 Y28	R20-V24 VanDerWaalsContact O-CG2 3.26Å; R20-V24 WeakPolarHBondContact O-CG2 3.37Å; R20-V24 PolarHBondContact O-N 3.29Å; R20-V24 VanDerWaalsContact O-N 3.15Å; V24-M26 PolarHBondContact O-N 2.92Å; V24-K27 PolarHBondContact O-N 3.35Å; V24-Y28 HydrophobicContact CG1-CD2 3.73Å; V24-Y28 HydrophobicContact CG1-CE2 3.31Å; V24-Y28 WeakPolarHBondContact O-CD2 3.16Å; V24-Y28 PolarHBondContact O-N 3.35Å; V24-Y28 VanDerWaalsContact O-N 3.08Å
25	R	68.1	Low	68.5	Low	188 Å²	188	128.7 Å²	128.7	71%	0.709	60%	0.598	S	S	*	*	H	α-helix	trans	-63.1	-39.7	175.2	-162.4	175.5	-174.1	-179.2	1.4	112.7	F21 Y28 L29	F21-R25 VanDerWaalsContact O-CB 3.31Å; F21-R25 WeakPolarHBondContact O-CB 3.45Å; F21-R25 PolarHBondContact O-N 3.23Å; R25-Y28 PolarHBondContact O-N 3.46Å; R25-L29 VanDerWaalsContact O-CG 3.29Å; R25-L29 WeakPolarHBondContact O-CG 3.07Å; R25-L29 PolarHBondContact O-N 3.36Å
26	M	72.8	Confident	70.5	Confident	134 Å²	134	123.2 Å²	123.2	66%	0.66	59%	0.587	S	S	*	*	H	α-helix	trans	-62	-41.9	172.5	-92.7	-78.1	-155.2	0	0	112.6	S22 Y23 V24 L29 F30	S22-M26 WeakPolarHBondContact O-CB 3.46Å; S22-M26 PolarHBondContact O-N 3.46Å; Y23-M26 PolarHBondContact O-N 3.44Å; V24-M26 PolarHBondContact O-N 2.92Å; M26-L29 PolarHBondContact O-N 3.06Å; M26-F30 WeakPolarHBondContact O-CB 3.32Å; M26-F30 PolarHBondContact O-N 3.02Å
27	K	77.9	Confident	72.5	Confident	100 Å²	100	118.5 Å²	118.5	44%	0.435	57%	0.57	S	S	.	*	H	α-helix	trans	-62.3	-46.3	175.9	-78.1	-174.8	167.8	179.8	0	112.2	Y23 V24 L29 F30 F31	Y23-K27 HydrophobicContact CD1-CD 4.34Å; Y23-K27 HydrophobicContact CE1-CD 3.95Å; Y23-K27 HydrophobicContact CE1-CG 4.47Å; Y23-K27 VanDerWaalsContact CZ-CE 3.45Å; Y23-K27 PolarHBondContact O-N 3.24Å; Y23-K27 VanDerWaalsContact OH-CE 3.31Å; Y23-K27 WeakPolarHBondContact OH-CE 3.41Å; V24-K27 PolarHBondContact O-N 3.35Å; K27-L29 VanDerWaalsContact C-N 3.34Å; K27-L29 PolarHBondContact O-N 3.11Å; K27-F30 PolarHBondContact O-N 3.19Å; K27-F31 HydrophobicContact CB-CE2 4.46Å; K27-F31 WeakPolarHBondContact O-CD2 3.5Å; K27-F31 PolarHBondContact O-N 2.86Å
28	Y	81.9	Confident	74.5	Confident	170 Å²	170	115.8 Å²	115.8	67%	0.667	56%	0.559	S	S	*	*	H	α-helix	trans	-64.5	-38.2	177.7	-72.9	-66.2	0	0	0	112.6	V24 R25 S32	V24-Y28 HydrophobicContact CG1-CD2 3.73Å; V24-Y28 HydrophobicContact CG1-CE2 3.31Å; V24-Y28 WeakPolarHBondContact O-CD2 3.16Å; V24-Y28 PolarHBondContact O-N 3.35Å; V24-Y28 VanDerWaalsContact O-N 3.08Å; R25-Y28 PolarHBondContact O-N 3.46Å; Y28-S32 VanDerWaalsContact O-CB 3.24Å; Y28-S32 WeakPolarHBondContact O-CB 3.35Å; Y28-S32 PolarHBondContact O-N 2.74Å
29	L	84.1	Confident	76.4	Confident	109 Å²	109	109.6 Å²	109.6	57%	0.571	54%	0.537	S	S	*	.	H	α-helix	trans	-64	-41.3	173.5	-72.6	169.9	0	0	0	112	R25 M26 K27 S32 W33	R25-L29 VanDerWaalsContact O-CG 3.29Å; R25-L29 WeakPolarHBondContact O-CG 3.07Å; R25-L29 PolarHBondContact O-N 3.36Å; M26-L29 PolarHBondContact O-N 3.06Å; K27-L29 VanDerWaalsContact C-N 3.34Å; K27-L29 PolarHBondContact O-N 3.11Å; L29-S32 PolarHBondContact O-N 2.79Å; L29-W33 VanDerWaalsContact O-CB 3.31Å; L29-W33 WeakPolarHBondContact O-CB 3.29Å; L29-W33 PolarHBondContact O-N 3.39Å
30	F	86.3	Confident	78.3	Confident	116 Å²	116	110 Å²	110	51%	0.509	54%	0.536	S	S	.	.	H	α-helix	trans	-63.8	-47.3	176	179.2	-98.2	0	0	0	112.3	M26 K27 S32 W33 L34	M26-F30 WeakPolarHBondContact O-CB 3.32Å; M26-F30 PolarHBondContact O-N 3.02Å; K27-F30 PolarHBondContact O-N 3.19Å; F30-S32 PolarHBondContact O-N 3.17Å; F30-W33 PolarHBondContact O-N 2.93Å; F30-L34 WeakPolarHBondContact O-CB 3.2Å; F30-L34 PolarHBondContact O-N 2.95Å
31	F	87.9	Confident	80	Confident	127 Å²	127	108.1 Å²	108.1	56%	0.557	53%	0.529	S	S	*	.	H	α-helix	trans	-66.2	-36.6	176.8	-74.2	-64.1	0	0	0	112.5	K27 L34 A35	K27-F31 HydrophobicContact CB-CE2 4.46Å; K27-F31 WeakPolarHBondContact O-CD2 3.5Å; K27-F31 PolarHBondContact O-N 2.86Å; F31-L34 PolarHBondContact O-N 3.48Å; F31-A35 VanDerWaalsContact O-CB 3.29Å; F31-A35 WeakPolarHBondContact O-CB 3.35Å; F31-A35 PolarHBondContact O-N 2.04Å
32	S	87.6	Confident	81.6	Confident	71 Å²	71	102.5 Å²	102.5	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-65.1	-43.1	173.8	-174.1	0	0	0	0	111.6	Y28 L29 F30 A35 V36	Y28-S32 VanDerWaalsContact O-CB 3.24Å; Y28-S32 WeakPolarHBondContact O-CB 3.35Å; Y28-S32 PolarHBondContact O-N 2.74Å; L29-S32 PolarHBondContact O-N 2.79Å; F30-S32 PolarHBondContact O-N 3.17Å; S32-A35 PolarHBondContact O-N 2.97Å; S32-V36 WeakPolarHBondContact O-CG2 3.24Å; S32-V36 PolarHBondContact O-N 2.93Å
33	W	92.4	Very high	82.9	Confident	154 Å²	154	104.5 Å²	104.5	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-64.2	-44.3	175.9	176	81.7	0	0	0	111.4	L29 F30 A35 V36 F37	L29-W33 VanDerWaalsContact O-CB 3.31Å; L29-W33 WeakPolarHBondContact O-CB 3.29Å; L29-W33 PolarHBondContact O-N 3.39Å; F30-W33 PolarHBondContact O-N 2.93Å; W33-A35 PolarHBondContact O-N 3.31Å; W33-V36 PolarHBondContact O-N 2.9Å; W33-F37 WeakPolarHBondContact O-CB 3.12Å; W33-F37 PolarHBondContact O-N 2.9Å
34	L	91	Very high	84	Confident	66 Å²	66	105.1 Å²	105.1	35%	0.346	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-42.8	176.1	-172.9	71.3	0	0	0	111.5	F30 F31 V36 F37 V38	F30-L34 WeakPolarHBondContact O-CB 3.2Å; F30-L34 PolarHBondContact O-N 2.95Å; F31-L34 PolarHBondContact O-N 3.48Å; L34-V36 PolarHBondContact O-N 3.43Å; L34-F37 PolarHBondContact O-N 2.98Å; L34-V38 HydrophobicContact CD1-CG2 4.24Å; L34-V38 HydrophobicContact CG-CG2 4.26Å; L34-V38 WeakPolarHBondContact O-CB 3.45Å; L34-V38 VanDerWaalsContact O-CG2 3.25Å; L34-V38 WeakPolarHBondContact O-CG2 3.4Å; L34-V38 PolarHBondContact O-N 2.99Å
35	A	89.6	Confident	84.8	Confident	66 Å²	66	104.3 Å²	104.3	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-41.2	177.2	0	0	0	0	0	112	F31 S32 W33 G39	F31-A35 VanDerWaalsContact O-CB 3.29Å; F31-A35 WeakPolarHBondContact O-CB 3.35Å; F31-A35 PolarHBondContact O-N 2.04Å; S32-A35 PolarHBondContact O-N 2.97Å; W33-A35 PolarHBondContact O-N 3.31Å; A35-G39 WeakPolarHBondContact O-CA 3Å; A35-G39 PolarHBondContact O-N 3.19Å
36	V	92.2	Very high	85	Confident	97 Å²	97	100.7 Å²	100.7	59%	0.588	50%	0.498	S	S	*	.	H	α-helix	trans	-67.6	-42.1	175.1	172.9	0	0	0	0	111.1	S32 W33 L34 G39 S40	S32-V36 WeakPolarHBondContact O-CG2 3.24Å; S32-V36 PolarHBondContact O-N 2.93Å; W33-V36 PolarHBondContact O-N 2.9Å; L34-V36 PolarHBondContact O-N 3.43Å; V36-G39 PolarHBondContact O-N 3.46Å; V36-S40 WeakPolarHBondContact O-CB 3.32Å; V36-S40 PolarHBondContact O-N 3.5Å
37	F	91.3	Very high	85.2	Confident	98 Å²	98	101.8 Å²	101.8	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-50.5	178.6	-178.2	-97.5	0	0	0	111.7	W33 L34 S40 W41	W33-F37 WeakPolarHBondContact O-CB 3.12Å; W33-F37 PolarHBondContact O-N 2.9Å; L34-F37 PolarHBondContact O-N 2.98Å; F37-S40 PolarHBondContact O-N 2.94Å; F37-W41 AromaticContact CE1-CE3 3.8Å; F37-W41 HydrophobicContact CE1-CE3 3.8Å; F37-W41 HydrophobicContact CE1-CZ3 4.23Å; F37-W41 AromaticContact CZ-CE3 3.74Å; F37-W41 HydrophobicContact CZ-CE3 3.74Å; F37-W41 AromaticContact CZ-CZ3 3.97Å; F37-W41 HydrophobicContact CZ-CZ3 3.97Å; F37-W41 WeakPolarHBondContact O-CB 3.02Å; F37-W41 PolarHBondContact O-N 3.07Å
38	V	88.9	Confident	84.9	Confident	66 Å²	66	99 Å²	99	40%	0.4	49%	0.489	S	S	.	.	H	α-helix	trans	-64.5	-42.6	177.3	174.1	0	0	0	0	110.5	L34 S40 W41 I42	L34-V38 HydrophobicContact CD1-CG2 4.24Å; L34-V38 HydrophobicContact CG-CG2 4.26Å; L34-V38 WeakPolarHBondContact O-CB 3.45Å; L34-V38 VanDerWaalsContact O-CG2 3.25Å; L34-V38 WeakPolarHBondContact O-CG2 3.4Å; L34-V38 PolarHBondContact O-N 2.99Å; V38-S40 PolarHBondContact O-N 2.82Å; V38-W41 PolarHBondContact O-N 3.27Å; V38-I42 HydrophobicContact CG1-CD1 3.77Å; V38-I42 HydrophobicContact CG1-CG1 4.36Å; V38-I42 WeakPolarHBondContact O-CB 3.41Å; V38-I42 VanDerWaalsContact O-CG1 3.22Å; V38-I42 WeakPolarHBondContact O-CG1 3.46Å; V38-I42 PolarHBondContact O-N 2.78Å
39	G	86.7	Confident	84.3	Confident	27 Å²	27	94.4 Å²	94.4	28%	0.278	48%	0.479	S	S	.	.	H	α-helix	trans	-60.5	-45.5	175.4	0	0	0	0	0	112.5	A35 V36 I42 I43	A35-G39 WeakPolarHBondContact O-CA 3Å; A35-G39 PolarHBondContact O-N 3.19Å; V36-G39 PolarHBondContact O-N 3.46Å; G39-I42 PolarHBondContact O-N 2.92Å; G39-I43 VanDerWaalsContact O-CG1 3.26Å; G39-I43 WeakPolarHBondContact O-CG1 3.31Å; G39-I43 PolarHBondContact O-N 3.17Å
40	S	89.1	Confident	83.7	Confident	75 Å²	75	95.8 Å²	95.8	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-65.2	-38.4	176	-171.2	0	0	0	0	112.1	V36 F37 V38 Y44	V36-S40 WeakPolarHBondContact O-CB 3.32Å; V36-S40 PolarHBondContact O-N 3.5Å; F37-S40 PolarHBondContact O-N 2.94Å; V38-S40 PolarHBondContact O-N 2.82Å; S40-Y44 VanDerWaalsContact O-CB 3.25Å; S40-Y44 WeakPolarHBondContact O-CB 3.3Å; S40-Y44 PolarHBondContact O-N 2.87Å
41	W	87.3	Confident	82.9	Confident	157 Å²	157	93 Å²	93	60%	0.595	47%	0.47	S	S	*	.	H	α-helix	trans	-64	-45.9	174.8	-171.5	-59.5	0	0	0	110.9	F37 V38 I43 Y44 V45	F37-W41 AromaticContact CE1-CE3 3.8Å; F37-W41 HydrophobicContact CE1-CE3 3.8Å; F37-W41 HydrophobicContact CE1-CZ3 4.23Å; F37-W41 AromaticContact CZ-CE3 3.74Å; F37-W41 HydrophobicContact CZ-CE3 3.74Å; F37-W41 AromaticContact CZ-CZ3 3.97Å; F37-W41 HydrophobicContact CZ-CZ3 3.97Å; F37-W41 WeakPolarHBondContact O-CB 3.02Å; F37-W41 PolarHBondContact O-N 3.07Å; V38-W41 PolarHBondContact O-N 3.27Å; W41-I43 PolarHBondContact O-N 2.69Å; W41-Y44 PolarHBondContact O-N 3.48Å; W41-V45 VanDerWaalsContact CD1-CG2 3.43Å; W41-V45 WeakPolarHBondContact O-CB 3.42Å; W41-V45 WeakPolarHBondContact O-CG2 3.24Å; W41-V45 PolarHBondContact O-N 2.79Å
42	I	82.3	Confident	82.1	Confident	44 Å²	44	92 Å²	92	23%	0.226	47%	0.467	C	S	.	.	H	α-helix	trans	-59.2	-47.3	177.3	-72.1	167.9	0	0	0	110.5	V38 G39 V45 Q46 W243 V244	V38-I42 HydrophobicContact CG1-CD1 3.77Å; V38-I42 HydrophobicContact CG1-CG1 4.36Å; V38-I42 WeakPolarHBondContact O-CB 3.41Å; V38-I42 VanDerWaalsContact O-CG1 3.22Å; V38-I42 WeakPolarHBondContact O-CG1 3.46Å; V38-I42 PolarHBondContact O-N 2.78Å; G39-I42 PolarHBondContact O-N 2.92Å; I42-V45 PolarHBondContact O-N 3.07Å; I42-Q46 VanDerWaalsContact O-CB 3.27Å; I42-Q46 WeakPolarHBondContact O-CB 3.47Å; I42-Q46 PolarHBondContact O-N 3Å; I42-W243 HydrophobicContact CB-CZ2 4.41Å; I42-W243 HydrophobicContact CG1-CH2 3.97Å; I42-W243 HydrophobicContact CG1-CZ2 4.13Å; I42-W243 HydrophobicContact CG2-CZ2 3.9Å; I42-V244 HydrophobicContact CG2-CG2 4.14Å
43	I	83.1	Confident	81.6	Confident	116 Å²	116	90.2 Å²	90.2	60%	0.595	45%	0.452	S	S	*	.	H	α-helix	trans	-62.3	-44.6	177.6	-67.8	165.4	0	0	0	110.4	G39 W41 Q46 Y47	G39-I43 VanDerWaalsContact O-CG1 3.26Å; G39-I43 WeakPolarHBondContact O-CG1 3.31Å; G39-I43 PolarHBondContact O-N 3.17Å; W41-I43 PolarHBondContact O-N 2.69Å; I43-Q46 PolarHBondContact O-N 3.3Å; I43-Y47 WeakPolarHBondContact O-CB 3.38Å; I43-Y47 PolarHBondContact O-N 3.26Å
44	Y	82.4	Confident	81.2	Confident	160 Å²	160	84.2 Å²	84.2	63%	0.627	43%	0.433	S	S	*	.	H	α-helix	trans	-62	-47.2	178.5	176.9	-96.8	0	0	0	112.1	S40 W41 Y47 S48	S40-Y44 VanDerWaalsContact O-CB 3.25Å; S40-Y44 WeakPolarHBondContact O-CB 3.3Å; S40-Y44 PolarHBondContact O-N 2.87Å; W41-Y44 PolarHBondContact O-N 3.48Å; Y44-Y47 PolarHBondContact O-N 3.39Å; Y44-S48 VanDerWaalsContact O-CB 3.25Å; Y44-S48 WeakPolarHBondContact O-CB 3.05Å; Y44-S48 PolarHBondContact O-N 2.99Å
45	V	77.6	Confident	81	Confident	50 Å²	50	85.8 Å²	85.8	30%	0.303	43%	0.434	S	S	.	.	H	α-helix	trans	-62.8	-47.9	177.4	170.8	0	0	0	0	110.3	W41 I42 Y47 S48 T49	W41-V45 VanDerWaalsContact CD1-CG2 3.43Å; W41-V45 WeakPolarHBondContact O-CB 3.42Å; W41-V45 WeakPolarHBondContact O-CG2 3.24Å; W41-V45 PolarHBondContact O-N 2.79Å; I42-V45 PolarHBondContact O-N 3.07Å; V45-Y47 VanDerWaalsContact C-N 3.31Å; V45-Y47 PolarHBondContact O-N 3.4Å; V45-S48 PolarHBondContact O-N 3.34Å; V45-T49 WeakPolarHBondContact O-CB 3.4Å; V45-T49 PolarHBondContact O-N 2.78Å; V45-T49 PolarHBondContact O-OG1 2.92Å
46	Q	73.6	Confident	80.8	Confident	111 Å²	111	83 Å²	83	52%	0.519	41%	0.412	S	S	.	.	H	α-helix	trans	-61.8	-40.1	179.1	-174.9	173.4	-8.4	0	0	112	I42 I43 Y50	I42-Q46 VanDerWaalsContact O-CB 3.27Å; I42-Q46 WeakPolarHBondContact O-CB 3.47Å; I42-Q46 PolarHBondContact O-N 3Å; I43-Q46 PolarHBondContact O-N 3.3Å; Q46-Y50 WeakPolarHBondContact O-CB 3.45Å; Q46-Y50 PolarHBondContact O-N 2.89Å
47	Y	77	Confident	80.5	Confident	157 Å²	157	87.2 Å²	87.2	62%	0.616	42%	0.422	S	S	*	.	H	α-helix	trans	-65.6	-48.2	175.5	-177.2	-96.9	0	0	0	111.5	I43 Y44 V45 Y50 T51	I43-Y47 WeakPolarHBondContact O-CB 3.38Å; I43-Y47 PolarHBondContact O-N 3.26Å; Y44-Y47 PolarHBondContact O-N 3.39Å; V45-Y47 VanDerWaalsContact C-N 3.31Å; V45-Y47 PolarHBondContact O-N 3.4Å; Y47-Y50 WeakPolarHBondContact O-CB 3.29Å; Y47-Y50 PolarHBondContact O-N 2.86Å; Y47-T51 HydrophobicContact CD1-CG2 4.14Å; Y47-T51 HydrophobicContact CE1-CG2 3.72Å; Y47-T51 HydrophobicContact CE2-CG2 4.25Å; Y47-T51 WeakPolarHBondContact O-CG2 3.42Å; Y47-T51 PolarHBondContact O-N 3.11Å; Y47-T51 PolarHBondContact O-OG1 3.39Å; Y47-T51 VanDerWaalsContact O-OG1 3.12Å
48	S	70.9	Confident	80.4	Confident	43 Å²	43	85.6 Å²	85.6	30%	0.301	42%	0.418	S	S	.	.	H	α-helix	trans	-59.6	-48	178.5	179.7	0	0	0	0	111.9	Y44 V45 Y50 T51 E52	Y44-S48 VanDerWaalsContact O-CB 3.25Å; Y44-S48 WeakPolarHBondContact O-CB 3.05Å; Y44-S48 PolarHBondContact O-N 2.99Å; V45-S48 PolarHBondContact O-N 3.34Å; S48-Y50 VanDerWaalsContact C-N 3.32Å; S48-Y50 PolarHBondContact O-N 3.22Å; S48-T51 WeakPolarHBondContact CA-OG1 3.39Å; S48-T51 PolarHBondContact O-N 3.42Å; S48-T51 PolarHBondContact O-OG1 2.84Å; S48-E52 WeakPolarHBondContact O-CG 3.12Å; S48-E52 PolarHBondContact O-N 3.39Å
49	T	69	Low	80.4	Confident	72 Å²	72	82.5 Å²	82.5	44%	0.442	40%	0.399	S	S	.	.	H	α-helix	trans	-62.3	-39.2	175.8	-54.1	0	0	0	0	111.6	V45 E52 L53	V45-T49 WeakPolarHBondContact O-CB 3.4Å; V45-T49 PolarHBondContact O-N 2.78Å; V45-T49 PolarHBondContact O-OG1 2.92Å; T49-E52 PolarHBondContact O-N 3.12Å; T49-L53 HydrophobicContact CG2-CD1 3.78Å; T49-L53 HydrophobicContact CG2-CG 4.42Å; T49-L53 WeakPolarHBondContact O-CB 3.41Å; T49-L53 WeakPolarHBondContact O-CD1 3.32Å; T49-L53 VanDerWaalsContact O-CG 3.22Å; T49-L53 WeakPolarHBondContact O-CG 3.27Å; T49-L53 PolarHBondContact O-N 2.03Å
50	Y	70.5	Confident	80.6	Confident	138 Å²	138	83.8 Å²	83.8	54%	0.541	40%	0.397	S	S	.	.	H	α-helix	trans	-66	-42	176.1	-175.5	-93	0	0	0	112.3	Q46 Y47 S48 E52 L53 C54	Q46-Y50 WeakPolarHBondContact O-CB 3.45Å; Q46-Y50 PolarHBondContact O-N 2.89Å; Y47-Y50 WeakPolarHBondContact O-CB 3.29Å; Y47-Y50 PolarHBondContact O-N 2.86Å; S48-Y50 VanDerWaalsContact C-N 3.32Å; S48-Y50 PolarHBondContact O-N 3.22Å; Y50-E52 VanDerWaalsContact C-N 3.31Å; Y50-E52 PolarHBondContact O-N 2.97Å; Y50-L53 PolarHBondContact O-N 3Å; Y50-C54 HydrophobicContact CE1-CB 4.21Å; Y50-C54 HydrophobicContact CE2-CB 4.48Å; Y50-C54 VanDerWaalsContact O-CB 3.31Å; Y50-C54 WeakPolarHBondContact O-CB 3.3Å; Y50-C54 PolarHBondContact O-N 2.89Å
51	T	70.8	Confident	80.7	Confident	57 Å²	57	87.8 Å²	87.8	35%	0.35	41%	0.405	S	S	.	.	H	α-helix	trans	-66.1	-33.2	178.9	48.6	0	0	0	0	112.8	Y47 S48 R55	Y47-T51 HydrophobicContact CD1-CG2 4.14Å; Y47-T51 HydrophobicContact CE1-CG2 3.72Å; Y47-T51 HydrophobicContact CE2-CG2 4.25Å; Y47-T51 WeakPolarHBondContact O-CG2 3.42Å; Y47-T51 PolarHBondContact O-N 3.11Å; Y47-T51 PolarHBondContact O-OG1 3.39Å; Y47-T51 VanDerWaalsContact O-OG1 3.12Å; S48-T51 WeakPolarHBondContact CA-OG1 3.39Å; S48-T51 PolarHBondContact O-N 3.42Å; S48-T51 PolarHBondContact O-OG1 2.84Å; T51-R55 WeakPolarHBondContact O-CG 3.15Å
52	E	70.6	Confident	80.9	Confident	107 Å²	107	84 Å²	84	50%	0.5	40%	0.396	S	S	.	.	H	α-helix	trans	-73.1	-39.5	174.6	-72.9	-64.6	160.5	0	0	112.4	S48 T49 Y50	S48-E52 WeakPolarHBondContact O-CG 3.12Å; S48-E52 PolarHBondContact O-N 3.39Å; T49-E52 PolarHBondContact O-N 3.12Å; Y50-E52 VanDerWaalsContact C-N 3.31Å; Y50-E52 PolarHBondContact O-N 2.97Å
53	L	77.3	Confident	81.3	Confident	34 Å²	34	82 Å²	82	18%	0.178	39%	0.386	C	S	.	.	H	α-helix	trans	-75.4	-29.3	-178.2	-72.4	171	0	0	0	113.7	T49 Y50 S93	T49-L53 HydrophobicContact CG2-CD1 3.78Å; T49-L53 HydrophobicContact CG2-CG 4.42Å; T49-L53 WeakPolarHBondContact O-CB 3.41Å; T49-L53 WeakPolarHBondContact O-CD1 3.32Å; T49-L53 VanDerWaalsContact O-CG 3.22Å; T49-L53 WeakPolarHBondContact O-CG 3.27Å; T49-L53 PolarHBondContact O-N 2.03Å; Y50-L53 PolarHBondContact O-N 3Å; L53-S93 WeakPolarHBondContact O-CB 3.33Å; L53-S93 PolarHBondContact O-OG 2.81Å
54	C	84.9	Confident	81.8	Confident	28 Å²	28	77 Å²	77	19%	0.189	36%	0.361	C	S	.	.			trans	-119	63.9	-165.9	-58.2	0	0	0	0	113.2	Y50 G56 C91 Y101	Y50-C54 HydrophobicContact CE1-CB 4.21Å; Y50-C54 HydrophobicContact CE2-CB 4.48Å; Y50-C54 VanDerWaalsContact O-CB 3.31Å; Y50-C54 WeakPolarHBondContact O-CB 3.3Å; Y50-C54 PolarHBondContact O-N 2.89Å; C54-G56 PolarHBondContact O-N 3.18Å; C54-C91 VanDerWaalsContact CA-SG 3.59Å; C54-C91 HydrophobicContact CB-CB 3.73Å; C54-C91 WeakPolarHBondContact CB-SG 3.07Å; C54-C91 WeakPolarHBondContact SG-CB 3.34Å; C54-C91 CovalentContact SG-SG 2.03Å; C54-C91 PolarHBondContact SG-SG 2.91Å; C54-Y101 VanDerWaalsContact CA-OH 3.24Å; C54-Y101 WeakPolarHBondContact CA-OH 3.46Å
55	R	85.4	Confident	82.4	Confident	98 Å²	98	74.3 Å²	74.3	37%	0.37	36%	0.357	S	S	.	.			trans	-97.7	42.9	179.1	-44.9	169.8	51.1	-172.2	-4	114.3	T51 K57 D58 C59 Q99 Y101 M116	T51-R55 WeakPolarHBondContact O-CG 3.15Å; R55-K57 PolarHBondContact O-N 3.36Å; R55-D58 HydrophobicContact CB-CB 4.18Å; R55-D58 IonicContact CZ-OD2 2.87Å; R55-D58 VanDerWaalsContact CZ-OD2 3.31Å; R55-D58 IonicContact NE-OD2 2.79Å; R55-D58 PolarHBondContact NE-OD2 3.33Å; R55-D58 IonicContact NH2-OD2 3.91Å; R55-D58 PolarHBondContact NH2-OD2 3.02Å; R55-D58 WeakPolarHBondContact O-CB 3Å; R55-D58 PolarHBondContact O-N 2.79Å; R55-C59 PolarHBondContact O-N 3.42Å; R55-C59 VanDerWaalsContact O-N 3.1Å; R55-Q99 VanDerWaalsContact CB-NE2 3.26Å; R55-Q99 VanDerWaalsContact N-NE2 3.16Å; R55-Q99 PolarHBondContact O-OE1 3.29Å; R55-Y101 PolarHBondContact N-OH 2.79Å; R55-M116 HydrophobicContact CB-CE 4.29Å
56	G	84.9	Confident	83	Confident	7 Å²	7	73.9 Å²	73.9	7%	0.072	35%	0.351	C	S	.	.	H	α-helix	trans	-64	-29.2	-172.4	0	0	0	0	0	113.6	C54 C59 K60 F88 Y101	C54-G56 PolarHBondContact O-N 3.18Å; G56-C59 PolarHBondContact O-N 2.98Å; G56-K60 WeakPolarHBondContact O-CB 3.39Å; G56-K60 PolarHBondContact O-N 2.7Å; G56-F88 WeakPolarHBondContact O-CE2 3.37Å; G56-Y101 VanDerWaalsContact CA-CZ 3.44Å; G56-Y101 VanDerWaalsContact CA-OH 3.24Å; G56-Y101 WeakPolarHBondContact CA-OH 3.24Å; G56-Y101 PolarHBondContact N-OH 2.9Å
57	K	87.7	Confident	84	Confident	187 Å²	187	71.1 Å²	71.1	81%	0.813	34%	0.336	S	S	*	.	H	α-helix	trans	-65.7	-40	173.1	-68.8	-179	178.9	177.9	0	112.3	R55 K61	R55-K57 PolarHBondContact O-N 3.36Å; K57-K61 WeakPolarHBondContact O-CB 3.45Å; K57-K61 PolarHBondContact O-N 3.41Å
58	D	88	Confident	84.8	Confident	64 Å²	64	70.9 Å²	70.9	34%	0.342	34%	0.338	S	S	.	.	H	α-helix	trans	-67.1	-46.2	177	-65.9	-14.7	0	0	0	109.9	R55 K61 I62 M116	R55-D58 HydrophobicContact CB-CB 4.18Å; R55-D58 IonicContact CZ-OD2 2.87Å; R55-D58 VanDerWaalsContact CZ-OD2 3.31Å; R55-D58 IonicContact NE-OD2 2.79Å; R55-D58 PolarHBondContact NE-OD2 3.33Å; R55-D58 IonicContact NH2-OD2 3.91Å; R55-D58 PolarHBondContact NH2-OD2 3.02Å; R55-D58 WeakPolarHBondContact O-CB 3Å; R55-D58 PolarHBondContact O-N 2.79Å; D58-K61 PolarHBondContact O-N 2.82Å; D58-I62 WeakPolarHBondContact O-CG1 3.46Å; D58-I62 PolarHBondContact O-N 3.16Å; D58-M116 HydrophobicContact CB-CE 3.99Å
59	C	88.5	Confident	85.8	Confident	1 Å²	1	73 Å²	73	1%	0.007	35%	0.35	C	S	.	.	H	α-helix	trans	-53.7	-55.9	173.5	166.1	0	0	0	0	111.4	R55 G56 K61 I62 I63 C114 M116	R55-C59 PolarHBondContact O-N 3.42Å; R55-C59 VanDerWaalsContact O-N 3.1Å; G56-C59 PolarHBondContact O-N 2.98Å; C59-K61 VanDerWaalsContact C-N 3.26Å; C59-K61 PolarHBondContact O-N 3Å; C59-I62 PolarHBondContact O-N 3.49Å; C59-I63 WeakPolarHBondContact O-CG1 3.5Å; C59-I63 PolarHBondContact O-N 3.49Å; C59-C114 HydrophobicContact CB-CB 4.04Å; C59-C114 WeakPolarHBondContact CB-SG 3.2Å; C59-C114 WeakPolarHBondContact SG-CB 3.19Å; C59-C114 CovalentContact SG-SG 2.01Å; C59-C114 PolarHBondContact SG-SG 3.44Å; C59-M116 HydrophobicContact CB-SD 3.73Å
60	K	91.9	Very high	86.8	Confident	54 Å²	54	72.2 Å²	72.2	24%	0.235	36%	0.356	C	S	.	.	H	α-helix	trans	-54.9	-44	178.5	175.4	173.2	172	175.8	0	111.1	G56 C64 L80 E84 F88	G56-K60 WeakPolarHBondContact O-CB 3.39Å; G56-K60 PolarHBondContact O-N 2.7Å; K60-C64 VanDerWaalsContact O-CB 3.24Å; K60-C64 WeakPolarHBondContact O-CB 3.47Å; K60-C64 PolarHBondContact O-N 3.33Å; K60-C64 PolarHBondContact O-SG 2.96Å; K60-L80 HydrophobicContact CD-CD1 4.12Å; K60-L80 WeakPolarHBondContact CE-O 2.96Å; K60-L80 HydrophobicContact CG-CD1 4.02Å; K60-L80 HydrophobicContact CG-CG 4.43Å; K60-L80 PolarHBondContact NZ-O 3.45Å; K60-E84 IonicContact NZ-OE1 3.8Å; K60-E84 PolarHBondContact NZ-OE1 2.97Å; K60-F88 HydrophobicContact CB-CE2 4.37Å; K60-F88 HydrophobicContact CB-CZ 4.27Å
61	K	91.6	Very high	87.7	Confident	159 Å²	159	67.6 Å²	67.6	69%	0.691	34%	0.342	S	S	*	.	H	α-helix	trans	-62.5	-47.1	-179.7	-174	-179.4	177.6	-175.7	0	112.1	K57 D58 C59 D65	K57-K61 WeakPolarHBondContact O-CB 3.45Å; K57-K61 PolarHBondContact O-N 3.41Å; D58-K61 PolarHBondContact O-N 2.82Å; C59-K61 VanDerWaalsContact C-N 3.26Å; C59-K61 PolarHBondContact O-N 3Å; K61-D65 WeakPolarHBondContact O-CB 3.41Å; K61-D65 PolarHBondContact O-N 3.16Å
62	I	90	Very high	88.8	Confident	76 Å²	76	65 Å²	65	39%	0.39	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-47.4	-179.1	-67.7	165.2	0	0	0	110.7	D58 C59 D65 K66	D58-I62 WeakPolarHBondContact O-CG1 3.46Å; D58-I62 PolarHBondContact O-N 3.16Å; C59-I62 PolarHBondContact O-N 3.49Å; I62-D65 PolarHBondContact O-N 3.41Å; I62-K66 HydrophobicContact CG2-CD 4.35Å; I62-K66 WeakPolarHBondContact O-CG 3.4Å; I62-K66 PolarHBondContact O-N 2.93Å; I62-K66 VanDerWaalsContact O-N 3.12Å
63	I	91.9	Very high	90	Very high	4 Å²	4	62.4 Å²	62.4	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-62.6	-47.5	179	-63.4	-62	0	0	0	110.4	C59 D65 K66 Y67 I72 L80 C222 D224 L225	C59-I63 WeakPolarHBondContact O-CG1 3.5Å; C59-I63 PolarHBondContact O-N 3.49Å; I63-D65 VanDerWaalsContact C-N 3.31Å; I63-D65 PolarHBondContact O-N 3.36Å; I63-K66 PolarHBondContact O-N 3.44Å; I63-Y67 PolarHBondContact O-N 2.83Å; I63-I72 HydrophobicContact CG2-CD1 3.8Å; I63-I72 WeakPolarHBondContact O-CD1 3.18Å; I63-L80 HydrophobicContact CB-CD2 4.39Å; I63-L80 HydrophobicContact CG2-CD2 3.75Å; I63-C222 HydrophobicContact CG2-CB 4.16Å; I63-C222 WeakPolarHBondContact CG2-SG 3.21Å; I63-D224 WeakPolarHBondContact CD1-OD1 3.4Å; I63-L225 HydrophobicContact CD1-CB 4.42Å; I63-L225 HydrophobicContact CG1-CB 4.3Å
64	C	93.8	Very high	90.8	Very high	10 Å²	10	61 Å²	61	7%	0.068	31%	0.31	C	S	.	.	H	α-helix	trans	-67.2	-29.6	-179.4	-67.3	0	0	0	0	114.2	K60 K68 C81	K60-C64 VanDerWaalsContact O-CB 3.24Å; K60-C64 WeakPolarHBondContact O-CB 3.47Å; K60-C64 PolarHBondContact O-N 3.33Å; K60-C64 PolarHBondContact O-SG 2.96Å; C64-K68 WeakPolarHBondContact O-CB 3.33Å; C64-K68 VanDerWaalsContact O-CG 3.24Å; C64-K68 WeakPolarHBondContact O-CG 3.23Å; C64-K68 PolarHBondContact O-N 3.29Å; C64-C81 WeakPolarHBondContact CA-SG 3.32Å; C64-C81 HydrophobicContact CB-CB 3.69Å; C64-C81 WeakPolarHBondContact CB-SG 3.39Å; C64-C81 WeakPolarHBondContact SG-CA 3.17Å; C64-C81 WeakPolarHBondContact SG-CB 3.44Å; C64-C81 CovalentContact SG-SG 2.04Å; C64-C81 PolarHBondContact SG-SG 2.77Å
65	D	93.7	Very high	91.3	Very high	104 Å²	104	62.2 Å²	62.2	56%	0.556	32%	0.317	S	S	*	.	H	α-helix	trans	-67.4	-45.2	172.8	-167.8	56.4	0	0	0	111.3	K61 I62 I63 Y67 K68 T69	K61-D65 WeakPolarHBondContact O-CB 3.41Å; K61-D65 PolarHBondContact O-N 3.16Å; I62-D65 PolarHBondContact O-N 3.41Å; I63-D65 VanDerWaalsContact C-N 3.31Å; I63-D65 PolarHBondContact O-N 3.36Å; D65-Y67 VanDerWaalsContact C-N 3.3Å; D65-Y67 PolarHBondContact O-N 2.72Å; D65-K68 PolarHBondContact O-N 3.2Å; D65-T69 WeakPolarHBondContact O-CG2 3.49Å; D65-T69 PolarHBondContact O-N 3.01Å; D65-T69 VanDerWaalsContact O-N 3.11Å; D65-T69 PolarHBondContact O-OG1 3.18Å
66	K	91.3	Very high	91.8	Very high	41 Å²	41	57.5 Å²	57.5	18%	0.178	30%	0.3	C	S	.	.	H	α-helix	trans	-62	-36.4	174.1	-69.5	178.4	-179.4	175.8	0	112.1	I62 I63 T69 G70 V71 I72 E117 F137	I62-K66 HydrophobicContact CG2-CD 4.35Å; I62-K66 WeakPolarHBondContact O-CG 3.4Å; I62-K66 PolarHBondContact O-N 2.93Å; I62-K66 VanDerWaalsContact O-N 3.12Å; I63-K66 PolarHBondContact O-N 3.44Å; K66-T69 WeakPolarHBondContact CA-OG1 3.47Å; K66-T69 PolarHBondContact O-OG1 2.96Å; K66-G70 PolarHBondContact O-N 2.87Å; K66-V71 HydrophobicContact CB-CB 4.47Å; K66-V71 WeakPolarHBondContact O-CB 3.39Å; K66-V71 PolarHBondContact O-N 3.36Å; K66-I72 HydrophobicContact CB-CD1 3.76Å; K66-I72 HydrophobicContact CB-CG1 3.82Å; K66-I72 HydrophobicContact CB-CG2 4.22Å; K66-E117 IonicContact NZ-OE1 2.79Å; K66-E117 PolarHBondContact NZ-OE1 3.33Å; K66-E117 VanDerWaalsContact NZ-OE1 3.13Å; K66-F137 HydrophobicContact CD-CD2 3.74Å; K66-F137 HydrophobicContact CD-CE2 3.7Å
67	Y	94.1	Very high	92.3	Very high	52 Å²	52	57.2 Å²	57.2	20%	0.204	30%	0.296	C	S	.	.	H	α-helix	trans	-69.4	-48.4	176.7	175.7	-118	0	0	0	112	I63 D65 T69 G70 C77 C81 V82	I63-Y67 PolarHBondContact O-N 2.83Å; D65-Y67 VanDerWaalsContact C-N 3.3Å; D65-Y67 PolarHBondContact O-N 2.72Å; Y67-T69 PolarHBondContact O-N 2.98Å; Y67-G70 PolarHBondContact O-N 3.39Å; Y67-C77 HydrophobicContact CD1-CB 4.11Å; Y67-C77 HydrophobicContact CD2-CB 3.42Å; Y67-C77 VanDerWaalsContact CD2-CB 3.42Å; Y67-C77 HydrophobicContact CE1-CB 4.07Å; Y67-C77 HydrophobicContact CE2-CB 3.39Å; Y67-C77 HydrophobicContact CG-CB 3.79Å; Y67-C81 HydrophobicContact CD1-CB 3.83Å; Y67-C81 HydrophobicContact CE1-CB 4.37Å; Y67-V82 HydrophobicContact CE1-CG2 4.02Å
68	K	94.3	Very high	92.6	Very high	152 Å²	152	51.8 Å²	51.8	66%	0.661	28%	0.276	S	S	*	.	H	α-helix	trans	-61.3	-28.1	178.6	-74.4	174.6	-177.2	-177.1	0	113.3	C64 D65 G70	C64-K68 WeakPolarHBondContact O-CB 3.33Å; C64-K68 VanDerWaalsContact O-CG 3.24Å; C64-K68 WeakPolarHBondContact O-CG 3.23Å; C64-K68 PolarHBondContact O-N 3.29Å; D65-K68 PolarHBondContact O-N 3.2Å; K68-G70 VanDerWaalsContact C-N 3.31Å
69	T	91.1	Very high	92.9	Very high	87 Å²	87	49.4 Å²	49.4	53%	0.534	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-1	175.3	52.5	0	0	0	0	113.7	D65 K66 Y67 V71	D65-T69 WeakPolarHBondContact O-CG2 3.49Å; D65-T69 PolarHBondContact O-N 3.01Å; D65-T69 VanDerWaalsContact O-N 3.11Å; D65-T69 PolarHBondContact O-OG1 3.18Å; K66-T69 WeakPolarHBondContact CA-OG1 3.47Å; K66-T69 PolarHBondContact O-OG1 2.96Å; Y67-T69 PolarHBondContact O-N 2.98Å; T69-V71 VanDerWaalsContact C-N 3.3Å; T69-V71 PolarHBondContact O-N 2.87Å; T69-V71 WeakPolarHBondContact OG1-CG2 3.49Å
70	G	90.3	Very high	93.2	Very high	56 Å²	56	49.4 Å²	49.4	58%	0.577	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	22.3	179.3	0	0	0	0	0	114	K66 Y67 K68	K66-G70 PolarHBondContact O-N 2.87Å; Y67-G70 PolarHBondContact O-N 3.39Å; K68-G70 VanDerWaalsContact C-N 3.31Å
71	V	90.9	Very high	93.4	Very high	42 Å²	42	47.3 Å²	47.3	26%	0.255	26%	0.257	S	S	.	.	S	Bend	trans	-82.3	-34.9	179.6	177.7	0	0	0	0	111.4	K66 T69 F137 K192	K66-V71 HydrophobicContact CB-CB 4.47Å; K66-V71 WeakPolarHBondContact O-CB 3.39Å; K66-V71 PolarHBondContact O-N 3.36Å; T69-V71 VanDerWaalsContact C-N 3.3Å; T69-V71 PolarHBondContact O-N 2.87Å; T69-V71 WeakPolarHBondContact OG1-CG2 3.49Å; V71-F137 HydrophobicContact CG1-CB 4.03Å; V71-K192 HydrophobicContact CG1-CD 4.43Å; V71-K192 WeakPolarHBondContact O-CD 3.44Å
72	I	93.4	Very high	93.5	Very high	2 Å²	2	44 Å²	44	1%	0.01	25%	0.249	C	C	.	.			trans	-126.6	161.8	-179.7	64.6	172.2	0	0	0	109.6	I63 K66 F137 S193	I63-I72 HydrophobicContact CG2-CD1 3.8Å; I63-I72 WeakPolarHBondContact O-CD1 3.18Å; K66-I72 HydrophobicContact CB-CD1 3.76Å; K66-I72 HydrophobicContact CB-CG1 3.82Å; K66-I72 HydrophobicContact CB-CG2 4.22Å; I72-F137 HydrophobicContact CG2-CB 4.4Å; I72-F137 HydrophobicContact CG2-CD1 3.37Å; I72-F137 HydrophobicContact CG2-CD2 4.11Å; I72-F137 HydrophobicContact CG2-CE1 3.47Å; I72-F137 VanDerWaalsContact CG2-CE1 3.47Å; I72-F137 HydrophobicContact CG2-CE2 4.19Å; I72-F137 HydrophobicContact CG2-CG 3.69Å; I72-F137 HydrophobicContact CG2-CZ 3.86Å; I72-S193 WeakPolarHBondContact CA-OG 3.41Å; I72-S193 WeakPolarHBondContact CB-OG 3.47Å
73	D	94.8	Very high	93.6	Very high	52 Å²	52	43.8 Å²	43.8	28%	0.278	25%	0.252	S	S	.	.			trans	-151.2	174.3	174.2	-145.2	-23.8	0	0	0	110.6	G189 E190 S193 G223	D73-G189 PolarHBondContact N-O 3.27Å; D73-E190 HydrophobicContact CB-CG 3.94Å; D73-S193 PolarHBondContact N-OG 3.12Å; D73-S193 WeakPolarHBondContact O-CB 3.18Å; D73-S193 PolarHBondContact O-OG 2.84Å; D73-G223 PolarHBondContact O-N 3.15Å
74	G	95.1	Very high	93.5	Very high	6 Å²	6	48.1 Å²	48.1	6%	0.062	27%	0.272	C	S	.	.			trans	155.6	162.9	174.6	0	0	0	0	0	112.6	A76 C77 F221	G74-A76 PolarHBondContact O-N 3.44Å; G74-C77 PolarHBondContact N-SG 2.89Å; G74-C77 WeakPolarHBondContact O-CB 3.42Å; G74-C77 PolarHBondContact O-N 3.01Å; G74-F221 CarbonylContact C-O 3.57Å; G74-F221 VanDerWaalsContact C-O 3.26Å; G74-F221 WeakPolarHBondContact CA-O 3.5Å
75	P	94.8	Very high	93.4	Very high	52 Å²	52	49.9 Å²	49.9	34%	0.338	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.6	-171.8	24.7	-34.8	0	0	0	113.5	F221	P75-F221 WeakPolarHBondContact CD-O 3.38Å; P75-F221 HydrophobicContact CG-CD1 4.27Å; P75-F221 HydrophobicContact CG-CE1 4.22Å
76	A	95.3	Very high	93.4	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-10.4	178.3	0	0	0	0	0	113.7	G74 S79 L80 L86 W105 F221 C222	G74-A76 PolarHBondContact O-N 3.44Å; A76-S79 PolarHBondContact O-N 3.33Å; A76-L80 VanDerWaalsContact O-CB 3.31Å; A76-L80 WeakPolarHBondContact O-CB 3.44Å; A76-L80 PolarHBondContact O-N 3.2Å; A76-L86 HydrophobicContact CB-CD1 4.15Å; A76-W105 HydrophobicContact CB-CH2 3.57Å; A76-W105 HydrophobicContact CB-CZ2 3.9Å; A76-W105 HydrophobicContact CB-CZ3 3.93Å; A76-F221 WeakPolarHBondContact CB-O 3.43Å; A76-F221 PolarHBondContact N-O 3.23Å; A76-C222 HydrophobicContact CB-CB 4.42Å
77	C	95.3	Very high	93.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.9	-45.2	-171.8	-75.3	0	0	0	0	113.2	Y67 G74 S79 L80 C81 C222	Y67-C77 HydrophobicContact CD1-CB 4.11Å; Y67-C77 HydrophobicContact CD2-CB 3.42Å; Y67-C77 VanDerWaalsContact CD2-CB 3.42Å; Y67-C77 HydrophobicContact CE1-CB 4.07Å; Y67-C77 HydrophobicContact CE2-CB 3.39Å; Y67-C77 HydrophobicContact CG-CB 3.79Å; G74-C77 PolarHBondContact N-SG 2.89Å; G74-C77 WeakPolarHBondContact O-CB 3.42Å; G74-C77 PolarHBondContact O-N 3.01Å; C77-S79 VanDerWaalsContact C-N 3.33Å; C77-S79 PolarHBondContact O-N 2.83Å; C77-L80 PolarHBondContact O-N 2.91Å; C77-C81 VanDerWaalsContact O-CB 3.32Å; C77-C81 WeakPolarHBondContact O-CB 3.25Å; C77-C81 PolarHBondContact O-N 3.5Å; C77-C222 WeakPolarHBondContact CA-SG 3.35Å; C77-C222 HydrophobicContact CB-CB 3.92Å; C77-C222 WeakPolarHBondContact CB-SG 3.33Å; C77-C222 WeakPolarHBondContact SG-CA 3.28Å; C77-C222 WeakPolarHBondContact SG-CB 3.31Å; C77-C222 CovalentContact SG-SG 2.03Å; C77-C222 PolarHBondContact SG-SG 2.73Å
78	N	94.6	Very high	93.2	Very high	74 Å²	74	49.6 Å²	49.6	40%	0.396	28%	0.275	S	S	.	.	H	α-helix	trans	-61.2	-44.6	177.8	-174.3	52.7	0	0	0	111	L80 C81 V82 T83	N78-L80 PolarHBondContact O-N 3.28Å; N78-C81 PolarHBondContact O-N 3.48Å; N78-V82 WeakPolarHBondContact O-CA 3.34Å; N78-V82 WeakPolarHBondContact O-CB 3.49Å; N78-V82 PolarHBondContact O-N 3.33Å; N78-V82 WeakPolarHBondContact OD1-CB 3.43Å; N78-T83 PolarHBondContact O-N 3.1Å; N78-T83 PolarHBondContact O-OG1 3.01Å
79	S	94.9	Very high	93	Very high	14 Å²	14	44.9 Å²	44.9	10%	0.098	27%	0.269	C	S	.	.	H	α-helix	trans	-65	-33.4	177.6	-58.4	0	0	0	0	114	A76 C77 T83 E84 T85 L86 W105	A76-S79 PolarHBondContact O-N 3.33Å; C77-S79 VanDerWaalsContact C-N 3.33Å; C77-S79 PolarHBondContact O-N 2.83Å; S79-T83 VanDerWaalsContact CA-OG1 3.29Å; S79-T83 WeakPolarHBondContact CA-OG1 3.46Å; S79-E84 CarbonylContact O-C 3.54Å; S79-E84 WeakPolarHBondContact O-CA 3.39Å; S79-E84 PolarHBondContact O-N 2.93Å; S79-T85 WeakPolarHBondContact CB-OG1 3.48Å; S79-T85 PolarHBondContact O-N 2.8Å; S79-L86 PolarHBondContact O-N 2.01Å; S79-W105 PolarHBondContact OG-NE1 2.84Å
80	L	94.8	Very high	92.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-77.8	-40.8	177.5	177.2	67.8	0	0	0	112.7	K60 I63 A76 C77 N78 L86 F88 C222 L225	K60-L80 HydrophobicContact CD-CD1 4.12Å; K60-L80 WeakPolarHBondContact CE-O 2.96Å; K60-L80 HydrophobicContact CG-CD1 4.02Å; K60-L80 HydrophobicContact CG-CG 4.43Å; K60-L80 PolarHBondContact NZ-O 3.45Å; I63-L80 HydrophobicContact CB-CD2 4.39Å; I63-L80 HydrophobicContact CG2-CD2 3.75Å; A76-L80 VanDerWaalsContact O-CB 3.31Å; A76-L80 WeakPolarHBondContact O-CB 3.44Å; A76-L80 PolarHBondContact O-N 3.2Å; C77-L80 PolarHBondContact O-N 2.91Å; N78-L80 PolarHBondContact O-N 3.28Å; L80-L86 HydrophobicContact CB-CD2 4.31Å; L80-L86 HydrophobicContact CD1-CD2 3.51Å; L80-L86 HydrophobicContact CG-CD2 4.46Å; L80-F88 HydrophobicContact CD1-CE1 3.53Å; L80-F88 HydrophobicContact CD1-CZ 3.92Å; L80-C222 HydrophobicContact CD2-CB 4.42Å; L80-L225 HydrophobicContact CD2-CD1 4.11Å; L80-L225 HydrophobicContact CD2-CD2 4.44Å
81	C	94.9	Very high	92.8	Very high	11 Å²	11	45.7 Å²	45.7	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-113.8	-19.9	-161.3	-60.4	0	0	0	0	115.9	C64 Y67 C77 N78	C64-C81 WeakPolarHBondContact CA-SG 3.32Å; C64-C81 HydrophobicContact CB-CB 3.69Å; C64-C81 WeakPolarHBondContact CB-SG 3.39Å; C64-C81 WeakPolarHBondContact SG-CA 3.17Å; C64-C81 WeakPolarHBondContact SG-CB 3.44Å; C64-C81 CovalentContact SG-SG 2.04Å; C64-C81 PolarHBondContact SG-SG 2.77Å; Y67-C81 HydrophobicContact CD1-CB 3.83Å; Y67-C81 HydrophobicContact CE1-CB 4.37Å; C77-C81 VanDerWaalsContact O-CB 3.32Å; C77-C81 WeakPolarHBondContact O-CB 3.25Å; C77-C81 PolarHBondContact O-N 3.5Å; N78-C81 PolarHBondContact O-N 3.48Å
82	V	94.3	Very high	92.6	Very high	89 Å²	89	46.5 Å²	46.5	54%	0.539	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-61.6	-174.7	-178	0	0	0	0	110.9	Y67 N78 E84	Y67-V82 HydrophobicContact CE1-CG2 4.02Å; N78-V82 WeakPolarHBondContact O-CA 3.34Å; N78-V82 WeakPolarHBondContact O-CB 3.49Å; N78-V82 PolarHBondContact O-N 3.33Å; N78-V82 WeakPolarHBondContact OD1-CB 3.43Å; V82-E84 VanDerWaalsContact C-N 3.34Å
83	T	92.4	Very high	92.1	Very high	72 Å²	72	47 Å²	47	44%	0.442	26%	0.257	S	S	.	.	S	Bend	trans	-81.8	-18.4	-178.4	59.5	0	0	0	0	112.4	N78 S79 T85	N78-T83 PolarHBondContact O-N 3.1Å; N78-T83 PolarHBondContact O-OG1 3.01Å; S79-T83 VanDerWaalsContact CA-OG1 3.29Å; S79-T83 WeakPolarHBondContact CA-OG1 3.46Å; T83-T85 PolarHBondContact O-N 2.88Å
84	E	89.7	Confident	91.2	Very high	95 Å²	95	49.4 Å²	49.4	44%	0.444	27%	0.274	S	S	.	.			trans	54.4	31.5	-179.9	-53	-156.7	124.6	0	0	114	K60 S79 V82 L86 Y87	K60-E84 IonicContact NZ-OE1 3.8Å; K60-E84 PolarHBondContact NZ-OE1 2.97Å; S79-E84 CarbonylContact O-C 3.54Å; S79-E84 WeakPolarHBondContact O-CA 3.39Å; S79-E84 PolarHBondContact O-N 2.93Å; V82-E84 VanDerWaalsContact C-N 3.34Å; E84-L86 VanDerWaalsContact C-N 3.26Å; E84-L86 PolarHBondContact O-N 3.22Å; E84-Y87 WeakPolarHBondContact O-CE1 3.24Å; E84-Y87 PolarHBondContact O-OH 3.21Å
85	T	91.8	Very high	90.4	Very high	46 Å²	46	53.5 Å²	53.5	28%	0.282	29%	0.29	S	S	.	.			trans	-78.7	-10.2	175.4	65.1	0	0	0	0	113.3	S79 T83 D106	S79-T85 WeakPolarHBondContact CB-OG1 3.48Å; S79-T85 PolarHBondContact O-N 2.8Å; T83-T85 PolarHBondContact O-N 2.88Å; T85-D106 WeakPolarHBondContact CB-OD1 3.39Å; T85-D106 PolarHBondContact OG1-OD1 3.18Å
86	L	93.4	Very high	89.4	Confident	3 Å²	3	54 Å²	54	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112.8	175.9	-174.7	151.9	0	0	0	110.6	A76 S79 L80 E84 F88 I104 W105 V112 V227	A76-L86 HydrophobicContact CB-CD1 4.15Å; S79-L86 PolarHBondContact O-N 2.01Å; L80-L86 HydrophobicContact CB-CD2 4.31Å; L80-L86 HydrophobicContact CD1-CD2 3.51Å; L80-L86 HydrophobicContact CG-CD2 4.46Å; E84-L86 VanDerWaalsContact C-N 3.26Å; E84-L86 PolarHBondContact O-N 3.22Å; L86-F88 HydrophobicContact CD2-CD1 4.07Å; L86-F88 HydrophobicContact CD2-CE1 3.63Å; L86-I104 WeakPolarHBondContact CA-O 3.38Å; L86-W105 HydrophobicContact CB-CB 4.41Å; L86-W105 HydrophobicContact CB-CG 4.18Å; L86-W105 HydrophobicContact CD1-CB 4.03Å; L86-W105 HydrophobicContact CD1-CD2 3.68Å; L86-W105 HydrophobicContact CD1-CE3 3.97Å; L86-W105 HydrophobicContact CD1-CG 3.68Å; L86-W105 HydrophobicContact CG-CB 4.14Å; L86-W105 HydrophobicContact CG-CG 4.15Å; L86-V112 HydrophobicContact CD2-CG2 4.3Å; L86-V227 HydrophobicContact CD1-CG2 3.71Å
87	Y	90.4	Very high	88.4	Confident	138 Å²	138	56.6 Å²	56.6	54%	0.541	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.5	-173.7	-60.5	-75.9	0	0	0	113	E84 G103 I104	E84-Y87 WeakPolarHBondContact O-CE1 3.24Å; E84-Y87 PolarHBondContact O-OH 3.21Å; Y87-G103 WeakPolarHBondContact O-CA 3.43Å; Y87-I104 PolarHBondContact N-O 3.32Å; Y87-I104 PolarHBondContact O-N 2.75Å
88	F	91.8	Very high	87.8	Confident	50 Å²	50	58.4 Å²	58.4	22%	0.219	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	113.7	172.8	-66	21.4	0	0	0	108	G56 K60 L80 L86 Y101 V112 L225	G56-F88 WeakPolarHBondContact O-CE2 3.37Å; K60-F88 HydrophobicContact CB-CE2 4.37Å; K60-F88 HydrophobicContact CB-CZ 4.27Å; L80-F88 HydrophobicContact CD1-CE1 3.53Å; L80-F88 HydrophobicContact CD1-CZ 3.92Å; L86-F88 HydrophobicContact CD2-CD1 4.07Å; L86-F88 HydrophobicContact CD2-CE1 3.63Å; F88-Y101 HydrophobicContact CB-CG 4.36Å; F88-Y101 AromaticContact CD2-CD2 3.88Å; F88-Y101 HydrophobicContact CD2-CD2 3.88Å; F88-Y101 HydrophobicContact CD2-CE2 4.23Å; F88-Y101 HydrophobicContact CD2-CG 4.1Å; F88-Y101 HydrophobicContact CE2-CD2 4.31Å; F88-Y101 HydrophobicContact CG-CG 4.45Å; F88-V112 HydrophobicContact CD1-CG1 4.36Å; F88-V112 HydrophobicContact CD1-CG2 4.26Å; F88-V112 HydrophobicContact CE1-CB 4.43Å; F88-V112 HydrophobicContact CE1-CG1 3.77Å; F88-V112 HydrophobicContact CE1-CG2 4.31Å; F88-V112 HydrophobicContact CE2-CG1 4.46Å; F88-V112 HydrophobicContact CZ-CG1 3.86Å; F88-L225 HydrophobicContact CE1-CD1 4.45Å; F88-L225 HydrophobicContact CZ-CD1 3.73Å
89	G	88.8	Confident	87.4	Confident	53 Å²	53	54.9 Å²	54.9	55%	0.546	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-120.7	176.7	0	0	0	0	0	112	L102	G89-L102 CarbonylContact C-O 3.55Å; G89-L102 WeakPolarHBondContact CA-O 3.43Å; G89-L102 PolarHBondContact N-O 3.02Å
90	K	88.8	Confident	87.2	Confident	145 Å²	145	55.5 Å²	55.5	63%	0.63	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	130.5	-173.5	-174.4	-177.4	177.2	-174.6	0	111.4	L92 Y101 L102	K90-L92 HydrophobicContact CD-CD2 4.41Å; K90-Y101 CarbonylContact O-C 3.34Å; K90-Y101 WeakPolarHBondContact O-CA 3.32Å; K90-L102 HydrophobicContact CB-CB 4.33Å; K90-L102 HydrophobicContact CB-CD1 4.14Å; K90-L102 HydrophobicContact CB-CG 4.5Å; K90-L102 HydrophobicContact CD-CD1 4.42Å; K90-L102 PolarHBondContact O-N 2.79Å
91	C	89.2	Confident	87	Confident	16 Å²	16	55.9 Å²	55.9	11%	0.108	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	130.8	172.1	-176	0	0	0	0	111.8	C54 S93 Y101	C54-C91 VanDerWaalsContact CA-SG 3.59Å; C54-C91 HydrophobicContact CB-CB 3.73Å; C54-C91 WeakPolarHBondContact CB-SG 3.07Å; C54-C91 WeakPolarHBondContact SG-CB 3.34Å; C54-C91 CovalentContact SG-SG 2.03Å; C54-C91 PolarHBondContact SG-SG 2.91Å; C91-S93 PolarHBondContact SG-OG 3.11Å; C91-S93 VanDerWaalsContact SG-OG 3.36Å; C91-Y101 HydrophobicContact CB-CD1 3.97Å; C91-Y101 HydrophobicContact CB-CE1 3.7Å
92	L	85.9	Confident	86.9	Confident	59 Å²	59	58.5 Å²	58.5	31%	0.309	31%	0.314	S	S	.	.			trans	-119.5	8.4	176.3	-58.3	-177.2	0	0	0	112.3	K90 T94 M100 L102	K90-L92 HydrophobicContact CD-CD2 4.41Å; L92-T94 PolarHBondContact O-N 3.13Å; L92-M100 HydrophobicContact CB-CB 4.16Å; L92-M100 PolarHBondContact N-O 3.36Å; L92-L102 HydrophobicContact CD1-CD1 4.39Å; L92-L102 HydrophobicContact CD1-CD2 3.64Å; L92-L102 HydrophobicContact CD1-CG 3.64Å; L92-L102 HydrophobicContact CD2-CD1 4.49Å; L92-L102 HydrophobicContact CD2-CG 4.4Å; L92-L102 HydrophobicContact CG-CG 4.05Å
93	S	84.1	Confident	86.7	Confident	12 Å²	12	54.7 Å²	54.7	8%	0.084	29%	0.292	C	S	.	.			trans	-60.7	129.8	-176.4	-52.1	0	0	0	0	112.4	L53 C91 Q99 M100	L53-S93 WeakPolarHBondContact O-CB 3.33Å; L53-S93 PolarHBondContact O-OG 2.81Å; C91-S93 PolarHBondContact SG-OG 3.11Å; C91-S93 VanDerWaalsContact SG-OG 3.36Å; S93-Q99 VanDerWaalsContact OG-CA 3.24Å; S93-Q99 WeakPolarHBondContact OG-CA 3.34Å; S93-M100 PolarHBondContact N-O 2.77Å; S93-M100 PolarHBondContact OG-N 3.07Å
94	T	75.3	Confident	86.7	Confident	102 Å²	102	55.6 Å²	55.6	63%	0.626	29%	0.294	S	S	*	.	S	Bend	trans	-106.8	-14.7	172.7	53.8	0	0	0	0	112.8	L92	L92-T94 PolarHBondContact O-N 3.13Å
95	K	77.2	Confident	86.9	Confident	93 Å²	93	51.9 Å²	51.9	40%	0.404	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-131.9	141.1	177.8	-64.8	-171.5	176.2	-169	0	109.6	N97 N98	K95-N97 VanDerWaalsContact C-N 3.32Å; K95-N97 PolarHBondContact O-N 3.03Å; K95-N98 HydrophobicContact CB-CB 4.47Å; K95-N98 CarbonylContact O-C 3.58Å; K95-N98 PolarHBondContact O-N 2.88Å
96	P	73.8	Confident	86.7	Confident	61 Å²	61	54.1 Å²	54.1	40%	0.396	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-36.6	-177.3	24.1	-33.2	0	0	0	112.7	N98	P96-N98 VanDerWaalsContact C-N 3.3Å; P96-N98 PolarHBondContact O-N 3.11Å
97	N	75.8	Confident	86.5	Confident	55 Å²	55	61.4 Å²	61.4	29%	0.294	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-21	-179	-57.9	-21.2	0	0	0	113.4	K95 M116 Q118	K95-N97 VanDerWaalsContact C-N 3.32Å; K95-N97 PolarHBondContact O-N 3.03Å; N97-M116 PolarHBondContact O-N 3.41Å; N97-Q118 PolarHBondContact ND2-NE2 2.97Å; N97-Q118 WeakPolarHBondContact OD1-CG 2.96Å
98	N	81.4	Confident	86.5	Confident	38 Å²	38	59.7 Å²	59.7	20%	0.203	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	94.2	-173.8	-70.4	-45.7	0	0	0	109.1	K95 P96 R314	K95-N98 HydrophobicContact CB-CB 4.47Å; K95-N98 CarbonylContact O-C 3.58Å; K95-N98 PolarHBondContact O-N 2.88Å; P96-N98 VanDerWaalsContact C-N 3.3Å; P96-N98 PolarHBondContact O-N 3.11Å; N98-R314 PolarHBondContact ND2-NH1 3.19Å
99	Q	87	Confident	86.5	Confident	1 Å²	1	61 Å²	61	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	136.7	-175.5	-55.5	-166.2	-5.4	0	0	110.9	R55 S93 Y101 K113 C114 M116	R55-Q99 VanDerWaalsContact CB-NE2 3.26Å; R55-Q99 VanDerWaalsContact N-NE2 3.16Å; R55-Q99 PolarHBondContact O-OE1 3.29Å; S93-Q99 VanDerWaalsContact OG-CA 3.24Å; S93-Q99 WeakPolarHBondContact OG-CA 3.34Å; Q99-Y101 HydrophobicContact CB-CD2 4.44Å; Q99-Y101 HydrophobicContact CB-CE2 3.55Å; Q99-Y101 PolarHBondContact OE1-OH 3.41Å; Q99-K113 WeakPolarHBondContact O-CA 3.39Å; Q99-C114 PolarHBondContact N-O 2.86Å; Q99-C114 PolarHBondContact O-N 3.41Å; Q99-M116 HydrophobicContact CG-CG 3.78Å
100	M	90.3	Very high	86.8	Confident	26 Å²	26	58.5 Å²	58.5	13%	0.128	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.7	-179.2	-61.1	-170.5	-78.1	0	0	108.8	L92 S93 V112 K113	L92-M100 HydrophobicContact CB-CB 4.16Å; L92-M100 PolarHBondContact N-O 3.36Å; S93-M100 PolarHBondContact N-O 2.77Å; S93-M100 PolarHBondContact OG-N 3.07Å; M100-V112 WeakPolarHBondContact CA-O 3.4Å; M100-K113 HydrophobicContact CG-CG 4.13Å; M100-K113 HydrophobicContact SD-CD 4.48Å
101	Y	91.4	Very high	87	Confident	9 Å²	9	52.2 Å²	52.2	4%	0.035	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.4	179.5	-61.5	-86.6	0	0	0	110	C54 R55 G56 F88 K90 C91 Q99 G103 V111 V112	C54-Y101 VanDerWaalsContact CA-OH 3.24Å; C54-Y101 WeakPolarHBondContact CA-OH 3.46Å; R55-Y101 PolarHBondContact N-OH 2.79Å; G56-Y101 VanDerWaalsContact CA-CZ 3.44Å; G56-Y101 VanDerWaalsContact CA-OH 3.24Å; G56-Y101 WeakPolarHBondContact CA-OH 3.24Å; G56-Y101 PolarHBondContact N-OH 2.9Å; F88-Y101 HydrophobicContact CB-CG 4.36Å; F88-Y101 AromaticContact CD2-CD2 3.88Å; F88-Y101 HydrophobicContact CD2-CD2 3.88Å; F88-Y101 HydrophobicContact CD2-CE2 4.23Å; F88-Y101 HydrophobicContact CD2-CG 4.1Å; F88-Y101 HydrophobicContact CE2-CD2 4.31Å; F88-Y101 HydrophobicContact CG-CG 4.45Å; K90-Y101 CarbonylContact O-C 3.34Å; K90-Y101 WeakPolarHBondContact O-CA 3.32Å; C91-Y101 HydrophobicContact CB-CD1 3.97Å; C91-Y101 HydrophobicContact CB-CE1 3.7Å; Q99-Y101 HydrophobicContact CB-CD2 4.44Å; Q99-Y101 HydrophobicContact CB-CE2 3.55Å; Q99-Y101 PolarHBondContact OE1-OH 3.41Å; Y101-G103 PolarHBondContact O-N 2.75Å; Y101-V111 CarbonylContact O-C 3.26Å; Y101-V111 WeakPolarHBondContact O-CA 3.44Å; Y101-V112 PolarHBondContact N-O 3.17Å; Y101-V112 PolarHBondContact O-N 2.79Å
102	L	92.2	Very high	87.3	Confident	66 Å²	66	51.6 Å²	51.6	35%	0.346	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	130.4	157.6	-67.3	179.9	0	0	0	107.7	G89 K90 L92 V111	G89-L102 CarbonylContact C-O 3.55Å; G89-L102 WeakPolarHBondContact CA-O 3.43Å; G89-L102 PolarHBondContact N-O 3.02Å; K90-L102 HydrophobicContact CB-CB 4.33Å; K90-L102 HydrophobicContact CB-CD1 4.14Å; K90-L102 HydrophobicContact CB-CG 4.5Å; K90-L102 HydrophobicContact CD-CD1 4.42Å; K90-L102 PolarHBondContact O-N 2.79Å; L92-L102 HydrophobicContact CD1-CD1 4.39Å; L92-L102 HydrophobicContact CD1-CD2 3.64Å; L92-L102 HydrophobicContact CD1-CG 3.64Å; L92-L102 HydrophobicContact CD2-CD1 4.49Å; L92-L102 HydrophobicContact CD2-CG 4.4Å; L92-L102 HydrophobicContact CG-CG 4.05Å; L102-V111 HydrophobicContact CD2-CG2 4.09Å
103	G	90.9	Very high	87.6	Confident	8 Å²	8	49.3 Å²	49.3	8%	0.082	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	170.9	179.3	0	0	0	0	0	111.9	Y87 Y101 G110	Y87-G103 WeakPolarHBondContact O-CA 3.43Å; Y101-G103 PolarHBondContact O-N 2.75Å; G103-G110 PolarHBondContact N-O 2.86Å; G103-G110 PolarHBondContact O-N 2.73Å; G103-G110 VanDerWaalsContact O-O 3.07Å
104	I	92.6	Very high	87.8	Confident	91 Å²	91	48.9 Å²	48.9	47%	0.467	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	130.2	171.6	-58.6	172.7	0	0	0	106	L86 Y87 L108	L86-I104 WeakPolarHBondContact CA-O 3.38Å; Y87-I104 PolarHBondContact N-O 3.32Å; Y87-I104 PolarHBondContact O-N 2.75Å; I104-L108 WeakPolarHBondContact CA-O 3.12Å
105	W	93.6	Very high	88.2	Confident	18 Å²	18	46.1 Å²	46.1	7%	0.068	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	119.4	174.7	-177.4	15.9	0	0	0	109	A76 S79 L86 N107 L108 M219 V227	A76-W105 HydrophobicContact CB-CH2 3.57Å; A76-W105 HydrophobicContact CB-CZ2 3.9Å; A76-W105 HydrophobicContact CB-CZ3 3.93Å; S79-W105 PolarHBondContact OG-NE1 2.84Å; L86-W105 HydrophobicContact CB-CB 4.41Å; L86-W105 HydrophobicContact CB-CG 4.18Å; L86-W105 HydrophobicContact CD1-CB 4.03Å; L86-W105 HydrophobicContact CD1-CD2 3.68Å; L86-W105 HydrophobicContact CD1-CE3 3.97Å; L86-W105 HydrophobicContact CD1-CG 3.68Å; L86-W105 HydrophobicContact CG-CB 4.14Å; L86-W105 HydrophobicContact CG-CG 4.15Å; W105-N107 VanDerWaalsContact C-N 3.26Å; W105-N107 PolarHBondContact O-N 3.44Å; W105-L108 PolarHBondContact N-O 3.03Å; W105-L108 WeakPolarHBondContact O-CB 3.34Å; W105-L108 PolarHBondContact O-N 3.24Å; W105-M219 HydrophobicContact CB-CE 4.41Å; W105-M219 HydrophobicContact CE3-CB 3.87Å; W105-M219 HydrophobicContact CE3-CE 4.24Å; W105-M219 VanDerWaalsContact CZ3-C 3.49Å; W105-M219 HydrophobicContact CZ3-CB 3.71Å; W105-M219 WeakPolarHBondContact CZ3-O 3.43Å; W105-V227 HydrophobicContact CE3-CB 4.01Å; W105-V227 HydrophobicContact CE3-CG1 4.08Å; W105-V227 HydrophobicContact CE3-CG2 4.21Å; W105-V227 HydrophobicContact CZ3-CB 4.23Å; W105-V227 HydrophobicContact CZ3-CG2 4.47Å
106	D	87.5	Confident	88.2	Confident	93 Å²	93	42.7 Å²	42.7	50%	0.497	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	44.8	-179.3	-59.9	-25.4	0	0	0	112.7	T85 L108	T85-D106 WeakPolarHBondContact CB-OD1 3.39Å; T85-D106 PolarHBondContact OG1-OD1 3.18Å; D106-L108 PolarHBondContact O-N 3.31Å
107	N	87.8	Confident	87.7	Confident	155 Å²	155	46 Å²	46	83%	0.829	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	8.1	-176.6	-57.2	-46.1	0	0	0	116.2	W105	W105-N107 VanDerWaalsContact C-N 3.26Å; W105-N107 PolarHBondContact O-N 3.44Å
108	L	91.6	Very high	86.6	Confident	103 Å²	103	50 Å²	50	54%	0.539	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132.4	172.8	-63.5	173.2	0	0	0	110.2	I104 W105 D106 M219	I104-L108 WeakPolarHBondContact CA-O 3.12Å; W105-L108 PolarHBondContact N-O 3.03Å; W105-L108 WeakPolarHBondContact O-CB 3.34Å; W105-L108 PolarHBondContact O-N 3.24Å; D106-L108 PolarHBondContact O-N 3.31Å; L108-M219 HydrophobicContact CB-CE 3.71Å; L108-M219 HydrophobicContact CD1-CE 4.06Å
109	P	92.5	Very high	84.4	Confident	77 Å²	77	51.9 Å²	51.9	50%	0.5	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136.1	173.6	30.9	-34.2	0	0	0	109.9	S230	P109-S230 WeakPolarHBondContact CB-OG 3.3Å
110	G	93.2	Very high	81.8	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	169.6	-179.1	0	0	0	0	0	112.2	G103 M228	G103-G110 PolarHBondContact N-O 2.86Å; G103-G110 PolarHBondContact O-N 2.73Å; G103-G110 VanDerWaalsContact O-O 3.07Å; G110-M228 CarbonylContact C-O 3.41Å; G110-M228 WeakPolarHBondContact CA-O 3.38Å
111	V	94.4	Very high	79	Confident	13 Å²	13	65.3 Å²	65.3	8%	0.079	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119.9	171	176.9	0	0	0	0	107.8	Y101 L102 K113 V227 M228	Y101-V111 CarbonylContact O-C 3.26Å; Y101-V111 WeakPolarHBondContact O-CA 3.44Å; L102-V111 HydrophobicContact CD2-CG2 4.09Å; V111-K113 HydrophobicContact CG1-CG 4.16Å; V111-V227 WeakPolarHBondContact O-CA 3.49Å; V111-M228 HydrophobicContact CB-CG 3.88Å; V111-M228 HydrophobicContact CG1-CG 4.49Å; V111-M228 PolarHBondContact N-O 3.35Å; V111-M228 PolarHBondContact O-N 3.29Å
112	V	94.6	Very high	76.2	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.012	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	121.3	174.9	-174.4	0	0	0	0	108.4	L86 F88 M100 Y101 L225 V227	L86-V112 HydrophobicContact CD2-CG2 4.3Å; F88-V112 HydrophobicContact CD1-CG1 4.36Å; F88-V112 HydrophobicContact CD1-CG2 4.26Å; F88-V112 HydrophobicContact CE1-CB 4.43Å; F88-V112 HydrophobicContact CE1-CG1 3.77Å; F88-V112 HydrophobicContact CE1-CG2 4.31Å; F88-V112 HydrophobicContact CE2-CG1 4.46Å; F88-V112 HydrophobicContact CZ-CG1 3.86Å; M100-V112 WeakPolarHBondContact CA-O 3.4Å; Y101-V112 PolarHBondContact N-O 3.17Å; Y101-V112 PolarHBondContact O-N 2.79Å; V112-L225 HydrophobicContact CG1-CD1 3.81Å; V112-L225 HydrophobicContact CG1-CD2 3.95Å; V112-L225 HydrophobicContact CG1-CG 3.89Å; V112-V227 HydrophobicContact CG2-CG1 4.45Å; V112-V227 HydrophobicContact CG2-CG2 4.13Å
113	K	92.5	Very high	73.2	Confident	11 Å²	11	75.4 Å²	75.4	5%	0.048	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130	174.7	-65.8	-172.5	170.9	166.5	0	109.1	Q99 M100 V111 E202 L225 Y226 M228 V311	Q99-K113 WeakPolarHBondContact O-CA 3.39Å; M100-K113 HydrophobicContact CG-CG 4.13Å; M100-K113 HydrophobicContact SD-CD 4.48Å; V111-K113 HydrophobicContact CG1-CG 4.16Å; K113-E202 IonicContact NZ-OE1 3.59Å; K113-E202 PolarHBondContact NZ-OE1 3.06Å; K113-E202 IonicContact NZ-OE2 2.75Å; K113-L225 WeakPolarHBondContact O-CA 3.28Å; K113-Y226 HydrophobicContact CB-CD1 4.49Å; K113-Y226 HydrophobicContact CB-CD2 4.37Å; K113-Y226 HydrophobicContact CB-CE1 3.97Å; K113-Y226 HydrophobicContact CB-CE2 3.83Å; K113-Y226 HydrophobicContact CD-CE2 3.67Å; K113-Y226 WeakPolarHBondContact CD-OH 2.96Å; K113-Y226 HydrophobicContact CG-CE2 4.11Å; K113-Y226 PolarHBondContact N-O 3.19Å; K113-Y226 PolarHBondContact O-N 3.02Å; K113-Y226 VanDerWaalsContact O-N 3.11Å; K113-M228 HydrophobicContact CD-SD 4.05Å; K113-M228 VanDerWaalsContact CE-SD 3.57Å; K113-M228 PolarHBondContact NZ-SD 2.9Å; K113-M228 VanDerWaalsContact NZ-SD 3.36Å; K113-V311 PolarHBondContact NZ-O 2.83Å
114	C	88.9	Confident	70.6	Confident	3 Å²	3	85 Å²	85	2%	0.02	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134.4	-179.4	-176.6	0	0	0	0	110.7	C59 Q99 L225	C59-C114 HydrophobicContact CB-CB 4.04Å; C59-C114 WeakPolarHBondContact CB-SG 3.2Å; C59-C114 WeakPolarHBondContact SG-CB 3.19Å; C59-C114 CovalentContact SG-SG 2.01Å; C59-C114 PolarHBondContact SG-SG 3.44Å; Q99-C114 PolarHBondContact N-O 2.86Å; Q99-C114 PolarHBondContact O-N 3.41Å; C114-L225 HydrophobicContact CB-CD1 4.26Å
115	Q	83.5	Confident	67.7	Low	45 Å²	45	83.3 Å²	83.3	21%	0.21	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.3	173.2	-59.6	-155.1	-8.9	0	0	110	L200	Q115-L200 HydrophobicContact CG-CD1 4.44Å
116	M	76.6	Confident	65	Low	21 Å²	21	88.9 Å²	88.9	10%	0.103	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-99.3	129.4	174.1	-64.6	-67	-68.6	0	0	108.4	R55 D58 C59 N97 Q99 Q118	R55-M116 HydrophobicContact CB-CE 4.29Å; D58-M116 HydrophobicContact CB-CE 3.99Å; C59-M116 HydrophobicContact CB-SD 3.73Å; N97-M116 PolarHBondContact O-N 3.41Å; Q99-M116 HydrophobicContact CG-CG 3.78Å; M116-Q118 PolarHBondContact O-N 2.91Å
117	E	63.9	Low	62.4	Low	129 Å²	129	90.9 Å²	90.9	60%	0.603	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-61.6	131.4	170.3	-70.5	170.4	-161.9	0	0	109.2	K66 A119	K66-E117 IonicContact NZ-OE1 2.79Å; K66-E117 PolarHBondContact NZ-OE1 3.33Å; K66-E117 VanDerWaalsContact NZ-OE1 3.13Å; E117-A119 PolarHBondContact O-N 2.92Å
118	Q	52.9	Low	59.9	Low	140 Å²	140	91.7 Å²	91.7	65%	0.654	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-66.1	122.9	176	-78.3	177.7	10.7	0	0	109.9	N97 M116	N97-Q118 PolarHBondContact ND2-NE2 2.97Å; N97-Q118 WeakPolarHBondContact OD1-CG 2.96Å; M116-Q118 PolarHBondContact O-N 2.91Å
119	A	34.6	Very low	57	Low	77 Å²	77	92.1 Å²	92.1	64%	0.636	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-73.8	118.4	145.9	0	0	0	0	0	106.3	E117 H121	E117-A119 PolarHBondContact O-N 2.92Å; A119-H121 PolarHBondContact O-N 3.24Å
120	L	32.4	Very low	54.1	Low	157 Å²	157	92.7 Å²	92.7	82%	0.822	49%	0.494	S	S	*	.			trans	-32.7	99.3	175.9	-98.7	147.9	0	0	0	112.8
121	H	32.2	Very low	51.3	Low	153 Å²	153	104.3 Å²	104.3	71%	0.708	54%	0.538	S	S	*	.			trans	-108.6	109.3	159	-88.9	-82.3	0	0	0	107.1	A119 D123	A119-H121 PolarHBondContact O-N 3.24Å; H121-D123 PolarHBondContact O-N 3.18Å
122	L	32.8	Very low	48.6	Very low	142 Å²	142	110.4 Å²	110.4	74%	0.743	56%	0.563	S	S	*	*			trans	-65.6	81.3	170	-88.3	140.6	0	0	0	109	F124	L122-F124 PolarHBondContact O-N 3Å
123	D	27.4	Very low	45.7	Very low	145 Å²	145	119.2 Å²	119.2	78%	0.775	60%	0.604	S	S	*	*			trans	-81.2	109.4	163.4	-82.6	-22.8	0	0	0	108.3	H121 G125	H121-D123 PolarHBondContact O-N 3.18Å; D123-G125 PolarHBondContact O-N 3.15Å
124	F	36.4	Very low	43.5	Very low	208 Å²	208	122 Å²	122	91%	0.912	62%	0.619	S	S	*	*			trans	-68.5	78.1	164.5	-82	-90.3	0	0	0	108.8	L122	L122-F124 PolarHBondContact O-N 3Å
125	G	32.5	Very low	41.7	Very low	56 Å²	56	126.1 Å²	126.1	58%	0.577	64%	0.644	S	S	*	*	S	Bend	trans	-148.7	128.9	173.5	0	0	0	0	0	108.3	D123 E127	D123-G125 PolarHBondContact O-N 3.15Å; G125-E127 PolarHBondContact O-N 3.36Å
126	T	36.1	Very low	40.6	Very low	136 Å²	136	124.8 Å²	124.8	83%	0.834	64%	0.638	S	S	*	*	S	Bend	trans	-59.1	84.4	-173.1	43	0	0	0	0	113.6
127	E	34.5	Very low	40.2	Very low	134 Å²	134	124.2 Å²	124.2	63%	0.626	64%	0.635	S	S	*	*			trans	-140.6	86.5	156.7	-72.7	-168.1	161.3	0	0	107.7	G125 E129	G125-E127 PolarHBondContact O-N 3.36Å; E127-E129 PolarHBondContact O-N 2.86Å
128	L	34.7	Very low	40.8	Very low	172 Å²	172	122.8 Å²	122.8	90%	0.901	63%	0.631	S	S	*	*			trans	-70.1	72.5	160.2	-93.4	135.7	0	0	0	107.8	P130	L128-P130 WeakPolarHBondContact O-CD 3.26Å
129	E	31.3	Very low	42.1	Very low	113 Å²	113	121.9 Å²	121.9	53%	0.528	63%	0.625	S	S	.	*			trans	-68.2	115	149	-73.2	-164.5	166.1	0	0	105.3	E127 R131 K315	E127-E129 PolarHBondContact O-N 2.86Å; E129-R131 PolarHBondContact O-N 3.43Å; E129-K315 IonicContact OE1-NZ 3.87Å; E129-K315 PolarHBondContact OE1-NZ 3.49Å
130	P	30.3	Very low	44.5	Very low	88 Å²	88	118.3 Å²	118.3	57%	0.571	60%	0.595	S	S	*	*			trans	-61	118.5	-176.2	22.5	-29.9	0	0	0	108.6	L128 K132 L325	L128-P130 WeakPolarHBondContact O-CD 3.26Å; P130-K132 PolarHBondContact O-N 2.95Å; P130-L325 HydrophobicContact CG-CD2 3.98Å
131	R	35.1	Very low	47.1	Very low	246 Å²	246	115.3 Å²	115.3	93%	0.928	58%	0.584	S	S	*	*			trans	-23.9	96.7	167.2	-67.7	173.7	176.2	165.5	-2.2	111.8	E129	E129-R131 PolarHBondContact O-N 3.43Å
132	K	38.3	Very low	49.6	Very low	140 Å²	140	118 Å²	118	61%	0.609	59%	0.588	S	S	*	*			trans	-100.6	103.6	146	-72.9	-178.9	175.7	176.4	0	105.1	P130 I134	P130-K132 PolarHBondContact O-N 2.95Å; K132-I134 HydrophobicContact CB-CD1 4.31Å; K132-I134 HydrophobicContact CB-CG1 3.43Å; K132-I134 VanDerWaalsContact CB-CG1 3.43Å; K132-I134 HydrophobicContact CD-CG1 4.31Å; K132-I134 PolarHBondContact O-N 3.36Å
133	E	32.1	Very low	51.9	Low	187 Å²	187	115 Å²	115	87%	0.874	59%	0.59	S	S	*	*			trans	-57.5	89.9	146.2	-77	176.3	156.4	0	0	105.3	V135	E133-V135 VanDerWaalsContact C-N 3.29Å; E133-V135 PolarHBondContact O-N 3.3Å
134	I	46.3	Very low	54.8	Low	71 Å²	71	109.8 Å²	109.8	36%	0.364	56%	0.564	S	S	.	*			trans	-79.2	94	179.5	-52.1	172.2	0	0	0	105.1	K132 L136	K132-I134 HydrophobicContact CB-CD1 4.31Å; K132-I134 HydrophobicContact CB-CG1 3.43Å; K132-I134 VanDerWaalsContact CB-CG1 3.43Å; K132-I134 HydrophobicContact CD-CG1 4.31Å; K132-I134 PolarHBondContact O-N 3.36Å; I134-L136 HydrophobicContact CB-CD1 3.83Å; I134-L136 HydrophobicContact CD1-CD1 4.34Å; I134-L136 HydrophobicContact CG2-CB 4.03Å; I134-L136 HydrophobicContact CG2-CD1 3.42Å; I134-L136 VanDerWaalsContact CG2-CD1 3.42Å; I134-L136 HydrophobicContact CG2-CG 3.81Å; I134-L136 PolarHBondContact O-N 3.09Å
135	V	52.1	Low	57.3	Low	88 Å²	88	104.1 Å²	104.1	53%	0.533	55%	0.547	S	S	.	.			trans	-69	80.3	160.3	-149.3	0	0	0	0	107	E133 F137 D138	E133-V135 VanDerWaalsContact C-N 3.29Å; E133-V135 PolarHBondContact O-N 3.3Å; V135-F137 PolarHBondContact O-N 3.38Å; V135-F137 VanDerWaalsContact O-N 3.08Å; V135-D138 HydrophobicContact CB-CB 3.88Å; V135-D138 HydrophobicContact CG1-CB 3.78Å; V135-D138 WeakPolarHBondContact CG1-OD1 3.48Å; V135-D138 WeakPolarHBondContact CG1-OD2 3.44Å; V135-D138 PolarHBondContact O-N 3.46Å; V135-D138 VanDerWaalsContact O-N 3.17Å
136	L	60.9	Low	60.1	Low	17 Å²	17	104.9 Å²	104.9	9%	0.089	54%	0.54	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.5	-156.5	-142.5	109.9	0	0	0	113.7	I134 A196 D224	I134-L136 HydrophobicContact CB-CD1 3.83Å; I134-L136 HydrophobicContact CD1-CD1 4.34Å; I134-L136 HydrophobicContact CG2-CB 4.03Å; I134-L136 HydrophobicContact CG2-CD1 3.42Å; I134-L136 VanDerWaalsContact CG2-CD1 3.42Å; I134-L136 HydrophobicContact CG2-CG 3.81Å; I134-L136 PolarHBondContact O-N 3.09Å; L136-A196 HydrophobicContact CD2-CB 3.69Å; L136-A196 HydrophobicContact CG-CB 4.02Å; L136-A196 WeakPolarHBondContact O-CB 3.02Å; L136-D224 HydrophobicContact CD2-CB 3.24Å; L136-D224 WeakPolarHBondContact CD2-OD2 3.4Å
137	F	68.3	Low	62.7	Low	9 Å²	9	104.1 Å²	104.1	4%	0.039	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	13.7	-177.4	-54.5	-68.9	0	0	0	113.9	K66 V71 I72 V135 K139 K192 A196 D224	K66-F137 HydrophobicContact CD-CD2 3.74Å; K66-F137 HydrophobicContact CD-CE2 3.7Å; V71-F137 HydrophobicContact CG1-CB 4.03Å; I72-F137 HydrophobicContact CG2-CB 4.4Å; I72-F137 HydrophobicContact CG2-CD1 3.37Å; I72-F137 HydrophobicContact CG2-CD2 4.11Å; I72-F137 HydrophobicContact CG2-CE1 3.47Å; I72-F137 VanDerWaalsContact CG2-CE1 3.47Å; I72-F137 HydrophobicContact CG2-CE2 4.19Å; I72-F137 HydrophobicContact CG2-CG 3.69Å; I72-F137 HydrophobicContact CG2-CZ 3.86Å; V135-F137 PolarHBondContact O-N 3.38Å; V135-F137 VanDerWaalsContact O-N 3.08Å; F137-K139 VanDerWaalsContact C-N 3.3Å; F137-K192 HydrophobicContact CD1-CB 4.48Å; F137-K192 VanDerWaalsContact O-CD 3.28Å; F137-K192 WeakPolarHBondContact O-CD 3.31Å; F137-K192 WeakPolarHBondContact O-CE 3.32Å; F137-K192 PolarHBondContact O-NZ 2.86Å; F137-A196 HydrophobicContact CD1-CB 4.02Å; F137-A196 HydrophobicContact CE1-CB 3.64Å; F137-A196 HydrophobicContact CZ-CB 4.4Å; F137-D224 HydrophobicContact CE1-CB 4.4Å; F137-D224 HydrophobicContact CZ-CB 3.93Å; F137-D224 WeakPolarHBondContact CZ-OD1 3.48Å
138	D	75.2	Confident	65.4	Low	100 Å²	100	102.7 Å²	102.7	54%	0.535	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-22.3	177.2	-90.4	15.7	0	0	0	112.8	V135 P140	V135-D138 HydrophobicContact CB-CB 3.88Å; V135-D138 HydrophobicContact CG1-CB 3.78Å; V135-D138 WeakPolarHBondContact CG1-OD1 3.48Å; V135-D138 WeakPolarHBondContact CG1-OD2 3.44Å; V135-D138 PolarHBondContact O-N 3.46Å; V135-D138 VanDerWaalsContact O-N 3.17Å; D138-P140 CarbonylContact O-C 3.46Å
139	K	81.5	Confident	68.2	Low	121 Å²	121	94.7 Å²	94.7	53%	0.526	48%	0.477	S	S	.	.			trans	-112	137.3	177.7	-66.5	-179.8	-178.2	177.9	0	109.6	F137 M152 W195	F137-K139 VanDerWaalsContact C-N 3.3Å; K139-M152 HydrophobicContact CB-CE 4.46Å; K139-W195 HydrophobicContact CB-CG 4.36Å
140	P	85.1	Confident	71.2	Confident	1 Å²	1	92 Å²	92	1%	0.006	46%	0.463	C	S	.	.	S	Bend	cis	-73.4	157.8	-6.4	28.9	-32.9	0	0	0	113.7	D138 T144 F149 M152 L188 A191 K192	D138-P140 CarbonylContact O-C 3.46Å; P140-T144 HydrophobicContact CB-CG2 3.88Å; P140-F149 HydrophobicContact CB-CD2 4.46Å; P140-F149 HydrophobicContact CG-CD2 3.97Å; P140-F149 HydrophobicContact CG-CE2 4.31Å; P140-M152 HydrophobicContact CB-CE 4.22Å; P140-M152 HydrophobicContact CB-SD 4.2Å; P140-L188 HydrophobicContact CG-CD1 4.18Å; P140-A191 HydrophobicContact CG-CB 3.66Å; P140-K192 HydrophobicContact CG-CG 4.48Å; P140-K192 WeakPolarHBondContact O-CE 3.3Å
141	T	86.2	Confident	74.2	Confident	95 Å²	95	92.1 Å²	92.1	58%	0.583	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-73.5	156.3	178.6	50	0	0	0	0	111.4	G143 T144	T141-G143 PolarHBondContact O-N 3.03Å; T141-T144 PolarHBondContact N-OG1 2.9Å; T141-T144 WeakPolarHBondContact O-CB 3.19Å; T141-T144 PolarHBondContact O-N 3.31Å; T141-T144 VanDerWaalsContact O-N 3.16Å; T141-T144 PolarHBondContact O-OG1 3.46Å; T141-T144 PolarHBondContact OG1-OG1 3.34Å
142	R	84	Confident	76.9	Confident	210 Å²	210	82.3 Å²	82.3	79%	0.792	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	132.7	174.2	-72	-179.6	177.2	176.1	0.8	110.1	L188	R142-L188 HydrophobicContact CB-CD2 4.29Å; R142-L188 HydrophobicContact CG-CD2 3.62Å
143	G	82.5	Confident	79.5	Confident	77 Å²	77	75.7 Å²	75.7	79%	0.794	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	2.6	-177.4	0	0	0	0	0	115.3	T141 T145	T141-G143 PolarHBondContact O-N 3.03Å; G143-T145 PolarHBondContact O-N 2.98Å
144	T	87.2	Confident	82.5	Confident	37 Å²	37	71.5 Å²	71.5	23%	0.227	37%	0.369	C	S	.	.			trans	-66.9	126.3	171	-56.5	0	0	0	0	110	P140 T141 K148 F149 M152	P140-T144 HydrophobicContact CB-CG2 3.88Å; T141-T144 PolarHBondContact N-OG1 2.9Å; T141-T144 WeakPolarHBondContact O-CB 3.19Å; T141-T144 PolarHBondContact O-N 3.31Å; T141-T144 VanDerWaalsContact O-N 3.16Å; T141-T144 PolarHBondContact O-OG1 3.46Å; T141-T144 PolarHBondContact OG1-OG1 3.34Å; T144-K148 HydrophobicContact CG2-CB 3.86Å; T144-K148 HydrophobicContact CG2-CG 3.98Å; T144-F149 HydrophobicContact CG2-CB 4.33Å; T144-M152 HydrophobicContact CG2-SD 4.27Å
145	T	90.1	Very high	84.7	Confident	89 Å²	89	71.3 Å²	71.3	55%	0.546	37%	0.374	S	S	.	.			trans	-77.3	157.6	175.2	63.9	0	0	0	0	111	G143 Q147 K148 F149	G143-T145 PolarHBondContact O-N 2.98Å; T145-Q147 PolarHBondContact O-N 3.31Å; T145-K148 PolarHBondContact O-N 2.96Å; T145-K148 WeakPolarHBondContact OG1-CB 3.28Å; T145-K148 PolarHBondContact OG1-N 3.34Å; T145-F149 PolarHBondContact O-N 3.14Å
146	V	89.6	Confident	86.5	Confident	72 Å²	72	68 Å²	68	44%	0.436	35%	0.354	S	S	.	.	H	α-helix	trans	-56.1	-40.8	176.6	-179.8	0	0	0	0	111.5	K148 F149 K150	V146-K148 VanDerWaalsContact C-N 3.33Å; V146-K148 PolarHBondContact O-N 3.05Å; V146-F149 WeakPolarHBondContact O-CB 3.42Å; V146-F149 PolarHBondContact O-N 3.42Å; V146-K150 PolarHBondContact O-N 3.44Å
147	Q	91	Very high	87.9	Confident	119 Å²	119	67.2 Å²	67.2	56%	0.556	35%	0.349	S	S	*	.	H	α-helix	trans	-63.4	-40.2	176.5	-173.1	62	17.4	0	0	111.9	T145 F149 K150 E151	T145-Q147 PolarHBondContact O-N 3.31Å; Q147-F149 VanDerWaalsContact C-N 3.35Å; Q147-K150 WeakPolarHBondContact O-CB 3.36Å; Q147-K150 PolarHBondContact O-N 3.11Å; Q147-E151 PolarHBondContact O-N 3.08Å; Q147-E151 VanDerWaalsContact O-N 3.08Å
148	K	92.3	Very high	89	Confident	104 Å²	104	71.2 Å²	71.2	45%	0.452	37%	0.367	S	S	.	.	H	α-helix	trans	-67.9	-38.6	177	-171.7	57.4	177.1	178.7	0	111.7	T144 T145 V146 K150 E151 M152	T144-K148 HydrophobicContact CG2-CB 3.86Å; T144-K148 HydrophobicContact CG2-CG 3.98Å; T145-K148 PolarHBondContact O-N 2.96Å; T145-K148 WeakPolarHBondContact OG1-CB 3.28Å; T145-K148 PolarHBondContact OG1-N 3.34Å; V146-K148 VanDerWaalsContact C-N 3.33Å; V146-K148 PolarHBondContact O-N 3.05Å; K148-K150 VanDerWaalsContact C-N 3.34Å; K148-E151 VanDerWaalsContact CD-OE2 3.27Å; K148-E151 WeakPolarHBondContact CD-OE2 3.06Å; K148-E151 IonicContact NZ-OE2 2.66Å; K148-E151 PolarHBondContact NZ-OE2 2.8Å; K148-E151 WeakPolarHBondContact O-CB 2.99Å; K148-E151 PolarHBondContact O-N 3.32Å; K148-M152 WeakPolarHBondContact O-CG 3.42Å; K148-M152 PolarHBondContact O-N 3.07Å
149	F	93	Very high	89.6	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.018	37%	0.369	C	S	.	.	H	α-helix	trans	-60.8	-44.4	172.9	179.8	-118.8	0	0	0	111.3	P140 T144 T145 V146 Q147 E151 M152 V153 L175 V186 A191 A194 W195	P140-F149 HydrophobicContact CB-CD2 4.46Å; P140-F149 HydrophobicContact CG-CD2 3.97Å; P140-F149 HydrophobicContact CG-CE2 4.31Å; T144-F149 HydrophobicContact CG2-CB 4.33Å; T145-F149 PolarHBondContact O-N 3.14Å; V146-F149 WeakPolarHBondContact O-CB 3.42Å; V146-F149 PolarHBondContact O-N 3.42Å; Q147-F149 VanDerWaalsContact C-N 3.35Å; F149-E151 VanDerWaalsContact C-N 3.32Å; F149-E151 PolarHBondContact O-N 3.45Å; F149-M152 WeakPolarHBondContact O-CA 3.34Å; F149-M152 WeakPolarHBondContact O-CB 3.24Å; F149-M152 PolarHBondContact O-N 2.68Å; F149-V153 HydrophobicContact CD1-CG2 4.37Å; F149-V153 HydrophobicContact CD2-CG2 4.23Å; F149-V153 HydrophobicContact CE1-CG2 3.98Å; F149-V153 HydrophobicContact CE2-CG2 3.83Å; F149-V153 HydrophobicContact CG-CG2 4.49Å; F149-V153 HydrophobicContact CZ-CG2 3.69Å; F149-V153 WeakPolarHBondContact O-CG2 3.45Å; F149-V153 PolarHBondContact O-N 3.01Å; F149-L175 HydrophobicContact CD1-CD2 3.69Å; F149-L175 HydrophobicContact CE1-CD2 3.78Å; F149-V186 HydrophobicContact CD1-CG1 4.45Å; F149-V186 HydrophobicContact CE1-CG1 4.29Å; F149-A191 HydrophobicContact CD1-CB 4.16Å; F149-A191 HydrophobicContact CD2-CB 4.03Å; F149-A191 HydrophobicContact CE1-CB 4.04Å; F149-A191 HydrophobicContact CE2-CB 3.92Å; F149-A191 WeakPolarHBondContact CE2-O 3.28Å; F149-A191 HydrophobicContact CG-CB 4.15Å; F149-A191 HydrophobicContact CZ-CB 3.92Å; F149-A191 WeakPolarHBondContact CZ-O 3.41Å; F149-A194 HydrophobicContact CZ-CB 4.25Å; F149-W195 HydrophobicContact CE2-CB 4.35Å; F149-W195 HydrophobicContact CE2-CE3 4.19Å
150	K	93.9	Very high	89.9	Confident	58 Å²	58	64.7 Å²	64.7	25%	0.252	35%	0.347	S	S	.	.	H	α-helix	trans	-54.2	-46.1	174	-172.6	175	-175.6	161.5	0	112.4	V146 Q147 K148 V153 Y154 V171 N172 L175	V146-K150 PolarHBondContact O-N 3.44Å; Q147-K150 WeakPolarHBondContact O-CB 3.36Å; Q147-K150 PolarHBondContact O-N 3.11Å; K148-K150 VanDerWaalsContact C-N 3.34Å; K150-V153 PolarHBondContact O-N 2.03Å; K150-Y154 WeakPolarHBondContact O-CB 3.35Å; K150-Y154 PolarHBondContact O-N 2.84Å; K150-V171 HydrophobicContact CD-CG1 4.43Å; K150-V171 HydrophobicContact CG-CG1 3.54Å; K150-N172 WeakPolarHBondContact CE-OD1 3.47Å; K150-N172 PolarHBondContact NZ-OD1 2.88Å; K150-L175 HydrophobicContact CB-CD1 4.28Å; K150-L175 HydrophobicContact CD-CD1 4.07Å; K150-L175 HydrophobicContact CG-CD1 4.02Å
151	E	93.1	Very high	90	Very high	90 Å²	90	64.9 Å²	64.9	42%	0.421	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-40.6	174.7	-69.5	171.6	-170.6	0	0	112.5	Q147 K148 F149 Y154 S155	Q147-E151 PolarHBondContact O-N 3.08Å; Q147-E151 VanDerWaalsContact O-N 3.08Å; K148-E151 VanDerWaalsContact CD-OE2 3.27Å; K148-E151 WeakPolarHBondContact CD-OE2 3.06Å; K148-E151 IonicContact NZ-OE2 2.66Å; K148-E151 PolarHBondContact NZ-OE2 2.8Å; K148-E151 WeakPolarHBondContact O-CB 2.99Å; K148-E151 PolarHBondContact O-N 3.32Å; F149-E151 VanDerWaalsContact C-N 3.32Å; F149-E151 PolarHBondContact O-N 3.45Å; E151-Y154 PolarHBondContact O-N 2.88Å; E151-S155 WeakPolarHBondContact O-CB 3.23Å; E151-S155 PolarHBondContact O-N 2.76Å
152	M	92.9	Very high	90	Very high	40 Å²	40	61 Å²	61	20%	0.197	33%	0.326	C	S	.	.	H	α-helix	trans	-61.4	-47.5	176.4	-71.1	176.2	61	0	0	111	K139 P140 T144 K148 F149 S155 L156 W195	K139-M152 HydrophobicContact CB-CE 4.46Å; P140-M152 HydrophobicContact CB-CE 4.22Å; P140-M152 HydrophobicContact CB-SD 4.2Å; T144-M152 HydrophobicContact CG2-SD 4.27Å; K148-M152 WeakPolarHBondContact O-CG 3.42Å; K148-M152 PolarHBondContact O-N 3.07Å; F149-M152 WeakPolarHBondContact O-CA 3.34Å; F149-M152 WeakPolarHBondContact O-CB 3.24Å; F149-M152 PolarHBondContact O-N 2.68Å; M152-S155 PolarHBondContact O-N 3.03Å; M152-S155 PolarHBondContact O-OG 3.01Å; M152-L156 PolarHBondContact O-N 2.87Å; M152-W195 HydrophobicContact CB-CH2 4.22Å; M152-W195 HydrophobicContact CB-CZ3 3.83Å; M152-W195 HydrophobicContact CE-CE3 4.5Å; M152-W195 HydrophobicContact CE-CH2 4.24Å; M152-W195 HydrophobicContact CE-CZ2 4.4Å; M152-W195 HydrophobicContact CE-CZ3 4.31Å
153	V	93.2	Very high	89.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-44.8	177.5	-179.4	0	0	0	0	110.5	F149 K150 S155 L156 F157 V171 I174 W195 L198	F149-V153 HydrophobicContact CD1-CG2 4.37Å; F149-V153 HydrophobicContact CD2-CG2 4.23Å; F149-V153 HydrophobicContact CE1-CG2 3.98Å; F149-V153 HydrophobicContact CE2-CG2 3.83Å; F149-V153 HydrophobicContact CG-CG2 4.49Å; F149-V153 HydrophobicContact CZ-CG2 3.69Å; F149-V153 WeakPolarHBondContact O-CG2 3.45Å; F149-V153 PolarHBondContact O-N 3.01Å; K150-V153 PolarHBondContact O-N 2.03Å; V153-S155 VanDerWaalsContact C-N 3.32Å; V153-S155 PolarHBondContact O-N 3.36Å; V153-L156 WeakPolarHBondContact O-CB 3.5Å; V153-L156 PolarHBondContact O-N 3.03Å; V153-F157 HydrophobicContact CG1-CD2 3.92Å; V153-F157 HydrophobicContact CG1-CE1 4.45Å; V153-F157 HydrophobicContact CG1-CE2 3.34Å; V153-F157 HydrophobicContact CG1-CZ 3.64Å; V153-F157 PolarHBondContact O-N 3.32Å; V153-V171 HydrophobicContact CB-CG1 4.37Å; V153-V171 HydrophobicContact CG1-CG1 4.34Å; V153-V171 HydrophobicContact CG1-CG2 4.09Å; V153-I174 HydrophobicContact CG1-CG2 4.17Å; V153-W195 HydrophobicContact CG2-CE3 4.49Å; V153-L198 HydrophobicContact CG1-CD1 3.95Å; V153-L198 HydrophobicContact CG2-CD1 4.16Å
154	Y	93.8	Very high	89.1	Confident	100 Å²	100	57 Å²	57	39%	0.392	30%	0.3	S	S	.	.	H	α-helix	trans	-57	-46.1	175.4	-174.2	-87.3	0	0	0	111.9	K150 E151 L156 F157 K158 L167 V171	K150-Y154 WeakPolarHBondContact O-CB 3.35Å; K150-Y154 PolarHBondContact O-N 2.84Å; E151-Y154 PolarHBondContact O-N 2.88Å; Y154-L156 VanDerWaalsContact C-N 3.32Å; Y154-L156 PolarHBondContact O-N 2.83Å; Y154-F157 PolarHBondContact O-N 2.98Å; Y154-K158 WeakPolarHBondContact O-CB 3.18Å; Y154-K158 PolarHBondContact O-N 3.35Å; Y154-L167 HydrophobicContact CD2-CB 4.23Å; Y154-L167 HydrophobicContact CE2-CB 3.75Å; Y154-L167 HydrophobicContact CE2-CD1 4.4Å; Y154-V171 HydrophobicContact CD2-CG2 4.13Å
155	S	92.1	Very high	87.9	Confident	66 Å²	66	57.4 Å²	57.4	46%	0.462	31%	0.311	S	S	.	.	H	α-helix	trans	-63.9	-36.7	178.3	75.7	0	0	0	0	112.8	E151 M152 V153 A159	E151-S155 WeakPolarHBondContact O-CB 3.23Å; E151-S155 PolarHBondContact O-N 2.76Å; M152-S155 PolarHBondContact O-N 3.03Å; M152-S155 PolarHBondContact O-OG 3.01Å; V153-S155 VanDerWaalsContact C-N 3.32Å; V153-S155 PolarHBondContact O-N 3.36Å; S155-A159 WeakPolarHBondContact O-CB 3.25Å; S155-A159 PolarHBondContact O-N 2.85Å
156	L	90.4	Very high	87.5	Confident	20 Å²	20	57.2 Å²	57.2	11%	0.105	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-44.6	175.4	178.4	65.5	0	0	0	110.8	M152 V153 Y154 A159 K160 W195 L198	M152-L156 PolarHBondContact O-N 2.87Å; V153-L156 WeakPolarHBondContact O-CB 3.5Å; V153-L156 PolarHBondContact O-N 3.03Å; Y154-L156 VanDerWaalsContact C-N 3.32Å; Y154-L156 PolarHBondContact O-N 2.83Å; L156-A159 PolarHBondContact O-N 2.8Å; L156-K160 HydrophobicContact CD1-CD 4.4Å; L156-K160 HydrophobicContact CD1-CG 4.42Å; L156-K160 HydrophobicContact CG-CD 4.5Å; L156-K160 WeakPolarHBondContact O-CB 3.33Å; L156-K160 PolarHBondContact O-N 2.9Å; L156-W195 HydrophobicContact CB-CH2 3.91Å; L156-W195 HydrophobicContact CB-CZ3 4.08Å; L156-W195 HydrophobicContact CD2-CE3 4.36Å; L156-W195 HydrophobicContact CD2-CH2 4.1Å; L156-W195 HydrophobicContact CD2-CZ3 3.99Å; L156-W195 HydrophobicContact CG-CH2 4.4Å; L156-L198 HydrophobicContact CD2-CB 3.82Å; L156-L198 HydrophobicContact CD2-CD1 4.28Å
157	F	91.1	Very high	87.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.7	-40.5	178.1	-64.8	-27.5	0	0	0	112.7	V153 Y154 A159 K160 L161 L167 L170 V171 I174 L198 L204	V153-F157 HydrophobicContact CG1-CD2 3.92Å; V153-F157 HydrophobicContact CG1-CE1 4.45Å; V153-F157 HydrophobicContact CG1-CE2 3.34Å; V153-F157 HydrophobicContact CG1-CZ 3.64Å; V153-F157 PolarHBondContact O-N 3.32Å; Y154-F157 PolarHBondContact O-N 2.98Å; F157-A159 PolarHBondContact O-N 3.28Å; F157-K160 PolarHBondContact O-N 2.79Å; F157-L161 HydrophobicContact CB-CD1 4.27Å; F157-L161 WeakPolarHBondContact O-CB 3.21Å; F157-L161 PolarHBondContact O-N 2.98Å; F157-L167 HydrophobicContact CB-CD2 4.03Å; F157-L170 HydrophobicContact CD1-CD2 4.47Å; F157-L170 HydrophobicContact CD2-CB 4.5Å; F157-L170 HydrophobicContact CD2-CD2 3.81Å; F157-L170 HydrophobicContact CD2-CG 3.96Å; F157-L170 HydrophobicContact CE2-CB 4.44Å; F157-L170 HydrophobicContact CE2-CD2 3.89Å; F157-L170 HydrophobicContact CE2-CG 3.65Å; F157-L170 HydrophobicContact CG-CD2 4.14Å; F157-L170 HydrophobicContact CZ-CD2 4.28Å; F157-L170 HydrophobicContact CZ-CG 4.21Å; F157-V171 HydrophobicContact CD2-CG2 3.74Å; F157-V171 HydrophobicContact CE2-CG2 4.03Å; F157-I174 HydrophobicContact CE2-CG1 4.14Å; F157-I174 HydrophobicContact CZ-CG1 3.88Å; F157-L198 HydrophobicContact CE1-CD2 3.85Å; F157-L198 HydrophobicContact CZ-CD1 4.29Å; F157-L198 HydrophobicContact CZ-CD2 3.66Å; F157-L204 HydrophobicContact CE1-CD1 3.81Å; F157-L204 HydrophobicContact CZ-CD1 4.1Å
158	K	90.8	Very high	87.4	Confident	92 Å²	92	51.3 Å²	51.3	40%	0.4	28%	0.282	S	S	.	.	H	α-helix	trans	-56.7	-41.5	171.7	178.9	171.2	172.2	125.3	0	111.5	Y154 G162 D163 L167	Y154-K158 WeakPolarHBondContact O-CB 3.18Å; Y154-K158 PolarHBondContact O-N 3.35Å; K158-G162 CarbonylContact O-C 3.6Å; K158-G162 WeakPolarHBondContact O-CA 3.46Å; K158-G162 PolarHBondContact O-N 3.18Å; K158-D163 WeakPolarHBondContact CD-OD1 3.41Å; K158-D163 WeakPolarHBondContact CE-OD1 3.34Å; K158-D163 WeakPolarHBondContact CG-OD1 3.31Å; K158-D163 IonicContact NZ-OD1 2.72Å; K158-D163 PolarHBondContact NZ-OD1 3.33Å; K158-D163 IonicContact NZ-OD2 2.74Å; K158-D163 PolarHBondContact NZ-OD2 2.92Å; K158-L167 HydrophobicContact CB-CD1 4.41Å
159	A	88.1	Confident	87.3	Confident	71 Å²	71	51.3 Å²	51.3	59%	0.587	28%	0.283	S	S	*	.	H	α-helix	trans	-69.7	-39.2	177	0	0	0	0	0	113.3	S155 L156 F157	S155-A159 WeakPolarHBondContact O-CB 3.25Å; S155-A159 PolarHBondContact O-N 2.85Å; L156-A159 PolarHBondContact O-N 2.8Å; F157-A159 PolarHBondContact O-N 3.28Å
160	K	87.7	Confident	87.3	Confident	14 Å²	14	51.1 Å²	51.1	6%	0.061	28%	0.283	C	S	.	.	H	α-helix	trans	-79.3	-45.9	-178.1	-79.8	-169.3	165.5	-159	0	113.3	L156 F157 L198 Q199 N201 P318	L156-K160 HydrophobicContact CD1-CD 4.4Å; L156-K160 HydrophobicContact CD1-CG 4.42Å; L156-K160 HydrophobicContact CG-CD 4.5Å; L156-K160 WeakPolarHBondContact O-CB 3.33Å; L156-K160 PolarHBondContact O-N 2.9Å; F157-K160 PolarHBondContact O-N 2.79Å; K160-L198 PolarHBondContact NZ-O 2.79Å; K160-Q199 PolarHBondContact NZ-O 3.26Å; K160-N201 PolarHBondContact NZ-OD1 3.1Å; K160-N201 VanDerWaalsContact NZ-OD1 3.15Å; K160-P318 WeakPolarHBondContact O-CB 3.45Å
161	L	87.7	Confident	87.2	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	27%	0.271	C	S	.	.	H	α-helix	trans	-99.4	-20.9	-169.9	-54.5	177.5	0	0	0	112.2	F157 Q164 L167 L170 F290 P318 T320	F157-L161 HydrophobicContact CB-CD1 4.27Å; F157-L161 WeakPolarHBondContact O-CB 3.21Å; F157-L161 PolarHBondContact O-N 2.98Å; L161-Q164 WeakPolarHBondContact O-CG 3.26Å; L161-L167 HydrophobicContact CB-CD2 4.43Å; L161-L167 HydrophobicContact CD1-CD2 4.01Å; L161-L170 HydrophobicContact CD1-CD2 3.78Å; L161-F290 HydrophobicContact CD2-CE1 3.91Å; L161-F290 HydrophobicContact CD2-CE2 4.4Å; L161-F290 HydrophobicContact CD2-CZ 3.57Å; L161-P318 HydrophobicContact CD2-CB 3.88Å; L161-P318 HydrophobicContact CD2-CG 3.65Å; L161-T320 PolarHBondContact O-OG1 3.2Å
162	G	84.7	Confident	87.2	Confident	12 Å²	12	47.4 Å²	47.4	12%	0.124	27%	0.268	C	S	.	.			trans	88.5	-171.1	-171.4	0	0	0	0	0	112.2	K158 Q164	K158-G162 CarbonylContact O-C 3.6Å; K158-G162 WeakPolarHBondContact O-CA 3.46Å; K158-G162 PolarHBondContact O-N 3.18Å; G162-Q164 PolarHBondContact O-N 2.63Å
163	D	79.3	Confident	87.2	Confident	118 Å²	118	48.3 Å²	48.3	63%	0.631	27%	0.274	S	S	*	.	S	Bend	trans	-82.3	61.2	177.7	-81.3	-35.9	0	0	0	111.5	K158	K158-D163 WeakPolarHBondContact CD-OD1 3.41Å; K158-D163 WeakPolarHBondContact CE-OD1 3.34Å; K158-D163 WeakPolarHBondContact CG-OD1 3.31Å; K158-D163 IonicContact NZ-OD1 2.72Å; K158-D163 PolarHBondContact NZ-OD1 3.33Å; K158-D163 IonicContact NZ-OD2 2.74Å; K158-D163 PolarHBondContact NZ-OD2 2.92Å
164	Q	70	Confident	87.2	Confident	86 Å²	86	48.4 Å²	48.4	40%	0.402	27%	0.274	S	S	.	.			trans	-82.9	158.9	176.5	-60.8	-64.9	-19.6	0	0	111.9	L161 G162	L161-Q164 WeakPolarHBondContact O-CG 3.26Å; G162-Q164 PolarHBondContact O-N 2.63Å
165	G	61.3	Low	87.2	Confident	46 Å²	46	44.9 Å²	44.9	47%	0.474	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	150.7	173	0	0	0	0	0	112.2	L167	G165-L167 PolarHBondContact O-N 2.74Å
166	N	81.1	Confident	87.3	Confident	85 Å²	85	46.6 Å²	46.6	46%	0.455	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	18.5	172.6	-59.3	5.4	0	0	0	118.4	S168 E169 L170 Y287	N166-S168 PolarHBondContact O-N 3.08Å; N166-S168 VanDerWaalsContact O-N 3.11Å; N166-E169 HydrophobicContact CB-CB 4.46Å; N166-E169 HydrophobicContact CB-CG 4.36Å; N166-E169 WeakPolarHBondContact CB-OE2 3.36Å; N166-E169 PolarHBondContact ND2-OE2 3.15Å; N166-E169 WeakPolarHBondContact O-CB 3.41Å; N166-E169 PolarHBondContact O-N 2.8Å; N166-L170 PolarHBondContact O-N 3.47Å; N166-Y287 HydrophobicContact CB-CE1 4.27Å
167	L	88.6	Confident	87.4	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-53.7	-33.2	172	-65.8	177	0	0	0	113.4	Y154 F157 K158 L161 G165 E169 L170 V171	Y154-L167 HydrophobicContact CD2-CB 4.23Å; Y154-L167 HydrophobicContact CE2-CB 3.75Å; Y154-L167 HydrophobicContact CE2-CD1 4.4Å; F157-L167 HydrophobicContact CB-CD2 4.03Å; K158-L167 HydrophobicContact CB-CD1 4.41Å; L161-L167 HydrophobicContact CB-CD2 4.43Å; L161-L167 HydrophobicContact CD1-CD2 4.01Å; G165-L167 PolarHBondContact O-N 2.74Å; L167-E169 VanDerWaalsContact C-N 3.33Å; L167-E169 PolarHBondContact O-N 2.84Å; L167-L170 PolarHBondContact O-N 3.22Å; L167-V171 VanDerWaalsContact O-CG2 3.26Å; L167-V171 WeakPolarHBondContact O-CG2 3.45Å; L167-V171 PolarHBondContact O-N 2.96Å
168	S	90	Very high	87.5	Confident	63 Å²	63	47.2 Å²	47.2	44%	0.441	27%	0.274	S	S	.	.	H	α-helix	trans	-61.8	-38.8	177.1	-172.6	0	0	0	0	112.7	N166 V171 N172	N166-S168 PolarHBondContact O-N 3.08Å; N166-S168 VanDerWaalsContact O-N 3.11Å; S168-V171 PolarHBondContact O-N 3.42Å; S168-N172 VanDerWaalsContact O-CG 3.29Å; S168-N172 PolarHBondContact O-N 3.33Å; S168-N172 PolarHBondContact O-ND2 3.15Å
169	E	91.3	Very high	87.6	Confident	104 Å²	104	44 Å²	44	49%	0.486	26%	0.261	S	S	.	.	H	α-helix	trans	-67.5	-43.7	177.2	-63.7	178.2	169.4	0	0	110.7	N166 L167 V171 N172 L173	N166-E169 HydrophobicContact CB-CB 4.46Å; N166-E169 HydrophobicContact CB-CG 4.36Å; N166-E169 WeakPolarHBondContact CB-OE2 3.36Å; N166-E169 PolarHBondContact ND2-OE2 3.15Å; N166-E169 WeakPolarHBondContact O-CB 3.41Å; N166-E169 PolarHBondContact O-N 2.8Å; L167-E169 VanDerWaalsContact C-N 3.33Å; L167-E169 PolarHBondContact O-N 2.84Å; E169-V171 VanDerWaalsContact C-N 3.32Å; E169-V171 PolarHBondContact O-N 2.91Å; E169-N172 PolarHBondContact O-N 3.34Å; E169-N172 VanDerWaalsContact O-N 3.14Å; E169-L173 PolarHBondContact O-N 3.4Å
170	L	91.5	Very high	87.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-40.6	175.9	-177.8	59.2	0	0	0	111.9	F157 L161 N166 L167 N172 L173 I174 L204 I208 Y287	F157-L170 HydrophobicContact CD1-CD2 4.47Å; F157-L170 HydrophobicContact CD2-CB 4.5Å; F157-L170 HydrophobicContact CD2-CD2 3.81Å; F157-L170 HydrophobicContact CD2-CG 3.96Å; F157-L170 HydrophobicContact CE2-CB 4.44Å; F157-L170 HydrophobicContact CE2-CD2 3.89Å; F157-L170 HydrophobicContact CE2-CG 3.65Å; F157-L170 HydrophobicContact CG-CD2 4.14Å; F157-L170 HydrophobicContact CZ-CD2 4.28Å; F157-L170 HydrophobicContact CZ-CG 4.21Å; L161-L170 HydrophobicContact CD1-CD2 3.78Å; N166-L170 PolarHBondContact O-N 3.47Å; L167-L170 PolarHBondContact O-N 3.22Å; L170-N172 VanDerWaalsContact C-N 3.34Å; L170-L173 HydrophobicContact CD1-CD2 4.4Å; L170-L173 PolarHBondContact O-N 3.16Å; L170-I174 HydrophobicContact CD1-CG1 4.39Å; L170-I174 WeakPolarHBondContact O-CB 3.27Å; L170-I174 VanDerWaalsContact O-CG1 3.26Å; L170-I174 WeakPolarHBondContact O-CG1 3.49Å; L170-I174 PolarHBondContact O-N 3.15Å; L170-L204 HydrophobicContact CD2-CD1 4.41Å; L170-I208 HydrophobicContact CD1-CD1 4.31Å; L170-I208 HydrophobicContact CD1-CG1 3.74Å; L170-I208 HydrophobicContact CD2-CD1 4.37Å; L170-Y287 HydrophobicContact CB-CD1 3.95Å; L170-Y287 HydrophobicContact CB-CE1 3.72Å; L170-Y287 HydrophobicContact CD1-CD2 4.33Å; L170-Y287 HydrophobicContact CD1-CE2 4.11Å; L170-Y287 HydrophobicContact CD2-CD1 4.23Å; L170-Y287 HydrophobicContact CD2-CD2 4.44Å; L170-Y287 HydrophobicContact CD2-CG 4.08Å
171	V	93.7	Very high	87.7	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-43.6	174.6	173.8	0	0	0	0	110.9	K150 V153 Y154 F157 L167 S168 E169 I174 L175	K150-V171 HydrophobicContact CD-CG1 4.43Å; K150-V171 HydrophobicContact CG-CG1 3.54Å; V153-V171 HydrophobicContact CB-CG1 4.37Å; V153-V171 HydrophobicContact CG1-CG1 4.34Å; V153-V171 HydrophobicContact CG1-CG2 4.09Å; Y154-V171 HydrophobicContact CD2-CG2 4.13Å; F157-V171 HydrophobicContact CD2-CG2 3.74Å; F157-V171 HydrophobicContact CE2-CG2 4.03Å; L167-V171 VanDerWaalsContact O-CG2 3.26Å; L167-V171 WeakPolarHBondContact O-CG2 3.45Å; L167-V171 PolarHBondContact O-N 2.96Å; S168-V171 PolarHBondContact O-N 3.42Å; E169-V171 VanDerWaalsContact C-N 3.32Å; E169-V171 PolarHBondContact O-N 2.91Å; V171-I174 PolarHBondContact O-N 3.41Å; V171-L175 HydrophobicContact CG1-CD1 4.28Å; V171-L175 WeakPolarHBondContact O-CG 3.47Å; V171-L175 PolarHBondContact O-N 3.14Å
172	N	92.9	Very high	87.9	Confident	69 Å²	69	53.9 Å²	53.9	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-64.5	-43	177.4	-66.8	-26.2	0	0	0	111.6	K150 S168 E169 L170 I174 L175 T176	K150-N172 WeakPolarHBondContact CE-OD1 3.47Å; K150-N172 PolarHBondContact NZ-OD1 2.88Å; S168-N172 VanDerWaalsContact O-CG 3.29Å; S168-N172 PolarHBondContact O-N 3.33Å; S168-N172 PolarHBondContact O-ND2 3.15Å; E169-N172 PolarHBondContact O-N 3.34Å; E169-N172 VanDerWaalsContact O-N 3.14Å; L170-N172 VanDerWaalsContact C-N 3.34Å; N172-I174 VanDerWaalsContact C-N 3.27Å; N172-I174 PolarHBondContact O-N 2.76Å; N172-L175 PolarHBondContact O-N 3.25Å; N172-T176 PolarHBondContact O-N 2.91Å; N172-T176 PolarHBondContact O-OG1 3.26Å
173	L	92.3	Very high	88.2	Confident	58 Å²	58	57.5 Å²	57.5	30%	0.304	32%	0.317	S	S	.	.	H	α-helix	trans	-56.1	-44.4	174.9	177.9	62.3	0	0	0	111.2	E169 L170 T176 V177 V207	E169-L173 PolarHBondContact O-N 3.4Å; L170-L173 HydrophobicContact CD1-CD2 4.4Å; L170-L173 PolarHBondContact O-N 3.16Å; L173-T176 WeakPolarHBondContact O-CB 3.26Å; L173-T176 PolarHBondContact O-N 3.16Å; L173-V177 WeakPolarHBondContact O-CG2 3.43Å; L173-V177 PolarHBondContact O-N 3.09Å; L173-V207 HydrophobicContact CD2-CG1 3.69Å; L173-V207 HydrophobicContact CG-CG1 3.84Å
174	I	93.6	Very high	88.7	Confident	3 Å²	3	55 Å²	55	2%	0.015	32%	0.319	C	S	.	.	H	α-helix	trans	-69.2	-35.2	179.4	-71.5	-70.1	0	0	0	112.6	V153 F157 L170 V171 N172 T176 V177 A178 L198 V207	V153-I174 HydrophobicContact CG1-CG2 4.17Å; F157-I174 HydrophobicContact CE2-CG1 4.14Å; F157-I174 HydrophobicContact CZ-CG1 3.88Å; L170-I174 HydrophobicContact CD1-CG1 4.39Å; L170-I174 WeakPolarHBondContact O-CB 3.27Å; L170-I174 VanDerWaalsContact O-CG1 3.26Å; L170-I174 WeakPolarHBondContact O-CG1 3.49Å; L170-I174 PolarHBondContact O-N 3.15Å; V171-I174 PolarHBondContact O-N 3.41Å; N172-I174 VanDerWaalsContact C-N 3.27Å; N172-I174 PolarHBondContact O-N 2.76Å; I174-T176 VanDerWaalsContact C-N 3.29Å; I174-V177 PolarHBondContact O-N 3.21Å; I174-A178 VanDerWaalsContact O-CB 3.25Å; I174-A178 WeakPolarHBondContact O-CB 3.35Å; I174-A178 PolarHBondContact O-N 3.36Å; I174-L198 HydrophobicContact CD1-CD2 3.68Å; I174-L198 HydrophobicContact CG1-CD2 4.16Å; I174-L198 HydrophobicContact CG2-CD1 3.87Å; I174-L198 HydrophobicContact CG2-CD2 4.01Å; I174-L198 HydrophobicContact CG2-CG 4.33Å; I174-V207 HydrophobicContact CD1-CB 4.15Å; I174-V207 HydrophobicContact CD1-CG1 3.73Å; I174-V207 HydrophobicContact CD1-CG2 4.17Å
175	L	93.3	Very high	89.6	Confident	25 Å²	25	57.1 Å²	57.1	13%	0.131	33%	0.329	C	S	.	.	H	α-helix	trans	-63.4	-38.4	171.8	-69.7	171.9	0	0	0	111.2	F149 K150 V171 N172 A178 D179 V186	F149-L175 HydrophobicContact CD1-CD2 3.69Å; F149-L175 HydrophobicContact CE1-CD2 3.78Å; K150-L175 HydrophobicContact CB-CD1 4.28Å; K150-L175 HydrophobicContact CD-CD1 4.07Å; K150-L175 HydrophobicContact CG-CD1 4.02Å; V171-L175 HydrophobicContact CG1-CD1 4.28Å; V171-L175 WeakPolarHBondContact O-CG 3.47Å; V171-L175 PolarHBondContact O-N 3.14Å; N172-L175 PolarHBondContact O-N 3.25Å; L175-A178 PolarHBondContact O-N 2.86Å; L175-D179 PolarHBondContact O-N 3.23Å; L175-D179 VanDerWaalsContact O-N 3.07Å; L175-V186 HydrophobicContact CD2-CG2 4.25Å
176	T	93.7	Very high	91.1	Very high	103 Å²	103	55.9 Å²	55.9	63%	0.632	31%	0.312	S	S	*	.	H	α-helix	trans	-66.9	-35.1	174.1	-55.1	0	0	0	0	112.9	N172 L173 I174	N172-T176 PolarHBondContact O-N 2.91Å; N172-T176 PolarHBondContact O-OG1 3.26Å; L173-T176 WeakPolarHBondContact O-CB 3.26Å; L173-T176 PolarHBondContact O-N 3.16Å; I174-T176 VanDerWaalsContact C-N 3.29Å
177	V	92.8	Very high	91.7	Very high	31 Å²	31	54.2 Å²	54.2	19%	0.188	31%	0.307	C	S	.	.	H	α-helix	trans	-74.2	-32.2	174.2	175.8	0	0	0	0	111.6	L173 I174 F203 V207 L218 F221	L173-V177 WeakPolarHBondContact O-CG2 3.43Å; L173-V177 PolarHBondContact O-N 3.09Å; I174-V177 PolarHBondContact O-N 3.21Å; V177-F203 HydrophobicContact CG1-CZ 4.15Å; V177-V207 HydrophobicContact CG1-CG2 4.42Å; V177-V207 HydrophobicContact CG2-CG1 4.08Å; V177-V207 HydrophobicContact CG2-CG2 4.48Å; V177-L218 HydrophobicContact CG1-CD2 4.49Å; V177-F221 HydrophobicContact CG1-CE1 4.06Å; V177-F221 WeakPolarHBondContact O-CE1 3.49Å; V177-F221 WeakPolarHBondContact O-CZ 3.2Å
178	A	93.2	Very high	91.9	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.008	32%	0.321	C	S	.	.	H	α-helix	trans	-70.6	-36.1	179.5	0	0	0	0	0	112.6	I174 L175 G180 V186 E190 A194	I174-A178 VanDerWaalsContact O-CB 3.25Å; I174-A178 WeakPolarHBondContact O-CB 3.35Å; I174-A178 PolarHBondContact O-N 3.36Å; L175-A178 PolarHBondContact O-N 2.86Å; A178-G180 VanDerWaalsContact C-N 3.29Å; A178-G180 PolarHBondContact O-N 2.8Å; A178-V186 HydrophobicContact CB-CG1 4.23Å; A178-V186 HydrophobicContact CB-CG2 4.49Å; A178-E190 VanDerWaalsContact O-CB 3.32Å; A178-E190 WeakPolarHBondContact O-CB 3.43Å; A178-E190 WeakPolarHBondContact O-CG 2.87Å; A178-A194 HydrophobicContact CB-CB 3.63Å
179	D	93.1	Very high	92	Very high	24 Å²	24	54.2 Å²	54.2	13%	0.128	30%	0.304	C	S	.	.			trans	-67.7	84.6	171.2	178.4	4.7	0	0	0	109.7	L175 K182 D183 G184 V186	L175-D179 PolarHBondContact O-N 3.23Å; L175-D179 VanDerWaalsContact O-N 3.07Å; D179-K182 WeakPolarHBondContact OD1-CA 3.48Å; D179-K182 PolarHBondContact OD1-N 3.27Å; D179-D183 PolarHBondContact OD1-N 3.4Å; D179-D183 VanDerWaalsContact OD1-N 3.11Å; D179-G184 WeakPolarHBondContact OD2-CA 3.38Å; D179-G184 PolarHBondContact OD2-N 3.42Å; D179-V186 HydrophobicContact CB-CG2 4.43Å
180	G	88.3	Confident	92.2	Very high	17 Å²	17	49.4 Å²	49.4	18%	0.175	28%	0.281	C	S	.	.	S	Bend	trans	-81.7	-30.7	-170.3	0	0	0	0	0	112.6	A178 E190	A178-G180 VanDerWaalsContact C-N 3.29Å; A178-G180 PolarHBondContact O-N 2.8Å; G180-E190 PolarHBondContact N-OE1 2.74Å
181	D	89.8	Confident	92.3	Very high	102 Å²	102	49.6 Å²	49.6	55%	0.545	28%	0.283	S	S	.	.	S	Bend	trans	-88.1	-9.7	176.3	73.6	0.8	0	0	0	113.5	D183 E190	D181-D183 VanDerWaalsContact C-N 3.32Å; D181-D183 WeakPolarHBondContact OD1-CB 3.42Å; D181-D183 PolarHBondContact OD1-N 2.94Å; D181-E190 PolarHBondContact N-OE1 2.99Å
182	K	91.1	Very high	92.2	Very high	180 Å²	180	50.6 Å²	50.6	78%	0.783	29%	0.287	S	S	*	.			trans	65.5	33.3	176.9	-53.4	178.1	-178.9	176.4	0	112.5	D179 G184	D179-K182 WeakPolarHBondContact OD1-CA 3.48Å; D179-K182 PolarHBondContact OD1-N 3.27Å; K182-G184 VanDerWaalsContact C-N 3.27Å
183	D	90.9	Very high	92.3	Very high	88 Å²	88	47.3 Å²	47.3	47%	0.471	27%	0.27	S	S	.	.	S	Bend	trans	-82.2	-5.7	176.2	86.4	-11.9	0	0	0	113.2	D179 D181 Q185	D179-D183 PolarHBondContact OD1-N 3.4Å; D179-D183 VanDerWaalsContact OD1-N 3.11Å; D181-D183 VanDerWaalsContact C-N 3.32Å; D181-D183 WeakPolarHBondContact OD1-CB 3.42Å; D181-D183 PolarHBondContact OD1-N 2.94Å; D183-Q185 VanDerWaalsContact C-N 3.32Å; D183-Q185 WeakPolarHBondContact OD1-CA 3.36Å; D183-Q185 WeakPolarHBondContact OD1-CB 2.95Å; D183-Q185 PolarHBondContact OD1-N 3.38Å
184	G	89.6	Confident	92.3	Very high	64 Å²	64	44.8 Å²	44.8	66%	0.66	26%	0.257	S	S	*	.	S	Bend	trans	84.3	4	-179.7	0	0	0	0	0	113.9	D179 K182	D179-G184 WeakPolarHBondContact OD2-CA 3.38Å; D179-G184 PolarHBondContact OD2-N 3.42Å; K182-G184 VanDerWaalsContact C-N 3.27Å
185	Q	90.1	Very high	92.3	Very high	131 Å²	131	46.1 Å²	46.1	61%	0.612	26%	0.262	S	S	*	.	S	Bend	trans	-121.7	165	176.4	-64.1	179.5	86.4	0	0	109.7	D183	D183-Q185 VanDerWaalsContact C-N 3.32Å; D183-Q185 WeakPolarHBondContact OD1-CA 3.36Å; D183-Q185 WeakPolarHBondContact OD1-CB 2.95Å; D183-Q185 PolarHBondContact OD1-N 3.38Å
186	V	92.9	Very high	92.1	Very high	21 Å²	21	45 Å²	45	13%	0.127	26%	0.256	C	S	.	.			trans	-120.2	109.2	175.7	-177.2	0	0	0	0	107.4	F149 L175 A178 D179 E190 A191	F149-V186 HydrophobicContact CD1-CG1 4.45Å; F149-V186 HydrophobicContact CE1-CG1 4.29Å; L175-V186 HydrophobicContact CD2-CG2 4.25Å; A178-V186 HydrophobicContact CB-CG1 4.23Å; A178-V186 HydrophobicContact CB-CG2 4.49Å; D179-V186 HydrophobicContact CB-CG2 4.43Å; V186-E190 HydrophobicContact CG1-CB 3.97Å; V186-A191 HydrophobicContact CG1-CB 3.94Å
187	S	93.1	Very high	92	Very high	50 Å²	50	40.1 Å²	40.1	35%	0.35	23%	0.226	S	C	.	.			trans	-68.5	167.6	175.3	72.6	0	0	0	0	111.5	G189 E190 A191	S187-G189 VanDerWaalsContact C-N 3.32Å; S187-G189 PolarHBondContact O-N 3.43Å; S187-E190 VanDerWaalsContact CB-OE2 3.3Å; S187-E190 WeakPolarHBondContact CB-OE2 3.24Å; S187-E190 PolarHBondContact N-OE2 3.35Å; S187-E190 PolarHBondContact O-N 2.71Å; S187-E190 WeakPolarHBondContact OG-CB 3.24Å; S187-E190 VanDerWaalsContact OG-CG 3.27Å; S187-E190 WeakPolarHBondContact OG-CG 3.47Å; S187-E190 PolarHBondContact OG-N 3.17Å; S187-E190 PolarHBondContact OG-OE2 2.96Å; S187-A191 WeakPolarHBondContact O-CB 3.08Å; S187-A191 PolarHBondContact O-N 2.87Å
188	L	92.4	Very high	92	Very high	60 Å²	60	38.7 Å²	38.7	31%	0.314	22%	0.217	S	C	.	.	H	α-helix	trans	-64	-37.7	177.3	-177.5	66.7	0	0	0	112.3	P140 R142 A191 K192	P140-L188 HydrophobicContact CG-CD1 4.18Å; R142-L188 HydrophobicContact CB-CD2 4.29Å; R142-L188 HydrophobicContact CG-CD2 3.62Å; L188-A191 PolarHBondContact O-N 2.9Å; L188-K192 HydrophobicContact CG-CD 4.25Å; L188-K192 WeakPolarHBondContact O-CB 3.05Å; L188-K192 VanDerWaalsContact O-CG 3.28Å; L188-K192 WeakPolarHBondContact O-CG 3.1Å; L188-K192 PolarHBondContact O-N 3.28Å
189	G	92.4	Very high	91.7	Very high	7 Å²	7	40.2 Å²	40.2	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-66.7	-43	179.7	0	0	0	0	0	111.8	D73 S187 K192 S193	D73-G189 PolarHBondContact N-O 3.27Å; S187-G189 VanDerWaalsContact C-N 3.32Å; S187-G189 PolarHBondContact O-N 3.43Å; G189-K192 PolarHBondContact O-N 2.83Å; G189-S193 WeakPolarHBondContact O-CB 3.15Å; G189-S193 PolarHBondContact O-N 3.19Å; G189-S193 PolarHBondContact O-OG 3.38Å
190	E	94.6	Very high	91.4	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-47.4	173	-73	170.5	136.5	0	0	111.8	D73 A178 G180 D181 V186 S187 K192 S193 A194	D73-E190 HydrophobicContact CB-CG 3.94Å; A178-E190 VanDerWaalsContact O-CB 3.32Å; A178-E190 WeakPolarHBondContact O-CB 3.43Å; A178-E190 WeakPolarHBondContact O-CG 2.87Å; G180-E190 PolarHBondContact N-OE1 2.74Å; D181-E190 PolarHBondContact N-OE1 2.99Å; V186-E190 HydrophobicContact CG1-CB 3.97Å; S187-E190 VanDerWaalsContact CB-OE2 3.3Å; S187-E190 WeakPolarHBondContact CB-OE2 3.24Å; S187-E190 PolarHBondContact N-OE2 3.35Å; S187-E190 PolarHBondContact O-N 2.71Å; S187-E190 WeakPolarHBondContact OG-CB 3.24Å; S187-E190 VanDerWaalsContact OG-CG 3.27Å; S187-E190 WeakPolarHBondContact OG-CG 3.47Å; S187-E190 PolarHBondContact OG-N 3.17Å; S187-E190 PolarHBondContact OG-OE2 2.96Å; E190-K192 VanDerWaalsContact C-N 3.3Å; E190-K192 PolarHBondContact O-N 3.4Å; E190-S193 PolarHBondContact O-N 3.26Å; E190-S193 VanDerWaalsContact O-N 3.16Å; E190-A194 WeakPolarHBondContact O-CB 3.47Å; E190-A194 PolarHBondContact O-N 3.07Å
191	A	93.9	Very high	91.5	Very high	5 Å²	5	40.3 Å²	40.3	4%	0.041	22%	0.221	C	C	.	.	H	α-helix	trans	-60.7	-39.2	179.1	0	0	0	0	0	112.3	P140 F149 V186 S187 L188 W195	P140-A191 HydrophobicContact CG-CB 3.66Å; F149-A191 HydrophobicContact CD1-CB 4.16Å; F149-A191 HydrophobicContact CD2-CB 4.03Å; F149-A191 HydrophobicContact CE1-CB 4.04Å; F149-A191 HydrophobicContact CE2-CB 3.92Å; F149-A191 WeakPolarHBondContact CE2-O 3.28Å; F149-A191 HydrophobicContact CG-CB 4.15Å; F149-A191 HydrophobicContact CZ-CB 3.92Å; F149-A191 WeakPolarHBondContact CZ-O 3.41Å; V186-A191 HydrophobicContact CG1-CB 3.94Å; S187-A191 WeakPolarHBondContact O-CB 3.08Å; S187-A191 PolarHBondContact O-N 2.87Å; L188-A191 PolarHBondContact O-N 2.9Å; A191-W195 VanDerWaalsContact O-CB 3.23Å; A191-W195 WeakPolarHBondContact O-CB 3.11Å; A191-W195 PolarHBondContact O-N 3.44Å
192	K	92.8	Very high	91.5	Very high	22 Å²	22	35.6 Å²	35.6	10%	0.096	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-42.7	175.3	-77.4	176.3	168.6	-139	0	112.2	V71 F137 P140 L188 G189 E190 W195 A196	V71-K192 HydrophobicContact CG1-CD 4.43Å; V71-K192 WeakPolarHBondContact O-CD 3.44Å; F137-K192 HydrophobicContact CD1-CB 4.48Å; F137-K192 VanDerWaalsContact O-CD 3.28Å; F137-K192 WeakPolarHBondContact O-CD 3.31Å; F137-K192 WeakPolarHBondContact O-CE 3.32Å; F137-K192 PolarHBondContact O-NZ 2.86Å; P140-K192 HydrophobicContact CG-CG 4.48Å; P140-K192 WeakPolarHBondContact O-CE 3.3Å; L188-K192 HydrophobicContact CG-CD 4.25Å; L188-K192 WeakPolarHBondContact O-CB 3.05Å; L188-K192 VanDerWaalsContact O-CG 3.28Å; L188-K192 WeakPolarHBondContact O-CG 3.1Å; L188-K192 PolarHBondContact O-N 3.28Å; G189-K192 PolarHBondContact O-N 2.83Å; E190-K192 VanDerWaalsContact C-N 3.3Å; E190-K192 PolarHBondContact O-N 3.4Å; K192-W195 PolarHBondContact O-N 3.26Å; K192-A196 PolarHBondContact O-N 3Å
193	S	93.6	Very high	91.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67	-47.2	-179.9	-53.3	0	0	0	0	110.8	I72 D73 G189 E190 W195 A196 L197	I72-S193 WeakPolarHBondContact CA-OG 3.41Å; I72-S193 WeakPolarHBondContact CB-OG 3.47Å; D73-S193 PolarHBondContact N-OG 3.12Å; D73-S193 WeakPolarHBondContact O-CB 3.18Å; D73-S193 PolarHBondContact O-OG 2.84Å; G189-S193 WeakPolarHBondContact O-CB 3.15Å; G189-S193 PolarHBondContact O-N 3.19Å; G189-S193 PolarHBondContact O-OG 3.38Å; E190-S193 PolarHBondContact O-N 3.26Å; E190-S193 VanDerWaalsContact O-N 3.16Å; S193-W195 PolarHBondContact O-N 3.34Å; S193-A196 WeakPolarHBondContact O-CB 3.49Å; S193-A196 PolarHBondContact O-N 3.44Å; S193-L197 WeakPolarHBondContact O-CG 3.02Å; S193-L197 PolarHBondContact O-N 3.4Å
194	A	94	Very high	91.6	Very high	4 Å²	4	23.1 Å²	23.1	3%	0.033	14%	0.137	C	C	.	.	H	α-helix	trans	-58.4	-46.6	172.8	0	0	0	0	0	111.6	F149 A178 E190 A196 L197 L198	F149-A194 HydrophobicContact CZ-CB 4.25Å; A178-A194 HydrophobicContact CB-CB 3.63Å; E190-A194 WeakPolarHBondContact O-CB 3.47Å; E190-A194 PolarHBondContact O-N 3.07Å; A194-A196 VanDerWaalsContact C-N 3.32Å; A194-A196 PolarHBondContact O-N 2.97Å; A194-L197 PolarHBondContact O-N 3.07Å; A194-L198 WeakPolarHBondContact O-CB 3.06Å; A194-L198 WeakPolarHBondContact O-CG 3.17Å; A194-L198 PolarHBondContact O-N 3.39Å
195	W	92.4	Very high	91.7	Very high	32 Å²	32	20.2 Å²	20.2	12%	0.121	11%	0.106	C	C	.	.	H	α-helix	trans	-59.4	-41	178.9	-174.6	-96.3	0	0	0	113.2	K139 F149 M152 V153 L156 A191 K192 S193	K139-W195 HydrophobicContact CB-CG 4.36Å; F149-W195 HydrophobicContact CE2-CB 4.35Å; F149-W195 HydrophobicContact CE2-CE3 4.19Å; M152-W195 HydrophobicContact CB-CH2 4.22Å; M152-W195 HydrophobicContact CB-CZ3 3.83Å; M152-W195 HydrophobicContact CE-CE3 4.5Å; M152-W195 HydrophobicContact CE-CH2 4.24Å; M152-W195 HydrophobicContact CE-CZ2 4.4Å; M152-W195 HydrophobicContact CE-CZ3 4.31Å; V153-W195 HydrophobicContact CG2-CE3 4.49Å; L156-W195 HydrophobicContact CB-CH2 3.91Å; L156-W195 HydrophobicContact CB-CZ3 4.08Å; L156-W195 HydrophobicContact CD2-CE3 4.36Å; L156-W195 HydrophobicContact CD2-CH2 4.1Å; L156-W195 HydrophobicContact CD2-CZ3 3.99Å; L156-W195 HydrophobicContact CG-CH2 4.4Å; A191-W195 VanDerWaalsContact O-CB 3.23Å; A191-W195 WeakPolarHBondContact O-CB 3.11Å; A191-W195 PolarHBondContact O-N 3.44Å; K192-W195 PolarHBondContact O-N 3.26Å; S193-W195 PolarHBondContact O-N 3.34Å
196	A	90.3	Very high	91.8	Very high	2 Å²	2	14 Å²	14	2%	0.017	8%	0.077	C	C	.	.	H	α-helix	trans	-61.9	-50.1	175.2	0	0	0	0	0	111.6	L136 F137 K192 S193 A194 L198 Q199 D224	L136-A196 HydrophobicContact CD2-CB 3.69Å; L136-A196 HydrophobicContact CG-CB 4.02Å; L136-A196 WeakPolarHBondContact O-CB 3.02Å; F137-A196 HydrophobicContact CD1-CB 4.02Å; F137-A196 HydrophobicContact CE1-CB 3.64Å; F137-A196 HydrophobicContact CZ-CB 4.4Å; K192-A196 PolarHBondContact O-N 3Å; S193-A196 WeakPolarHBondContact O-CB 3.49Å; S193-A196 PolarHBondContact O-N 3.44Å; A194-A196 VanDerWaalsContact C-N 3.32Å; A194-A196 PolarHBondContact O-N 2.97Å; A196-L198 VanDerWaalsContact C-N 3.34Å; A196-L198 PolarHBondContact O-N 3.06Å; A196-Q199 WeakPolarHBondContact O-CB 3.36Å; A196-Q199 PolarHBondContact O-N 3.41Å; A196-Q199 VanDerWaalsContact O-N 3.15Å; A196-D224 HydrophobicContact CB-CB 4.19Å
197	L	91.6	Very high	91.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62.8	-37.8	-179.8	-70.5	166	0	0	0	112.5	S193 A194 Q199 L200 F203 F221 G223 Y226	S193-L197 WeakPolarHBondContact O-CG 3.02Å; S193-L197 PolarHBondContact O-N 3.4Å; A194-L197 PolarHBondContact O-N 3.07Å; L197-Q199 PolarHBondContact O-N 3.49Å; L197-Q199 VanDerWaalsContact O-N 3.16Å; L197-L200 HydrophobicContact CD2-CD1 4.48Å; L197-L200 WeakPolarHBondContact O-CA 3.26Å; L197-L200 VanDerWaalsContact O-CB 3.24Å; L197-L200 WeakPolarHBondContact O-CB 3.38Å; L197-L200 WeakPolarHBondContact O-CG 3.38Å; L197-L200 PolarHBondContact O-N 3.38Å; L197-F203 HydrophobicContact CB-CB 4.47Å; L197-F203 HydrophobicContact CB-CD1 3.62Å; L197-F203 HydrophobicContact CB-CD2 3.99Å; L197-F203 HydrophobicContact CB-CE1 3.73Å; L197-F203 HydrophobicContact CB-CE2 4.08Å; L197-F203 HydrophobicContact CB-CG 3.76Å; L197-F203 HydrophobicContact CB-CZ 3.96Å; L197-F203 HydrophobicContact CD1-CD2 4.26Å; L197-F203 HydrophobicContact CD1-CE1 4.39Å; L197-F203 HydrophobicContact CD1-CE2 3.71Å; L197-F203 HydrophobicContact CD1-CZ 3.79Å; L197-F203 HydrophobicContact CD2-CD2 3.88Å; L197-F203 HydrophobicContact CD2-CE2 4.16Å; L197-F203 HydrophobicContact CD2-CG 4.3Å; L197-F203 HydrophobicContact CG-CD2 4.27Å; L197-F203 HydrophobicContact CG-CE2 4.21Å; L197-F203 HydrophobicContact CG-CZ 4.39Å; L197-F221 HydrophobicContact CD1-CB 3.68Å; L197-F221 HydrophobicContact CD1-CD1 4.1Å; L197-F221 HydrophobicContact CD1-CD2 3.44Å; L197-F221 VanDerWaalsContact CD1-CD2 3.44Å; L197-F221 HydrophobicContact CD1-CE2 4.1Å; L197-F221 HydrophobicContact CD1-CG 3.45Å; L197-F221 VanDerWaalsContact CD1-CG 3.45Å; L197-G223 VanDerWaalsContact CD1-O 3.31Å; L197-G223 WeakPolarHBondContact CD1-O 3.22Å; L197-G223 WeakPolarHBondContact CG-O 3.48Å; L197-Y226 HydrophobicContact CD2-CD1 3.8Å; L197-Y226 HydrophobicContact CD2-CG 4.41Å
198	L	91	Very high	91.7	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-63.2	-19.6	177	-73	176.3	0	0	0	114.1	V153 L156 F157 K160 I174 A194 A196 L200 L204	V153-L198 HydrophobicContact CG1-CD1 3.95Å; V153-L198 HydrophobicContact CG2-CD1 4.16Å; L156-L198 HydrophobicContact CD2-CB 3.82Å; L156-L198 HydrophobicContact CD2-CD1 4.28Å; F157-L198 HydrophobicContact CE1-CD2 3.85Å; F157-L198 HydrophobicContact CZ-CD1 4.29Å; F157-L198 HydrophobicContact CZ-CD2 3.66Å; K160-L198 PolarHBondContact NZ-O 2.79Å; I174-L198 HydrophobicContact CD1-CD2 3.68Å; I174-L198 HydrophobicContact CG1-CD2 4.16Å; I174-L198 HydrophobicContact CG2-CD1 3.87Å; I174-L198 HydrophobicContact CG2-CD2 4.01Å; I174-L198 HydrophobicContact CG2-CG 4.33Å; A194-L198 WeakPolarHBondContact O-CB 3.06Å; A194-L198 WeakPolarHBondContact O-CG 3.17Å; A194-L198 PolarHBondContact O-N 3.39Å; A196-L198 VanDerWaalsContact C-N 3.34Å; A196-L198 PolarHBondContact O-N 3.06Å; L198-L200 PolarHBondContact O-N 3.43Å; L198-L204 HydrophobicContact CD2-CD1 4.45Å
199	Q	87.1	Confident	91.6	Very high	33 Å²	33	9.8 Å²	9.8	15%	0.154	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-25.5	171.3	-60.3	-54.7	-48.3	0	0	111.3	K160 A196 L197	K160-Q199 PolarHBondContact NZ-O 3.26Å; A196-Q199 WeakPolarHBondContact O-CB 3.36Å; A196-Q199 PolarHBondContact O-N 3.41Å; A196-Q199 VanDerWaalsContact O-N 3.15Å; L197-Q199 PolarHBondContact O-N 3.49Å; L197-Q199 VanDerWaalsContact O-N 3.16Å
200	L	88.5	Confident	91.4	Very high	23 Å²	23	13.2 Å²	13.2	12%	0.12	6%	0.064	C	C	.	.			trans	-87.3	117.3	-177.8	-46.2	-176	0	0	0	110.5	Q115 L197 L198 E202 F203 L204 Y226	Q115-L200 HydrophobicContact CG-CD1 4.44Å; L197-L200 HydrophobicContact CD2-CD1 4.48Å; L197-L200 WeakPolarHBondContact O-CA 3.26Å; L197-L200 VanDerWaalsContact O-CB 3.24Å; L197-L200 WeakPolarHBondContact O-CB 3.38Å; L197-L200 WeakPolarHBondContact O-CG 3.38Å; L197-L200 PolarHBondContact O-N 3.38Å; L198-L200 PolarHBondContact O-N 3.43Å; L200-E202 VanDerWaalsContact C-N 3.25Å; L200-E202 PolarHBondContact O-N 3.46Å; L200-F203 HydrophobicContact CB-CB 4.1Å; L200-F203 PolarHBondContact O-N 3.04Å; L200-L204 PolarHBondContact O-N 3.32Å; L200-L204 VanDerWaalsContact O-N 3.15Å; L200-Y226 HydrophobicContact CD1-CE1 4.06Å
201	N	89.2	Confident	91.1	Very high	20 Å²	20	20.6 Å²	20.6	11%	0.107	10%	0.104	C	C	.	.	H	α-helix	trans	-63.7	-34.4	179.9	-63	-17.8	0	0	0	112.1	K160 F203 L204 L205 I316	K160-N201 PolarHBondContact NZ-OD1 3.1Å; K160-N201 VanDerWaalsContact NZ-OD1 3.15Å; N201-F203 PolarHBondContact O-N 3.32Å; N201-L204 PolarHBondContact O-N 2.98Å; N201-L205 WeakPolarHBondContact O-CB 3.49Å; N201-L205 VanDerWaalsContact O-CG 3.31Å; N201-L205 WeakPolarHBondContact O-CG 3.31Å; N201-L205 PolarHBondContact O-N 2.96Å; N201-I316 WeakPolarHBondContact CB-O 3.26Å; N201-I316 PolarHBondContact ND2-O 2.77Å
202	E	90.8	Very high	91	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.019	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-43.4	175.3	174.5	167.9	-133.8	0	0	112.2	K113 L200 L205 M206 Y226 M313 R314	K113-E202 IonicContact NZ-OE1 3.59Å; K113-E202 PolarHBondContact NZ-OE1 3.06Å; K113-E202 IonicContact NZ-OE2 2.75Å; L200-E202 VanDerWaalsContact C-N 3.25Å; L200-E202 PolarHBondContact O-N 3.46Å; E202-L205 PolarHBondContact O-N 3.49Å; E202-M206 HydrophobicContact CG-CE 4.38Å; E202-M206 WeakPolarHBondContact O-CG 3.46Å; E202-M206 PolarHBondContact O-N 2.66Å; E202-Y226 VanDerWaalsContact CD-OH 3.24Å; E202-Y226 PolarHBondContact OE2-OH 3.04Å; E202-M313 HydrophobicContact CB-CB 4.27Å; E202-M313 HydrophobicContact CG-CB 4.16Å; E202-M313 PolarHBondContact OE1-N 2.99Å; E202-R314 HydrophobicContact CB-CG 3.91Å; E202-R314 HydrophobicContact CG-CG 4.45Å; E202-R314 WeakPolarHBondContact OE2-CG 3.45Å
203	F	91.6	Very high	90.8	Very high	5 Å²	5	30 Å²	30	2%	0.022	15%	0.146	C	C	.	.	H	α-helix	trans	-65.2	-45.8	176.3	-178.9	-92	0	0	0	111.6	V177 L197 L200 N201 L205 M206 V207 L218 F221	V177-F203 HydrophobicContact CG1-CZ 4.15Å; L197-F203 HydrophobicContact CB-CB 4.47Å; L197-F203 HydrophobicContact CB-CD1 3.62Å; L197-F203 HydrophobicContact CB-CD2 3.99Å; L197-F203 HydrophobicContact CB-CE1 3.73Å; L197-F203 HydrophobicContact CB-CE2 4.08Å; L197-F203 HydrophobicContact CB-CG 3.76Å; L197-F203 HydrophobicContact CB-CZ 3.96Å; L197-F203 HydrophobicContact CD1-CD2 4.26Å; L197-F203 HydrophobicContact CD1-CE1 4.39Å; L197-F203 HydrophobicContact CD1-CE2 3.71Å; L197-F203 HydrophobicContact CD1-CZ 3.79Å; L197-F203 HydrophobicContact CD2-CD2 3.88Å; L197-F203 HydrophobicContact CD2-CE2 4.16Å; L197-F203 HydrophobicContact CD2-CG 4.3Å; L197-F203 HydrophobicContact CG-CD2 4.27Å; L197-F203 HydrophobicContact CG-CE2 4.21Å; L197-F203 HydrophobicContact CG-CZ 4.39Å; L200-F203 HydrophobicContact CB-CB 4.1Å; L200-F203 PolarHBondContact O-N 3.04Å; N201-F203 PolarHBondContact O-N 3.32Å; F203-L205 VanDerWaalsContact C-N 3.29Å; F203-L205 PolarHBondContact O-N 3.11Å; F203-M206 HydrophobicContact CB-CE 4.36Å; F203-M206 HydrophobicContact CD2-CE 4.15Å; F203-M206 PolarHBondContact O-N 2.94Å; F203-V207 HydrophobicContact CD1-CG2 4.28Å; F203-V207 HydrophobicContact CE1-CG2 3.84Å; F203-V207 HydrophobicContact CZ-CG2 4.03Å; F203-V207 PolarHBondContact O-N 2.96Å; F203-V207 VanDerWaalsContact O-N 3.09Å; F203-L218 HydrophobicContact CD2-CD1 4.42Å; F203-L218 HydrophobicContact CD2-CD2 4.37Å; F203-L218 HydrophobicContact CE2-CD1 4.12Å; F203-L218 HydrophobicContact CE2-CD2 3.55Å; F203-L218 HydrophobicContact CZ-CD2 4.04Å; F203-F221 HydrophobicContact CE2-CD1 4.46Å
204	L	91.1	Very high	90.8	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-56.6	-44.7	176.4	179.2	61.6	0	0	0	111.6	F157 L170 L198 L200 N201 V207 I208	F157-L204 HydrophobicContact CE1-CD1 3.81Å; F157-L204 HydrophobicContact CZ-CD1 4.1Å; L170-L204 HydrophobicContact CD2-CD1 4.41Å; L198-L204 HydrophobicContact CD2-CD1 4.45Å; L200-L204 PolarHBondContact O-N 3.32Å; L200-L204 VanDerWaalsContact O-N 3.15Å; N201-L204 PolarHBondContact O-N 2.98Å; L204-V207 PolarHBondContact O-N 2.98Å; L204-I208 HydrophobicContact CD1-CD1 3.84Å; L204-I208 HydrophobicContact CD1-CG1 4.27Å; L204-I208 HydrophobicContact CD2-CD1 4.42Å; L204-I208 HydrophobicContact CG-CD1 3.74Å; L204-I208 VanDerWaalsContact O-CG1 3.31Å; L204-I208 WeakPolarHBondContact O-CG1 3.24Å; L204-I208 PolarHBondContact O-N 3.33Å
205	L	92.3	Very high	90.7	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-67.4	-38.3	178.4	-73	165.1	0	0	0	112.6	N201 E202 F203 V207 I208 L209 F290 M313 I316	N201-L205 WeakPolarHBondContact O-CB 3.49Å; N201-L205 VanDerWaalsContact O-CG 3.31Å; N201-L205 WeakPolarHBondContact O-CG 3.31Å; N201-L205 PolarHBondContact O-N 2.96Å; E202-L205 PolarHBondContact O-N 3.49Å; F203-L205 VanDerWaalsContact C-N 3.29Å; F203-L205 PolarHBondContact O-N 3.11Å; L205-V207 VanDerWaalsContact C-N 3.26Å; L205-V207 PolarHBondContact O-N 2.82Å; L205-I208 PolarHBondContact O-N 2.94Å; L205-L209 HydrophobicContact CD2-CD1 4.4Å; L205-L209 VanDerWaalsContact O-CB 3.3Å; L205-L209 WeakPolarHBondContact O-CB 3.37Å; L205-L209 PolarHBondContact O-N 3.17Å; L205-F290 HydrophobicContact CD2-CD1 3.85Å; L205-F290 HydrophobicContact CD2-CD2 4.41Å; L205-F290 HydrophobicContact CD2-CE1 3.88Å; L205-F290 HydrophobicContact CD2-CE2 4.45Å; L205-F290 HydrophobicContact CD2-CG 4.13Å; L205-F290 HydrophobicContact CD2-CZ 4.19Å; L205-F290 HydrophobicContact CG-CE1 4.46Å; L205-M313 HydrophobicContact CB-CE 4.31Å; L205-M313 HydrophobicContact CB-SD 4.13Å; L205-M313 HydrophobicContact CD1-CB 4.1Å; L205-I316 HydrophobicContact CD1-CB 3.5Å; L205-I316 VanDerWaalsContact CD1-CB 3.5Å; L205-I316 HydrophobicContact CD1-CD1 4.36Å; L205-I316 HydrophobicContact CD1-CG1 4.46Å; L205-I316 HydrophobicContact CD1-CG2 3.53Å; L205-I316 HydrophobicContact CD2-CG2 4.49Å
206	M	93.1	Very high	90.7	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-61.2	-35.7	174	-75.2	-172.7	-59.7	0	0	112.4	E202 F203 Q210 T215 L218 Y226 M228 M313	E202-M206 HydrophobicContact CG-CE 4.38Å; E202-M206 WeakPolarHBondContact O-CG 3.46Å; E202-M206 PolarHBondContact O-N 2.66Å; F203-M206 HydrophobicContact CB-CE 4.36Å; F203-M206 HydrophobicContact CD2-CE 4.15Å; F203-M206 PolarHBondContact O-N 2.94Å; M206-Q210 VanDerWaalsContact O-CA 3.25Å; M206-Q210 WeakPolarHBondContact O-CA 3.38Å; M206-Q210 WeakPolarHBondContact O-CB 3.25Å; M206-Q210 PolarHBondContact O-N 3.46Å; M206-Q210 VanDerWaalsContact O-N 3.15Å; M206-T215 HydrophobicContact CG-CG2 4.28Å; M206-L218 HydrophobicContact CE-CD1 4.16Å; M206-Y226 HydrophobicContact CE-CD2 3.64Å; M206-Y226 HydrophobicContact CE-CE2 3.39Å; M206-Y226 HydrophobicContact CE-CG 4.49Å; M206-Y226 HydrophobicContact SD-CE2 4.31Å; M206-M228 HydrophobicContact SD-CB 4.34Å; M206-M313 HydrophobicContact CB-CE 4.48Å; M206-M313 HydrophobicContact CG-CE 3.44Å; M206-M313 VanDerWaalsContact CG-CE 3.44Å
207	V	91.9	Very high	90.8	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-74.4	-44.9	176.1	177.2	0	0	0	0	111.3	L173 I174 V177 F203 L204 L205 L209 L218	L173-V207 HydrophobicContact CD2-CG1 3.69Å; L173-V207 HydrophobicContact CG-CG1 3.84Å; I174-V207 HydrophobicContact CD1-CB 4.15Å; I174-V207 HydrophobicContact CD1-CG1 3.73Å; I174-V207 HydrophobicContact CD1-CG2 4.17Å; V177-V207 HydrophobicContact CG1-CG2 4.42Å; V177-V207 HydrophobicContact CG2-CG1 4.08Å; V177-V207 HydrophobicContact CG2-CG2 4.48Å; F203-V207 HydrophobicContact CD1-CG2 4.28Å; F203-V207 HydrophobicContact CE1-CG2 3.84Å; F203-V207 HydrophobicContact CZ-CG2 4.03Å; F203-V207 PolarHBondContact O-N 2.96Å; F203-V207 VanDerWaalsContact O-N 3.09Å; L204-V207 PolarHBondContact O-N 2.98Å; L205-V207 VanDerWaalsContact C-N 3.26Å; L205-V207 PolarHBondContact O-N 2.82Å; V207-L209 VanDerWaalsContact C-N 3.32Å; V207-L209 PolarHBondContact O-N 3.3Å; V207-L218 HydrophobicContact CG2-CD2 4.48Å
208	I	90.8	Very high	90.9	Very high	31 Å²	31	36 Å²	36	16%	0.159	17%	0.173	C	C	.	.	H	α-helix	trans	-63.3	-39.3	179.7	-71	170.3	0	0	0	111.7	L170 L204 L205 Y287 F290	L170-I208 HydrophobicContact CD1-CD1 4.31Å; L170-I208 HydrophobicContact CD1-CG1 3.74Å; L170-I208 HydrophobicContact CD2-CD1 4.37Å; L204-I208 HydrophobicContact CD1-CD1 3.84Å; L204-I208 HydrophobicContact CD1-CG1 4.27Å; L204-I208 HydrophobicContact CD2-CD1 4.42Å; L204-I208 HydrophobicContact CG-CD1 3.74Å; L204-I208 VanDerWaalsContact O-CG1 3.31Å; L204-I208 WeakPolarHBondContact O-CG1 3.24Å; L204-I208 PolarHBondContact O-N 3.33Å; L205-I208 PolarHBondContact O-N 2.94Å; I208-Y287 HydrophobicContact CB-CD2 4.28Å; I208-Y287 HydrophobicContact CB-CE2 4.44Å; I208-Y287 HydrophobicContact CD1-CD2 3.91Å; I208-Y287 HydrophobicContact CG1-CD2 3.76Å; I208-Y287 HydrophobicContact CG1-CE2 4.05Å; I208-Y287 HydrophobicContact CG2-CD2 3.62Å; I208-Y287 HydrophobicContact CG2-CE2 3.92Å; I208-F290 HydrophobicContact CD1-CE2 4.45Å; I208-F290 HydrophobicContact CD1-CZ 3.93Å
209	L	91.4	Very high	91.1	Very high	8 Å²	8	38.8 Å²	38.8	4%	0.042	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	22.5	-174.6	-55.8	174.2	0	0	0	112.3	L205 V207 D211 K212 T215 F278 D281 V282	L205-L209 HydrophobicContact CD2-CD1 4.4Å; L205-L209 VanDerWaalsContact O-CB 3.3Å; L205-L209 WeakPolarHBondContact O-CB 3.37Å; L205-L209 PolarHBondContact O-N 3.17Å; V207-L209 VanDerWaalsContact C-N 3.32Å; V207-L209 PolarHBondContact O-N 3.3Å; L209-D211 PolarHBondContact O-N 3.3Å; L209-K212 HydrophobicContact CB-CB 4.33Å; L209-K212 HydrophobicContact CB-CG 4.13Å; L209-K212 HydrophobicContact CD2-CG 4.12Å; L209-K212 WeakPolarHBondContact O-CB 3.29Å; L209-K212 PolarHBondContact O-N 2.93Å; L209-T215 HydrophobicContact CB-CG2 4.2Å; L209-T215 VanDerWaalsContact CB-OG1 3.25Å; L209-T215 WeakPolarHBondContact CB-OG1 3.17Å; L209-T215 WeakPolarHBondContact O-CB 3.49Å; L209-T215 PolarHBondContact O-OG1 2.99Å; L209-F278 HydrophobicContact CD1-CD2 4.33Å; L209-F278 HydrophobicContact CD1-CE2 3.73Å; L209-D281 HydrophobicContact CD2-CB 4.14Å; L209-V282 HydrophobicContact CD1-CG2 4.03Å
210	Q	87.7	Confident	91.4	Very high	80 Å²	80	37.4 Å²	37.4	37%	0.374	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-33.2	-173.5	-175	173.6	-15.7	0	0	113.2	M206 K212	M206-Q210 VanDerWaalsContact O-CA 3.25Å; M206-Q210 WeakPolarHBondContact O-CA 3.38Å; M206-Q210 WeakPolarHBondContact O-CB 3.25Å; M206-Q210 PolarHBondContact O-N 3.46Å; M206-Q210 VanDerWaalsContact O-N 3.15Å; Q210-K212 VanDerWaalsContact C-N 3.33Å
211	D	87.6	Confident	91.7	Very high	157 Å²	157	36.5 Å²	36.5	84%	0.84	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-0.5	-179.2	-64.1	-39.3	0	0	0	113.6	L209	L209-D211 PolarHBondContact O-N 3.3Å
212	K	91.6	Very high	91.9	Very high	83 Å²	83	35.6 Å²	35.6	36%	0.361	17%	0.172	S	C	.	.	S	Bend	trans	-93.3	136.1	-177	-56.9	-59.7	-169.9	137.9	0	111.4	L209 Q210 H214 T215 D281	L209-K212 HydrophobicContact CB-CB 4.33Å; L209-K212 HydrophobicContact CB-CG 4.13Å; L209-K212 HydrophobicContact CD2-CG 4.12Å; L209-K212 WeakPolarHBondContact O-CB 3.29Å; L209-K212 PolarHBondContact O-N 2.93Å; Q210-K212 VanDerWaalsContact C-N 3.33Å; K212-H214 VanDerWaalsContact C-N 3.26Å; K212-H214 VanDerWaalsContact CB-NE2 3.31Å; K212-H214 WeakPolarHBondContact CB-NE2 3.3Å; K212-H214 PolarHBondContact O-N 3.42Å; K212-T215 PolarHBondContact O-N 3.26Å; K212-T215 VanDerWaalsContact O-N 3.15Å; K212-D281 WeakPolarHBondContact CD-OD2 3.31Å; K212-D281 WeakPolarHBondContact CE-OD2 3.25Å; K212-D281 IonicContact NZ-OD1 2.86Å; K212-D281 PolarHBondContact NZ-OD1 2.79Å; K212-D281 IonicContact NZ-OD2 3.51Å; K212-D281 PolarHBondContact NZ-OD2 2.89Å
213	E	90.3	Very high	92	Very high	141 Å²	141	35.4 Å²	35.4	66%	0.659	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-32.1	-175.2	-64.3	-170.9	169.3	0	0	113.1	T215 K309	E213-T215 PolarHBondContact O-N 3.05Å; E213-K309 WeakPolarHBondContact O-CD 3.31Å; E213-K309 WeakPolarHBondContact O-CE 3.42Å; E213-K309 PolarHBondContact O-NZ 3.48Å
214	H	92.4	Very high	91.9	Very high	8 Å²	8	35.5 Å²	35.5	4%	0.037	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-5.2	-179.5	50.2	-114.6	0	0	0	115	K212 F278 D281 L308 K309 M310	K212-H214 VanDerWaalsContact C-N 3.26Å; K212-H214 VanDerWaalsContact CB-NE2 3.31Å; K212-H214 WeakPolarHBondContact CB-NE2 3.3Å; K212-H214 PolarHBondContact O-N 3.42Å; H214-F278 HydrophobicContact CB-CB 4.35Å; H214-F278 AromaticContact CD2-CD2 3.29Å; H214-F278 WeakPolarHBondContact CD2-CD2 3.37Å; H214-F278 AromaticContact CG-CD2 3.93Å; H214-F278 AromaticContact NE2-CD2 3.52Å; H214-D281 IonicContact CE1-OD2 3.31Å; H214-D281 PolarHBondContact CE1-OD2 3.4Å; H214-D281 IonicContact NE2-OD2 2.8Å; H214-L308 VanDerWaalsContact CA-O 3.26Å; H214-L308 WeakPolarHBondContact CA-O 3.48Å; H214-L308 HydrophobicContact CB-CD2 4.38Å; H214-K309 CarbonylContact O-C 3.2Å; H214-K309 WeakPolarHBondContact O-CA 3.43Å; H214-M310 WeakPolarHBondContact O-CG 2.93Å; H214-M310 PolarHBondContact O-N 3.47Å
215	T	92.9	Very high	92	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	17%	0.171	C	C	.	.	S	Bend	trans	-103.1	132.3	180	-57.8	0	0	0	0	110.2	M206 L209 K212 E213 K217 K309 M313	M206-T215 HydrophobicContact CG-CG2 4.28Å; L209-T215 HydrophobicContact CB-CG2 4.2Å; L209-T215 VanDerWaalsContact CB-OG1 3.25Å; L209-T215 WeakPolarHBondContact CB-OG1 3.17Å; L209-T215 WeakPolarHBondContact O-CB 3.49Å; L209-T215 PolarHBondContact O-OG1 2.99Å; K212-T215 PolarHBondContact O-N 3.26Å; K212-T215 VanDerWaalsContact O-N 3.15Å; E213-T215 PolarHBondContact O-N 3.05Å; T215-K217 PolarHBondContact O-N 3.25Å; T215-K309 PolarHBondContact O-NZ 2.84Å; T215-M313 HydrophobicContact CG2-CE 3.97Å
216	P	92.7	Very high	92.1	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-63	130.8	169.9	-24.2	35.1	0	0	0	112.1	L218 M228 E229 V231 M310	P216-L218 PolarHBondContact O-N 3.5Å; P216-M228 HydrophobicContact CB-CB 4.38Å; P216-M228 HydrophobicContact CB-CE 3.62Å; P216-M228 HydrophobicContact CB-SD 4.46Å; P216-M228 HydrophobicContact CG-CE 3.7Å; P216-E229 VanDerWaalsContact CA-OE1 3.24Å; P216-E229 WeakPolarHBondContact CA-OE1 3.43Å; P216-E229 HydrophobicContact CB-CG 3.81Å; P216-V231 HydrophobicContact CG-CG2 4.22Å; P216-M310 WeakPolarHBondContact CD-O 3.12Å; P216-M310 WeakPolarHBondContact CG-O 3.28Å
217	K	92.1	Very high	92.2	Very high	129 Å²	129	35.6 Å²	35.6	56%	0.561	17%	0.172	S	C	*	.	P	Polyproline II helix	trans	-63.1	129.2	176.2	-66	-178.8	179.5	-179.3	0	111.7	T215 M219 M228 E229	T215-K217 PolarHBondContact O-N 3.25Å; K217-M219 PolarHBondContact O-N 3.12Å; K217-M228 CarbonylContact O-C 3.59Å; K217-M228 VanDerWaalsContact O-CA 3.26Å; K217-M228 WeakPolarHBondContact O-CA 3.38Å; K217-E229 HydrophobicContact CB-CB 4.43Å; K217-E229 HydrophobicContact CB-CG 4.29Å; K217-E229 WeakPolarHBondContact CG-OE2 3.22Å; K217-E229 PolarHBondContact N-OE1 3.21Å; K217-E229 PolarHBondContact O-N 3.05Å
218	L	93.7	Very high	92.3	Very high	26 Å²	26	35.7 Å²	35.7	14%	0.136	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	117.9	167.9	180	70.2	0	0	0	109	V177 F203 M206 V207 P216 Y226	V177-L218 HydrophobicContact CG1-CD2 4.49Å; F203-L218 HydrophobicContact CD2-CD1 4.42Å; F203-L218 HydrophobicContact CD2-CD2 4.37Å; F203-L218 HydrophobicContact CE2-CD1 4.12Å; F203-L218 HydrophobicContact CE2-CD2 3.55Å; F203-L218 HydrophobicContact CZ-CD2 4.04Å; M206-L218 HydrophobicContact CE-CD1 4.16Å; V207-L218 HydrophobicContact CG2-CD2 4.48Å; P216-L218 PolarHBondContact O-N 3.5Å; L218-Y226 HydrophobicContact CD1-CD2 4.23Å
219	M	93.5	Very high	92.4	Very high	57 Å²	57	36.3 Å²	36.3	28%	0.281	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-35.4	176.9	-62.6	177.2	69.3	0	0	111.3	W105 L108 K217 V227	W105-M219 HydrophobicContact CB-CE 4.41Å; W105-M219 HydrophobicContact CE3-CB 3.87Å; W105-M219 HydrophobicContact CE3-CE 4.24Å; W105-M219 VanDerWaalsContact CZ3-C 3.49Å; W105-M219 HydrophobicContact CZ3-CB 3.71Å; W105-M219 WeakPolarHBondContact CZ3-O 3.43Å; L108-M219 HydrophobicContact CB-CE 3.71Å; L108-M219 HydrophobicContact CD1-CE 4.06Å; K217-M219 PolarHBondContact O-N 3.12Å; M219-V227 HydrophobicContact CB-CB 4.37Å; M219-V227 HydrophobicContact CB-CG1 4.35Å; M219-V227 PolarHBondContact N-O 3.04Å; M219-V227 HydrophobicContact SD-CG1 4.02Å
220	G	93.9	Very high	92.4	Very high	4 Å²	4	37.3 Å²	37.3	4%	0.041	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.6	179.3	-179.3	0	0	0	0	0	112.8	Y226 V227	G220-Y226 WeakPolarHBondContact O-CA 3.44Å; G220-V227 PolarHBondContact N-O 2.93Å; G220-V227 PolarHBondContact O-N 3.42Å
221	F	95.1	Very high	92.6	Very high	5 Å²	5	34 Å²	34	2%	0.022	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	164.6	-174.9	62	-91.5	0	0	0	112.1	G74 P75 A76 V177 L197 F203 L225	G74-F221 CarbonylContact C-O 3.57Å; G74-F221 VanDerWaalsContact C-O 3.26Å; G74-F221 WeakPolarHBondContact CA-O 3.5Å; P75-F221 WeakPolarHBondContact CD-O 3.38Å; P75-F221 HydrophobicContact CG-CD1 4.27Å; P75-F221 HydrophobicContact CG-CE1 4.22Å; A76-F221 WeakPolarHBondContact CB-O 3.43Å; A76-F221 PolarHBondContact N-O 3.23Å; V177-F221 HydrophobicContact CG1-CE1 4.06Å; V177-F221 WeakPolarHBondContact O-CE1 3.49Å; V177-F221 WeakPolarHBondContact O-CZ 3.2Å; L197-F221 HydrophobicContact CD1-CB 3.68Å; L197-F221 HydrophobicContact CD1-CD1 4.1Å; L197-F221 HydrophobicContact CD1-CD2 3.44Å; L197-F221 VanDerWaalsContact CD1-CD2 3.44Å; L197-F221 HydrophobicContact CD1-CE2 4.1Å; L197-F221 HydrophobicContact CD1-CG 3.45Å; L197-F221 VanDerWaalsContact CD1-CG 3.45Å; F203-F221 HydrophobicContact CE2-CD1 4.46Å; F221-L225 CarbonylContact C-O 3.56Å; F221-L225 VanDerWaalsContact CA-O 3.23Å; F221-L225 WeakPolarHBondContact CA-O 3.46Å; F221-L225 WeakPolarHBondContact CB-O 3.26Å
222	C	94.6	Very high	92.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	105.9	171.3	-177.8	0	0	0	0	109.5	I63 A76 C77 L80 D224 L225	I63-C222 HydrophobicContact CG2-CB 4.16Å; I63-C222 WeakPolarHBondContact CG2-SG 3.21Å; A76-C222 HydrophobicContact CB-CB 4.42Å; C77-C222 WeakPolarHBondContact CA-SG 3.35Å; C77-C222 HydrophobicContact CB-CB 3.92Å; C77-C222 WeakPolarHBondContact CB-SG 3.33Å; C77-C222 WeakPolarHBondContact SG-CA 3.28Å; C77-C222 WeakPolarHBondContact SG-CB 3.31Å; C77-C222 CovalentContact SG-SG 2.03Å; C77-C222 PolarHBondContact SG-SG 2.73Å; L80-C222 HydrophobicContact CD2-CB 4.42Å; C222-D224 PolarHBondContact O-N 3.49Å; C222-L225 PolarHBondContact N-O 3.26Å; C222-L225 WeakPolarHBondContact O-CB 3.06Å; C222-L225 PolarHBondContact O-N 2.91Å
223	G	91.8	Very high	92.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	-121.5	-168.1	0	0	0	0	0	110.8	D73 L197	D73-G223 PolarHBondContact O-N 3.15Å; L197-G223 VanDerWaalsContact CD1-O 3.31Å; L197-G223 WeakPolarHBondContact CD1-O 3.22Å; L197-G223 WeakPolarHBondContact CG-O 3.48Å
224	D	90	Very high	92.1	Very high	8 Å²	8	29 Å²	29	4%	0.043	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-1.7	176.3	66.4	-34	0	0	0	113.9	I63 L136 F137 A196 C222	I63-D224 WeakPolarHBondContact CD1-OD1 3.4Å; L136-D224 HydrophobicContact CD2-CB 3.24Å; L136-D224 WeakPolarHBondContact CD2-OD2 3.4Å; F137-D224 HydrophobicContact CE1-CB 4.4Å; F137-D224 HydrophobicContact CZ-CB 3.93Å; F137-D224 WeakPolarHBondContact CZ-OD1 3.48Å; A196-D224 HydrophobicContact CB-CB 4.19Å; C222-D224 PolarHBondContact O-N 3.49Å
225	L	93.4	Very high	91.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134.7	167	176.8	154	0	0	0	108.9	I63 L80 F88 V112 K113 C114 F221 C222 V227	I63-L225 HydrophobicContact CD1-CB 4.42Å; I63-L225 HydrophobicContact CG1-CB 4.3Å; L80-L225 HydrophobicContact CD2-CD1 4.11Å; L80-L225 HydrophobicContact CD2-CD2 4.44Å; F88-L225 HydrophobicContact CE1-CD1 4.45Å; F88-L225 HydrophobicContact CZ-CD1 3.73Å; V112-L225 HydrophobicContact CG1-CD1 3.81Å; V112-L225 HydrophobicContact CG1-CD2 3.95Å; V112-L225 HydrophobicContact CG1-CG 3.89Å; K113-L225 WeakPolarHBondContact O-CA 3.28Å; C114-L225 HydrophobicContact CB-CD1 4.26Å; F221-L225 CarbonylContact C-O 3.56Å; F221-L225 VanDerWaalsContact CA-O 3.23Å; F221-L225 WeakPolarHBondContact CA-O 3.46Å; F221-L225 WeakPolarHBondContact CB-O 3.26Å; C222-L225 PolarHBondContact N-O 3.26Å; C222-L225 WeakPolarHBondContact O-CB 3.06Å; C222-L225 PolarHBondContact O-N 2.91Å; L225-V227 HydrophobicContact CD2-CG2 4.28Å
226	Y	94.2	Very high	91.3	Very high	5 Å²	5	30.4 Å²	30.4	2%	0.02	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	156.4	175	64	-89	0	0	0	112	K113 L197 L200 E202 M206 L218 G220	K113-Y226 HydrophobicContact CB-CD1 4.49Å; K113-Y226 HydrophobicContact CB-CD2 4.37Å; K113-Y226 HydrophobicContact CB-CE1 3.97Å; K113-Y226 HydrophobicContact CB-CE2 3.83Å; K113-Y226 HydrophobicContact CD-CE2 3.67Å; K113-Y226 WeakPolarHBondContact CD-OH 2.96Å; K113-Y226 HydrophobicContact CG-CE2 4.11Å; K113-Y226 PolarHBondContact N-O 3.19Å; K113-Y226 PolarHBondContact O-N 3.02Å; K113-Y226 VanDerWaalsContact O-N 3.11Å; L197-Y226 HydrophobicContact CD2-CD1 3.8Å; L197-Y226 HydrophobicContact CD2-CG 4.41Å; L200-Y226 HydrophobicContact CD1-CE1 4.06Å; E202-Y226 VanDerWaalsContact CD-OH 3.24Å; E202-Y226 PolarHBondContact OE2-OH 3.04Å; M206-Y226 HydrophobicContact CE-CD2 3.64Å; M206-Y226 HydrophobicContact CE-CE2 3.39Å; M206-Y226 HydrophobicContact CE-CG 4.49Å; M206-Y226 HydrophobicContact SD-CE2 4.31Å; L218-Y226 HydrophobicContact CD1-CD2 4.23Å; G220-Y226 WeakPolarHBondContact O-CA 3.44Å
227	V	95.1	Very high	90.5	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.8	-177.3	-170.3	0	0	0	0	109	L86 W105 V111 V112 M219 G220 L225	L86-V227 HydrophobicContact CD1-CG2 3.71Å; W105-V227 HydrophobicContact CE3-CB 4.01Å; W105-V227 HydrophobicContact CE3-CG1 4.08Å; W105-V227 HydrophobicContact CE3-CG2 4.21Å; W105-V227 HydrophobicContact CZ3-CB 4.23Å; W105-V227 HydrophobicContact CZ3-CG2 4.47Å; V111-V227 WeakPolarHBondContact O-CA 3.49Å; V112-V227 HydrophobicContact CG2-CG1 4.45Å; V112-V227 HydrophobicContact CG2-CG2 4.13Å; M219-V227 HydrophobicContact CB-CB 4.37Å; M219-V227 HydrophobicContact CB-CG1 4.35Å; M219-V227 PolarHBondContact N-O 3.04Å; M219-V227 HydrophobicContact SD-CG1 4.02Å; G220-V227 PolarHBondContact N-O 2.93Å; G220-V227 PolarHBondContact O-N 3.42Å; L225-V227 HydrophobicContact CD2-CG2 4.28Å
228	M	94.1	Very high	89.1	Confident	5 Å²	5	28.7 Å²	28.7	3%	0.025	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	162.6	176.7	57.5	-179.1	-100	0	0	110.3	G110 V111 K113 M206 P216 K217	G110-M228 CarbonylContact C-O 3.41Å; G110-M228 WeakPolarHBondContact CA-O 3.38Å; V111-M228 HydrophobicContact CB-CG 3.88Å; V111-M228 HydrophobicContact CG1-CG 4.49Å; V111-M228 PolarHBondContact N-O 3.35Å; V111-M228 PolarHBondContact O-N 3.29Å; K113-M228 HydrophobicContact CD-SD 4.05Å; K113-M228 VanDerWaalsContact CE-SD 3.57Å; K113-M228 PolarHBondContact NZ-SD 2.9Å; K113-M228 VanDerWaalsContact NZ-SD 3.36Å; M206-M228 HydrophobicContact SD-CB 4.34Å; P216-M228 HydrophobicContact CB-CB 4.38Å; P216-M228 HydrophobicContact CB-CE 3.62Å; P216-M228 HydrophobicContact CB-SD 4.46Å; P216-M228 HydrophobicContact CG-CE 3.7Å; K217-M228 CarbonylContact O-C 3.59Å; K217-M228 VanDerWaalsContact O-CA 3.26Å; K217-M228 WeakPolarHBondContact O-CA 3.38Å
229	E	92.8	Very high	87.6	Confident	44 Å²	44	29.9 Å²	29.9	21%	0.206	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	144.7	172.2	72.1	-175.6	178.2	0	0	111.4	P216 K217 K309	P216-E229 VanDerWaalsContact CA-OE1 3.24Å; P216-E229 WeakPolarHBondContact CA-OE1 3.43Å; P216-E229 HydrophobicContact CB-CG 3.81Å; K217-E229 HydrophobicContact CB-CB 4.43Å; K217-E229 HydrophobicContact CB-CG 4.29Å; K217-E229 WeakPolarHBondContact CG-OE2 3.22Å; K217-E229 PolarHBondContact N-OE1 3.21Å; K217-E229 PolarHBondContact O-N 3.05Å; E229-K309 WeakPolarHBondContact OE1-CE 3.21Å; E229-K309 IonicContact OE1-NZ 2.75Å; E229-K309 PolarHBondContact OE1-NZ 3.29Å
230	S	91.3	Very high	85.8	Confident	28 Å²	28	32.9 Å²	32.9	20%	0.196	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-74.7	136.3	174.8	62	0	0	0	0	111.2	P109	P109-S230 WeakPolarHBondContact CB-OG 3.3Å
231	V	90.6	Very high	84.2	Confident	12 Å²	12	34.6 Å²	34.6	7%	0.073	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-99	126.3	170.8	-176.9	0	0	0	0	108.5	P216 Y233 K309 V311	P216-V231 HydrophobicContact CG-CG2 4.22Å; V231-Y233 WeakPolarHBondContact CG1-O 3.33Å; V231-K309 HydrophobicContact CB-CB 4.48Å; V231-K309 HydrophobicContact CG1-CB 3.85Å; V231-K309 HydrophobicContact CG1-CG 4.34Å; V231-K309 HydrophobicContact CG2-CB 3.73Å; V231-K309 HydrophobicContact CG2-CG 4.22Å; V231-V311 HydrophobicContact CB-CG2 4.44Å; V231-V311 HydrophobicContact CG1-CG2 4.27Å; V231-V311 HydrophobicContact CG2-CG2 4.48Å
232	E	86.9	Confident	82.6	Confident	100 Å²	100	38 Å²	38	47%	0.467	22%	0.216	S	C	.	.	S	Bend	trans	-65.6	-48.5	-175.2	-64.6	83.1	178.2	0	0	111.8	N303	E232-N303 WeakPolarHBondContact OE2-CA 3.29Å; E232-N303 WeakPolarHBondContact OE2-CB 3.45Å
233	Y	87.4	Confident	81	Confident	99 Å²	99	43.9 Å²	43.9	39%	0.388	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-108.3	104.5	178.1	-59.6	-83.8	0	0	0	109.9	V231 S235 G301 Y302	V231-Y233 WeakPolarHBondContact CG1-O 3.33Å; Y233-S235 VanDerWaalsContact C-N 3.28Å; Y233-S235 PolarHBondContact O-N 3.18Å; Y233-G301 CarbonylContact O-C 3.46Å; Y233-G301 WeakPolarHBondContact O-CA 3.18Å; Y233-Y302 WeakPolarHBondContact CB-O 3.49Å; Y233-Y302 HydrophobicContact CD1-CE2 4.12Å; Y233-Y302 AromaticContact CD1-CZ 3.98Å; Y233-Y302 AromaticContact CD2-CD2 3.61Å; Y233-Y302 HydrophobicContact CD2-CD2 3.61Å; Y233-Y302 AromaticContact CD2-CE2 3.28Å; Y233-Y302 HydrophobicContact CD2-CE2 3.28Å; Y233-Y302 HydrophobicContact CD2-CG 4.47Å; Y233-Y302 AromaticContact CD2-CZ 3.93Å; Y233-Y302 HydrophobicContact CE2-CD2 4.38Å; Y233-Y302 AromaticContact CE2-CE2 3.86Å; Y233-Y302 HydrophobicContact CE2-CE2 3.86Å; Y233-Y302 AromaticContact CG-CD2 3.99Å; Y233-Y302 HydrophobicContact CG-CD2 3.99Å; Y233-Y302 HydrophobicContact CG-CE1 4.19Å; Y233-Y302 AromaticContact CG-CE2 3.42Å; Y233-Y302 HydrophobicContact CG-CE2 3.42Å; Y233-Y302 VanDerWaalsContact CG-CE2 3.42Å; Y233-Y302 AromaticContact CG-CZ 3.53Å; Y233-Y302 PolarHBondContact N-O 3.06Å; Y233-Y302 PolarHBondContact O-N 3.38Å
234	T	85.2	Confident	79.6	Confident	76 Å²	76	46 Å²	46	47%	0.466	25%	0.252	S	S	.	.			trans	-85.5	9.5	-172.9	63.3	0	0	0	0	114.6
235	S	86.3	Confident	78.4	Confident	34 Å²	34	49.6 Å²	49.6	24%	0.238	27%	0.27	C	S	.	.			trans	-151.9	141.6	176	-169.6	0	0	0	0	111	Y233 Y237 A297 L300	Y233-S235 VanDerWaalsContact C-N 3.28Å; Y233-S235 PolarHBondContact O-N 3.18Å; S235-Y237 VanDerWaalsContact C-N 3.34Å; S235-Y237 PolarHBondContact O-N 2.97Å; S235-Y237 PolarHBondContact OG-O 2.99Å; S235-Y237 VanDerWaalsContact OG-O 3.1Å; S235-A297 CarbonylContact C-O 3.6Å; S235-A297 VanDerWaalsContact CA-O 3.28Å; S235-A297 WeakPolarHBondContact CA-O 3.49Å; S235-A297 PolarHBondContact OG-O 3.47Å; S235-L300 CarbonylContact C-O 3.56Å; S235-L300 WeakPolarHBondContact CA-O 3.41Å
236	L	82.1	Confident	76.9	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	28%	0.284	C	S	.	.	S	Bend	trans	-63.6	-39.7	177.6	-74.3	177.9	0	0	0	113.2	I271 A297 L300 Y302 L308 L369	L236-I271 HydrophobicContact CD2-CG2 3.39Å; L236-A297 HydrophobicContact CB-CB 4.21Å; L236-A297 PolarHBondContact N-O 3.35Å; L236-L300 HydrophobicContact CD1-CB 3.64Å; L236-L300 HydrophobicContact CD1-CD1 3.49Å; L236-L300 VanDerWaalsContact CD1-CD1 3.49Å; L236-L300 HydrophobicContact CD1-CG 4.2Å; L236-L300 HydrophobicContact CD2-CB 4.2Å; L236-L300 HydrophobicContact CG-CB 3.52Å; L236-L300 HydrophobicContact CG-CD1 4.35Å; L236-L300 PolarHBondContact N-O 3.15Å; L236-Y302 HydrophobicContact CD2-CD1 4.49Å; L236-L308 HydrophobicContact CD2-CD1 3.98Å; L236-L369 HydrophobicContact CD1-CD2 3.94Å
237	Y	76	Confident	75.4	Confident	61 Å²	61	59.1 Å²	59.1	24%	0.239	32%	0.318	C	S	.	.	S	Bend	trans	-163.1	155.9	179.3	57.5	-97.3	0	0	0	108.8	S235 A297 L369 Y373	S235-Y237 VanDerWaalsContact C-N 3.34Å; S235-Y237 PolarHBondContact O-N 2.97Å; S235-Y237 PolarHBondContact OG-O 2.99Å; S235-Y237 VanDerWaalsContact OG-O 3.1Å; Y237-A297 HydrophobicContact CD1-CB 3.99Å; Y237-A297 HydrophobicContact CD2-CB 4.12Å; Y237-A297 HydrophobicContact CE1-CB 3.68Å; Y237-A297 HydrophobicContact CE2-CB 3.8Å; Y237-A297 HydrophobicContact CG-CB 4.21Å; Y237-L369 HydrophobicContact CE1-CD1 4.3Å; Y237-L369 WeakPolarHBondContact OH-CD1 3.25Å; Y237-Y373 AromaticContact CD1-CD2 3.64Å; Y237-Y373 HydrophobicContact CD1-CD2 3.64Å; Y237-Y373 HydrophobicContact CD1-CE2 4.17Å; Y237-Y373 HydrophobicContact CD1-CG 4.45Å; Y237-Y373 HydrophobicContact CE1-CD2 4.22Å
238	G	63.5	Low	73.9	Confident	34 Å²	34	66.6 Å²	66.6	35%	0.351	35%	0.351	S	S	.	.			trans	109.8	141.8	-175.3	0	0	0	0	0	113	D258	G238-D258 WeakPolarHBondContact CA-OD1 3.25Å; G238-D258 PolarHBondContact N-O 2.97Å
239	I	61.4	Low	72.4	Confident	51 Å²	51	67.9 Å²	67.9	26%	0.262	36%	0.357	S	S	.	.			trans	-100.8	128	177.8	-50.7	172.3	0	0	0	108.1	L241 D258 F261	I239-L241 HydrophobicContact CB-CD2 4.46Å; I239-L241 HydrophobicContact CB-CG 4.11Å; I239-L241 HydrophobicContact CG2-CD2 3.68Å; I239-L241 HydrophobicContact CG2-CG 3.8Å; I239-L241 PolarHBondContact O-N 3.15Å; I239-D258 PolarHBondContact N-OD1 2.71Å; I239-F261 HydrophobicContact CD1-CD2 3.53Å; I239-F261 HydrophobicContact CD1-CE2 3.48Å; I239-F261 VanDerWaalsContact CD1-CE2 3.48Å; I239-F261 HydrophobicContact CG1-CD2 3.99Å; I239-F261 HydrophobicContact CG1-CE2 4.39Å
240	S	57.2	Low	71.2	Confident	119 Å²	119	70 Å²	70	83%	0.832	38%	0.375	S	S	*	.			trans	-72.6	94.7	167.9	62.3	0	0	0	0	109.1
241	L	59.7	Low	69.7	Low	41 Å²	41	73.7 Å²	73.7	22%	0.215	40%	0.401	C	S	.	.			trans	-96.1	141.6	178.8	-68.7	172.2	0	0	0	110.4	I239 W243 I245 E246 I249 M257	I239-L241 HydrophobicContact CB-CD2 4.46Å; I239-L241 HydrophobicContact CB-CG 4.11Å; I239-L241 HydrophobicContact CG2-CD2 3.68Å; I239-L241 HydrophobicContact CG2-CG 3.8Å; I239-L241 PolarHBondContact O-N 3.15Å; L241-W243 PolarHBondContact O-N 3.4Å; L241-I245 HydrophobicContact CD1-CG2 4.33Å; L241-I245 HydrophobicContact CD2-CG2 4.36Å; L241-E246 HydrophobicContact CB-CG 3.87Å; L241-I249 HydrophobicContact CD1-CD1 3.46Å; L241-I249 VanDerWaalsContact CD1-CD1 3.46Å; L241-M257 HydrophobicContact CD1-CE 4.42Å
242	P	61.9	Low	68.3	Low	77 Å²	77	75.7 Å²	75.7	50%	0.5	42%	0.424	S	S	.	.			trans	-52.8	137.3	167.9	-24.4	32.4	0	0	0	110.8	V244 I245 E246	P242-V244 PolarHBondContact O-N 3.44Å; P242-I245 HydrophobicContact CG-CD1 4.16Å; P242-I245 PolarHBondContact O-N 2.89Å; P242-E246 PolarHBondContact O-N 2.82Å; P242-E246 VanDerWaalsContact O-N 3.14Å
243	W	60.4	Low	67.1	Low	123 Å²	123	76.7 Å²	76.7	47%	0.466	43%	0.427	S	S	.	.	H	α-helix	trans	-50.9	-31.9	-176.9	69.5	-93.2	0	0	0	113.8	I42 L241 E246 L247	I42-W243 HydrophobicContact CB-CZ2 4.41Å; I42-W243 HydrophobicContact CG1-CH2 3.97Å; I42-W243 HydrophobicContact CG1-CZ2 4.13Å; I42-W243 HydrophobicContact CG2-CZ2 3.9Å; L241-W243 PolarHBondContact O-N 3.4Å; W243-E246 PolarHBondContact O-N 2.9Å; W243-L247 PolarHBondContact O-N 2.99Å
244	V	63.3	Low	65.8	Low	45 Å²	45	75.5 Å²	75.5	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-62.9	-42	176.8	-176.8	0	0	0	0	111.2	I42 P242 F248	I42-V244 HydrophobicContact CG2-CG2 4.14Å; P242-V244 PolarHBondContact O-N 3.44Å; V244-F248 HydrophobicContact CG1-CE2 4.18Å; V244-F248 WeakPolarHBondContact O-CD2 3.32Å; V244-F248 WeakPolarHBondContact O-CE2 3.31Å
245	I	64.3	Low	64.6	Low	83 Å²	83	81 Å²	81	43%	0.426	43%	0.434	S	S	.	.	H	α-helix	trans	-74.4	-35.6	179	-64.8	173.3	0	0	0	110.2	L241 P242 L247 F248 I249	L241-I245 HydrophobicContact CD1-CG2 4.33Å; L241-I245 HydrophobicContact CD2-CG2 4.36Å; P242-I245 HydrophobicContact CG-CD1 4.16Å; P242-I245 PolarHBondContact O-N 2.89Å; I245-L247 PolarHBondContact O-N 3.23Å; I245-F248 PolarHBondContact O-N 3.42Å; I245-I249 HydrophobicContact CG2-CD1 3.82Å; I245-I249 WeakPolarHBondContact O-CG1 3.46Å
246	E	60.6	Low	63.3	Low	65 Å²	65	82.4 Å²	82.4	30%	0.304	44%	0.444	S	S	.	.	H	α-helix	trans	-58.7	-35.7	175.9	-65.2	-162.1	167.6	0	0	113	L241 P242 W243 F248 I249 R254	L241-E246 HydrophobicContact CB-CG 3.87Å; P242-E246 PolarHBondContact O-N 2.82Å; P242-E246 VanDerWaalsContact O-N 3.14Å; W243-E246 PolarHBondContact O-N 2.9Å; E246-F248 PolarHBondContact O-N 3.09Å; E246-I249 PolarHBondContact O-N 3.34Å; E246-R254 IonicContact OE1-CZ 3.98Å; E246-R254 IonicContact OE1-NH1 2.96Å; E246-R254 PolarHBondContact OE1-NH1 3.32Å; E246-R254 IonicContact OE1-NH2 2.78Å; E246-R254 PolarHBondContact OE1-NH2 3.39Å; E246-R254 IonicContact OE2-CZ 2.66Å; E246-R254 IonicContact OE2-NH1 3.11Å; E246-R254 PolarHBondContact OE2-NH1 2.76Å; E246-R254 IonicContact OE2-NH2 2.67Å; E246-R254 PolarHBondContact OE2-NH2 3.48Å
247	L	62.8	Low	62.2	Low	139 Å²	139	84.5 Å²	84.5	73%	0.728	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-25	-179.1	-147.9	99	0	0	0	113.3	W243 I245	W243-L247 PolarHBondContact O-N 2.99Å; I245-L247 PolarHBondContact O-N 3.23Å
248	F	64.9	Low	61.5	Low	159 Å²	159	82.9 Å²	82.9	70%	0.697	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-2.4	-178.2	-64.9	-73.2	0	0	0	113.6	V244 I245 E246	V244-F248 HydrophobicContact CG1-CE2 4.18Å; V244-F248 WeakPolarHBondContact O-CD2 3.32Å; V244-F248 WeakPolarHBondContact O-CE2 3.31Å; I245-F248 PolarHBondContact O-N 3.42Å; E246-F248 PolarHBondContact O-N 3.09Å
249	I	62	Low	61.3	Low	31 Å²	31	82.6 Å²	82.6	16%	0.159	44%	0.439	C	S	.	.	S	Bend	trans	-99.6	118.1	-177.4	-65.2	165.3	0	0	0	110.2	L241 I245 E246 S251 F253 R254 M257	L241-I249 HydrophobicContact CD1-CD1 3.46Å; L241-I249 VanDerWaalsContact CD1-CD1 3.46Å; I245-I249 HydrophobicContact CG2-CD1 3.82Å; I245-I249 WeakPolarHBondContact O-CG1 3.46Å; E246-I249 PolarHBondContact O-N 3.34Å; I249-S251 PolarHBondContact O-N 3.27Å; I249-F253 HydrophobicContact CG2-CB 4.27Å; I249-F253 HydrophobicContact CG2-CD1 4.1Å; I249-R254 HydrophobicContact CG2-CB 4.03Å; I249-M257 HydrophobicContact CD1-CE 3.65Å; I249-M257 HydrophobicContact CG1-CE 4.32Å; I249-M257 HydrophobicContact CG2-CE 4.34Å
250	P	68.1	Low	61.5	Low	90 Å²	90	86.7 Å²	86.7	58%	0.584	46%	0.461	S	S	*	.			trans	-57.6	137.4	171.8	-22.2	32.3	0	0	0	111.4	G252 F253 R254	P250-G252 PolarHBondContact O-N 3.03Å; P250-G252 VanDerWaalsContact O-N 3.09Å; P250-F253 WeakPolarHBondContact O-CB 3.47Å; P250-F253 PolarHBondContact O-N 2.84Å; P250-R254 PolarHBondContact O-N 2.99Å; P250-R254 VanDerWaalsContact O-N 3.15Å
251	S	60	Low	61.9	Low	105 Å²	105	87.7 Å²	87.7	73%	0.734	45%	0.45	S	S	*	.	H	α-helix	trans	-54.8	-32	-176.6	53.6	0	0	0	0	114.1	I249	I249-S251 PolarHBondContact O-N 3.27Å
252	G	60.9	Low	62.6	Low	54 Å²	54	87.1 Å²	87.1	56%	0.557	45%	0.449	S	S	*	.	H	α-helix	trans	-69.4	-32.1	174.3	0	0	0	0	0	114.3	P250	P250-G252 PolarHBondContact O-N 3.03Å; P250-G252 VanDerWaalsContact O-N 3.09Å
253	F	61.7	Low	63.7	Low	121 Å²	121	84.3 Å²	84.3	53%	0.531	43%	0.431	S	S	.	.	H	α-helix	trans	-78	-32.5	177	-166.6	-112	0	0	0	111.5	I249 P250 R255 S256 M257	I249-F253 HydrophobicContact CG2-CB 4.27Å; I249-F253 HydrophobicContact CG2-CD1 4.1Å; P250-F253 WeakPolarHBondContact O-CB 3.47Å; P250-F253 PolarHBondContact O-N 2.84Å; F253-R255 PolarHBondContact O-N 3.32Å; F253-S256 PolarHBondContact O-N 3.36Å; F253-S256 VanDerWaalsContact O-N 3.15Å; F253-M257 HydrophobicContact CD1-CE 3.94Å; F253-M257 HydrophobicContact CD1-CG 3.79Å; F253-M257 HydrophobicContact CD1-SD 4Å; F253-M257 HydrophobicContact CE1-CE 3.82Å; F253-M257 HydrophobicContact CE1-CG 3.49Å; F253-M257 VanDerWaalsContact CE1-CG 3.49Å; F253-M257 HydrophobicContact CE1-SD 3.36Å; F253-M257 WeakPolarHBondContact CE1-SD 3.32Å; F253-M257 HydrophobicContact CG-CG 4.46Å; F253-M257 HydrophobicContact CZ-CG 3.91Å; F253-M257 HydrophobicContact CZ-SD 4.04Å; F253-M257 PolarHBondContact O-N 3.07Å
254	R	59.9	Low	65	Low	74 Å²	74	81 Å²	81	28%	0.279	43%	0.426	S	S	.	.	H	α-helix	trans	-57.8	-48.8	176.5	-168.7	168.3	-177	145.9	4.2	112.6	E246 I249 P250 S256 M257 D258	E246-R254 IonicContact OE1-CZ 3.98Å; E246-R254 IonicContact OE1-NH1 2.96Å; E246-R254 PolarHBondContact OE1-NH1 3.32Å; E246-R254 IonicContact OE1-NH2 2.78Å; E246-R254 PolarHBondContact OE1-NH2 3.39Å; E246-R254 IonicContact OE2-CZ 2.66Å; E246-R254 IonicContact OE2-NH1 3.11Å; E246-R254 PolarHBondContact OE2-NH1 2.76Å; E246-R254 IonicContact OE2-NH2 2.67Å; E246-R254 PolarHBondContact OE2-NH2 3.48Å; I249-R254 HydrophobicContact CG2-CB 4.03Å; P250-R254 PolarHBondContact O-N 2.99Å; P250-R254 VanDerWaalsContact O-N 3.15Å; R254-S256 VanDerWaalsContact C-N 3.25Å; R254-S256 PolarHBondContact O-N 2.91Å; R254-M257 PolarHBondContact O-N 3.32Å; R254-D258 WeakPolarHBondContact CG-OD2 3.11Å; R254-D258 WeakPolarHBondContact O-CB 3.46Å; R254-D258 VanDerWaalsContact O-CG 3.31Å; R254-D258 PolarHBondContact O-N 3.33Å
255	R	59.8	Low	66.3	Low	192 Å²	192	79.9 Å²	79.9	73%	0.725	42%	0.417	S	S	*	.	H	α-helix	trans	-59.7	-33.5	176	-72.1	-173.7	-177.2	167.4	1.5	113.3	F253 Q259	F253-R255 PolarHBondContact O-N 3.32Å; R255-Q259 WeakPolarHBondContact O-CB 3.42Å; R255-Q259 WeakPolarHBondContact O-CG 3.37Å; R255-Q259 PolarHBondContact O-OE1 3.2Å
256	S	59.4	Low	67.6	Low	63 Å²	63	77.6 Å²	77.6	44%	0.441	41%	0.408	S	S	.	.	H	α-helix	trans	-77.6	-37.3	177	-71.9	0	0	0	0	112.6	F253 R254 L260	F253-S256 PolarHBondContact O-N 3.36Å; F253-S256 VanDerWaalsContact O-N 3.15Å; R254-S256 VanDerWaalsContact C-N 3.25Å; R254-S256 PolarHBondContact O-N 2.91Å; S256-L260 PolarHBondContact O-N 2.63Å
257	M	59.2	Low	69.1	Low	47 Å²	47	79 Å²	79	23%	0.232	41%	0.41	C	S	.	.	H	α-helix	trans	-70.7	-45.2	178.4	-76.9	-143.3	-63.7	0	0	112.9	L241 I249 F253 R254 Q259 L260 F261	L241-M257 HydrophobicContact CD1-CE 4.42Å; I249-M257 HydrophobicContact CD1-CE 3.65Å; I249-M257 HydrophobicContact CG1-CE 4.32Å; I249-M257 HydrophobicContact CG2-CE 4.34Å; F253-M257 HydrophobicContact CD1-CE 3.94Å; F253-M257 HydrophobicContact CD1-CG 3.79Å; F253-M257 HydrophobicContact CD1-SD 4Å; F253-M257 HydrophobicContact CE1-CE 3.82Å; F253-M257 HydrophobicContact CE1-CG 3.49Å; F253-M257 VanDerWaalsContact CE1-CG 3.49Å; F253-M257 HydrophobicContact CE1-SD 3.36Å; F253-M257 WeakPolarHBondContact CE1-SD 3.32Å; F253-M257 HydrophobicContact CG-CG 4.46Å; F253-M257 HydrophobicContact CZ-CG 3.91Å; F253-M257 HydrophobicContact CZ-SD 4.04Å; F253-M257 PolarHBondContact O-N 3.07Å; R254-M257 PolarHBondContact O-N 3.32Å; M257-Q259 PolarHBondContact O-N 3.29Å; M257-Q259 VanDerWaalsContact O-N 3.07Å; M257-L260 PolarHBondContact O-N 3.35Å; M257-L260 VanDerWaalsContact O-N 3.14Å; M257-F261 WeakPolarHBondContact O-CD2 3.18Å
258	D	59.7	Low	70.5	Confident	27 Å²	27	72.9 Å²	72.9	14%	0.144	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-24.2	178.9	-73.9	-23.4	0	0	0	112.4	G238 I239 R254	G238-D258 WeakPolarHBondContact CA-OD1 3.25Å; G238-D258 PolarHBondContact N-O 2.97Å; I239-D258 PolarHBondContact N-OD1 2.71Å; R254-D258 WeakPolarHBondContact CG-OD2 3.11Å; R254-D258 WeakPolarHBondContact O-CB 3.46Å; R254-D258 VanDerWaalsContact O-CG 3.31Å; R254-D258 PolarHBondContact O-N 3.33Å
259	Q	60.1	Low	71.9	Confident	29 Å²	29	65.3 Å²	65.3	14%	0.136	35%	0.345	C	S	.	.	H	α-helix	trans	-99.2	-12.9	-176.3	-65.9	176.2	-2.3	0	0	113.7	R255 M257 F261 T262	R255-Q259 WeakPolarHBondContact O-CB 3.42Å; R255-Q259 WeakPolarHBondContact O-CG 3.37Å; R255-Q259 PolarHBondContact O-OE1 3.2Å; M257-Q259 PolarHBondContact O-N 3.29Å; M257-Q259 VanDerWaalsContact O-N 3.07Å; Q259-F261 VanDerWaalsContact C-N 3.32Å; Q259-T262 PolarHBondContact O-OG1 3.02Å
260	L	65	Low	73.4	Confident	137 Å²	137	66.5 Å²	66.5	72%	0.717	35%	0.349	S	S	*	.	H	α-helix	trans	-71.6	-29.8	176.3	-169.1	67.2	0	0	0	111.7	S256 M257 T262	S256-L260 PolarHBondContact O-N 2.63Å; M257-L260 PolarHBondContact O-N 3.35Å; M257-L260 VanDerWaalsContact O-N 3.14Å; L260-T262 VanDerWaalsContact C-N 3.29Å; L260-T262 PolarHBondContact O-N 3Å
261	F	67.2	Low	74.6	Confident	139 Å²	139	62.3 Å²	62.3	61%	0.61	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	45.3	178.3	-61.5	-83	0	0	0	111.9	I239 M257 Q259	I239-F261 HydrophobicContact CD1-CD2 3.53Å; I239-F261 HydrophobicContact CD1-CE2 3.48Å; I239-F261 VanDerWaalsContact CD1-CE2 3.48Å; I239-F261 HydrophobicContact CG1-CD2 3.99Å; I239-F261 HydrophobicContact CG1-CE2 4.39Å; M257-F261 WeakPolarHBondContact O-CD2 3.18Å; Q259-F261 VanDerWaalsContact C-N 3.32Å
262	T	74.1	Confident	76.3	Confident	30 Å²	30	57.3 Å²	57.3	18%	0.184	29%	0.286	C	S	.	.			trans	-108.5	146.7	174.4	57.3	0	0	0	0	110.3	Q259 L260 K268 Y373	Q259-T262 PolarHBondContact O-OG1 3.02Å; L260-T262 VanDerWaalsContact C-N 3.29Å; L260-T262 PolarHBondContact O-N 3Å; T262-K268 WeakPolarHBondContact OG1-CE 3.21Å; T262-K268 PolarHBondContact OG1-NZ 2.66Å; T262-Y373 HydrophobicContact CG2-CD2 4.46Å; T262-Y373 HydrophobicContact CG2-CE2 4.16Å
263	P	83.3	Confident	77.9	Confident	18 Å²	18	55.2 Å²	55.2	12%	0.117	26%	0.262	C	S	.	.			trans	-68.2	173.6	-176.5	30	-35.8	0	0	0	111.6	R267 K268 I271 Y306	P263-R267 HydrophobicContact CB-CB 3.87Å; P263-R267 HydrophobicContact CG-CB 4.23Å; P263-K268 HydrophobicContact CG-CG 4Å; P263-K268 WeakPolarHBondContact O-CE 3.25Å; P263-I271 HydrophobicContact CG-CD1 4.2Å; P263-Y306 HydrophobicContact CB-CD1 4.19Å; P263-Y306 HydrophobicContact CB-CE1 3.67Å; P263-Y306 HydrophobicContact CG-CD1 4.34Å; P263-Y306 HydrophobicContact CG-CE1 4.22Å
264	S	88.9	Confident	79.5	Confident	54 Å²	54	49.9 Å²	49.9	38%	0.378	24%	0.241	S	C	.	.			trans	-56.5	151.7	175.6	66.9	0	0	0	0	111.2	P266 R267 K268	S264-P266 VanDerWaalsContact C-CD 3.47Å; S264-P266 VanDerWaalsContact C-N 3.35Å; S264-R267 WeakPolarHBondContact O-CB 3.41Å; S264-R267 PolarHBondContact O-N 2.87Å; S264-R267 VanDerWaalsContact OG-CD 3.28Å; S264-R267 WeakPolarHBondContact OG-CD 3.35Å; S264-K268 PolarHBondContact O-N 2.81Å
265	W	90.9	Very high	81.2	Confident	20 Å²	20	46.4 Å²	46.4	8%	0.076	23%	0.228	C	C	.	.	H	α-helix	trans	-54.2	-40.8	-174.3	-170.4	91.1	0	0	0	114.4	R267 K268 A269 L374 G377 A378 P379 I382 L386 L418 K421	W265-R267 VanDerWaalsContact C-N 3.29Å; W265-R267 PolarHBondContact O-N 3.5Å; W265-K268 WeakPolarHBondContact O-CB 3.5Å; W265-K268 PolarHBondContact O-N 3.37Å; W265-K268 VanDerWaalsContact O-N 3.17Å; W265-A269 HydrophobicContact CE3-CB 4.35Å; W265-A269 HydrophobicContact CH2-CB 3.92Å; W265-A269 HydrophobicContact CZ2-CB 4.42Å; W265-A269 HydrophobicContact CZ3-CB 3.89Å; W265-A269 PolarHBondContact O-N 3.5Å; W265-L374 PolarHBondContact NE1-O 3.46Å; W265-G377 WeakPolarHBondContact CB-O 3.39Å; W265-G377 VanDerWaalsContact CD1-O 3.25Å; W265-A378 VanDerWaalsContact NE1-CA 3.35Å; W265-P379 HydrophobicContact CD2-CG 4.24Å; W265-P379 HydrophobicContact CE3-CG 4.04Å; W265-P379 HydrophobicContact CZ3-CG 4.34Å; W265-I382 HydrophobicContact CH2-CD1 3.17Å; W265-I382 HydrophobicContact CZ2-CD1 3.41Å; W265-I382 VanDerWaalsContact CZ2-CD1 3.41Å; W265-I382 HydrophobicContact CZ3-CD1 3.99Å; W265-L386 HydrophobicContact CZ2-CD2 4.12Å; W265-L418 HydrophobicContact CH2-CD2 4.04Å; W265-L418 HydrophobicContact CZ2-CD2 4.12Å; W265-K421 HydrophobicContact CE3-CG 4.38Å; W265-K421 HydrophobicContact CH2-CB 4.12Å; W265-K421 HydrophobicContact CH2-CG 4Å; W265-K421 HydrophobicContact CZ3-CB 3.9Å; W265-K421 HydrophobicContact CZ3-CG 3.47Å; W265-K421 VanDerWaalsContact CZ3-CG 3.47Å
266	P	91.8	Very high	82.9	Confident	35 Å²	35	37.4 Å²	37.4	23%	0.227	20%	0.195	C	C	.	.	H	α-helix	trans	-58.7	-39	175.1	-25.3	35.3	0	0	0	113.5	S264 A269 K270 I422 T425	S264-P266 VanDerWaalsContact C-CD 3.47Å; S264-P266 VanDerWaalsContact C-N 3.35Å; P266-A269 WeakPolarHBondContact O-CB 3.28Å; P266-A269 PolarHBondContact O-N 2.86Å; P266-K270 PolarHBondContact O-N 2.88Å; P266-I422 HydrophobicContact CB-CG2 4.16Å; P266-T425 HydrophobicContact CG-CG2 4.49Å
267	R	91.3	Very high	84.5	Confident	95 Å²	95	38.3 Å²	38.3	36%	0.358	19%	0.192	S	C	.	.	H	α-helix	trans	-69.1	-38.7	176.9	-65.3	167.5	178.3	-176.1	9.3	111.5	P263 S264 W265 A269 K270 I271 Y306	P263-R267 HydrophobicContact CB-CB 3.87Å; P263-R267 HydrophobicContact CG-CB 4.23Å; S264-R267 WeakPolarHBondContact O-CB 3.41Å; S264-R267 PolarHBondContact O-N 2.87Å; S264-R267 VanDerWaalsContact OG-CD 3.28Å; S264-R267 WeakPolarHBondContact OG-CD 3.35Å; W265-R267 VanDerWaalsContact C-N 3.29Å; W265-R267 PolarHBondContact O-N 3.5Å; R267-A269 VanDerWaalsContact C-N 3.31Å; R267-A269 PolarHBondContact O-N 3.28Å; R267-K270 PolarHBondContact O-N 2.83Å; R267-I271 WeakPolarHBondContact O-CG1 3.34Å; R267-I271 PolarHBondContact O-N 2.96Å; R267-Y306 HydrophobicContact CB-CD1 3.91Å; R267-Y306 HydrophobicContact CB-CD2 4.13Å; R267-Y306 HydrophobicContact CB-CE1 4.3Å; R267-Y306 HydrophobicContact CB-CG 3.81Å; R267-Y306 VanDerWaalsContact CD-CZ 3.44Å; R267-Y306 HydrophobicContact CG-CD1 4.31Å; R267-Y306 HydrophobicContact CG-CD2 3.67Å; R267-Y306 HydrophobicContact CG-CE1 4.49Å; R267-Y306 HydrophobicContact CG-CE2 3.88Å; R267-Y306 HydrophobicContact CG-CG 3.91Å; R267-Y306 PolarHBondContact NH1-OH 3.43Å
268	K	91.8	Very high	86.2	Confident	11 Å²	11	36.1 Å²	36.1	5%	0.048	18%	0.181	C	C	.	.	H	α-helix	trans	-59.2	-43.4	171.4	-60.9	-171.5	-169.6	-169.4	0	111.8	T262 P263 S264 W265 I271 A272 Y373 L374 R376	T262-K268 WeakPolarHBondContact OG1-CE 3.21Å; T262-K268 PolarHBondContact OG1-NZ 2.66Å; P263-K268 HydrophobicContact CG-CG 4Å; P263-K268 WeakPolarHBondContact O-CE 3.25Å; S264-K268 PolarHBondContact O-N 2.81Å; W265-K268 WeakPolarHBondContact O-CB 3.5Å; W265-K268 PolarHBondContact O-N 3.37Å; W265-K268 VanDerWaalsContact O-N 3.17Å; K268-I271 PolarHBondContact O-N 3.47Å; K268-A272 WeakPolarHBondContact O-CB 3.38Å; K268-A272 PolarHBondContact O-N 3.35Å; K268-Y373 HydrophobicContact CB-CD1 4.21Å; K268-Y373 HydrophobicContact CB-CE1 3.5Å; K268-Y373 VanDerWaalsContact CB-CE1 3.5Å; K268-Y373 HydrophobicContact CD-CE1 4.25Å; K268-Y373 HydrophobicContact CD-CE2 4.27Å; K268-Y373 WeakPolarHBondContact CD-O 3.31Å; K268-Y373 HydrophobicContact CG-CE1 3.91Å; K268-Y373 HydrophobicContact CG-CE2 4.26Å; K268-L374 HydrophobicContact CB-CD2 4.37Å; K268-R376 PolarHBondContact NZ-O 2.86Å
269	A	93.9	Very high	87.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-42.4	177.9	0	0	0	0	0	111.4	W265 P266 R267 A272 I273 L418 I422	W265-A269 HydrophobicContact CE3-CB 4.35Å; W265-A269 HydrophobicContact CH2-CB 3.92Å; W265-A269 HydrophobicContact CZ2-CB 4.42Å; W265-A269 HydrophobicContact CZ3-CB 3.89Å; W265-A269 PolarHBondContact O-N 3.5Å; P266-A269 WeakPolarHBondContact O-CB 3.28Å; P266-A269 PolarHBondContact O-N 2.86Å; R267-A269 VanDerWaalsContact C-N 3.31Å; R267-A269 PolarHBondContact O-N 3.28Å; A269-A272 PolarHBondContact O-N 2.98Å; A269-I273 VanDerWaalsContact O-CG1 3.31Å; A269-I273 WeakPolarHBondContact O-CG1 3.48Å; A269-I273 PolarHBondContact O-N 3.26Å; A269-L418 HydrophobicContact CB-CB 4.44Å; A269-L418 HydrophobicContact CB-CD2 4.08Å; A269-I422 HydrophobicContact CB-CG2 3.65Å
270	K	93.5	Very high	89.2	Confident	56 Å²	56	36.3 Å²	36.3	24%	0.243	18%	0.181	C	C	.	.	H	α-helix	trans	-57.9	-49.4	173.9	-171.3	-179.9	177.9	-169.9	0	112.3	P266 R267 A272 I273 G274 K305 D307 I422	P266-K270 PolarHBondContact O-N 2.88Å; R267-K270 PolarHBondContact O-N 2.83Å; K270-A272 VanDerWaalsContact C-N 3.31Å; K270-A272 PolarHBondContact O-N 3.43Å; K270-I273 PolarHBondContact O-N 2.88Å; K270-G274 PolarHBondContact O-N 3.44Å; K270-G274 VanDerWaalsContact O-N 3.16Å; K270-K305 PolarHBondContact NZ-O 2.98Å; K270-D307 WeakPolarHBondContact CE-OD1 3.32Å; K270-D307 IonicContact NZ-OD1 3.13Å; K270-D307 PolarHBondContact NZ-OD1 2.93Å; K270-I422 HydrophobicContact CB-CD1 4.46Å
271	I	94.1	Very high	90.5	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-60.7	-42	176.8	-63.6	163.4	0	0	0	111.3	L236 P263 R267 K268 I273 G274 L275 Y302 Y306 L308 Y373	L236-I271 HydrophobicContact CD2-CG2 3.39Å; P263-I271 HydrophobicContact CG-CD1 4.2Å; R267-I271 WeakPolarHBondContact O-CG1 3.34Å; R267-I271 PolarHBondContact O-N 2.96Å; K268-I271 PolarHBondContact O-N 3.47Å; I271-I273 PolarHBondContact O-N 2.85Å; I271-G274 PolarHBondContact O-N 3.14Å; I271-L275 PolarHBondContact O-N 2.83Å; I271-L275 VanDerWaalsContact O-N 3.12Å; I271-Y302 HydrophobicContact CD1-CD1 3.84Å; I271-Y302 HydrophobicContact CD1-CD2 4.13Å; I271-Y302 HydrophobicContact CD1-CE1 4.28Å; I271-Y302 HydrophobicContact CD1-CG 3.77Å; I271-Y302 HydrophobicContact CG1-CG 4.34Å; I271-Y306 HydrophobicContact CD1-CD1 4.04Å; I271-Y306 VanDerWaalsContact CG1-O 3.26Å; I271-Y306 WeakPolarHBondContact CG1-O 3.38Å; I271-L308 HydrophobicContact CG2-CB 4.36Å; I271-L308 HydrophobicContact CG2-CD1 3.61Å; I271-Y373 WeakPolarHBondContact CD1-OH 3.08Å
272	A	95.4	Very high	91.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.3	-38.8	179	0	0	0	0	0	112.5	K268 A269 K270 G274 L275 L276 L370 L374 L418	K268-A272 WeakPolarHBondContact O-CB 3.38Å; K268-A272 PolarHBondContact O-N 3.35Å; A269-A272 PolarHBondContact O-N 2.98Å; K270-A272 VanDerWaalsContact C-N 3.31Å; K270-A272 PolarHBondContact O-N 3.43Å; A272-G274 VanDerWaalsContact C-N 3.34Å; A272-L275 PolarHBondContact O-N 3.03Å; A272-L276 WeakPolarHBondContact O-CG 3.46Å; A272-L276 PolarHBondContact O-N 3.31Å; A272-L370 HydrophobicContact CB-CD1 4Å; A272-L370 HydrophobicContact CB-CD2 3.64Å; A272-L370 HydrophobicContact CB-CG 4.44Å; A272-L374 HydrophobicContact CB-CD1 3.97Å; A272-L374 HydrophobicContact CB-CD2 3.81Å; A272-L374 HydrophobicContact CB-CG 4.22Å; A272-L418 HydrophobicContact CB-CD1 4.12Å
273	I	94.9	Very high	92	Very high	10 Å²	10	25.3 Å²	25.3	5%	0.051	13%	0.127	C	C	.	.	H	α-helix	trans	-59.7	-46.7	173.2	-68.9	167.5	0	0	0	110	A269 K270 I271 L275 L276 E277 L418 W419 I422	A269-I273 VanDerWaalsContact O-CG1 3.31Å; A269-I273 WeakPolarHBondContact O-CG1 3.48Å; A269-I273 PolarHBondContact O-N 3.26Å; K270-I273 PolarHBondContact O-N 2.88Å; I271-I273 PolarHBondContact O-N 2.85Å; I273-L275 PolarHBondContact O-N 3.14Å; I273-L276 WeakPolarHBondContact O-CB 3.4Å; I273-L276 PolarHBondContact O-N 3.27Å; I273-E277 HydrophobicContact CG2-CG 4.33Å; I273-E277 WeakPolarHBondContact CG2-OE1 3.34Å; I273-E277 WeakPolarHBondContact O-CG 3.26Å; I273-E277 PolarHBondContact O-N 3.07Å; I273-L418 HydrophobicContact CD1-CB 3.76Å; I273-L418 HydrophobicContact CG1-CB 3.77Å; I273-L418 HydrophobicContact CG1-CD1 3.97Å; I273-W419 HydrophobicContact CD1-CB 4.33Å; I273-W419 HydrophobicContact CD1-CE3 4.06Å; I273-I422 HydrophobicContact CD1-CD1 3.6Å
274	G	94.9	Very high	91.5	Very high	9 Å²	9	28.4 Å²	28.4	9%	0.093	14%	0.139	C	C	.	.	H	α-helix	trans	-58.1	-32.5	176.1	0	0	0	0	0	113.6	K270 I271 A272 F278	K270-G274 PolarHBondContact O-N 3.44Å; K270-G274 VanDerWaalsContact O-N 3.16Å; I271-G274 PolarHBondContact O-N 3.14Å; A272-G274 VanDerWaalsContact C-N 3.34Å; G274-F278 WeakPolarHBondContact O-CB 3.48Å; G274-F278 PolarHBondContact O-N 2.88Å
275	L	95.9	Very high	91	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-72	-39.8	175.7	-179.7	60.3	0	0	0	111.7	I271 A272 I273 E277 F278 V279 L300 L308 A366 L369 L370	I271-L275 PolarHBondContact O-N 2.83Å; I271-L275 VanDerWaalsContact O-N 3.12Å; A272-L275 PolarHBondContact O-N 3.03Å; I273-L275 PolarHBondContact O-N 3.14Å; L275-E277 VanDerWaalsContact C-N 3.35Å; L275-F278 HydrophobicContact CD1-CD1 4.45Å; L275-F278 PolarHBondContact O-N 3.19Å; L275-V279 WeakPolarHBondContact O-CG2 3.18Å; L275-V279 PolarHBondContact O-N 3.01Å; L275-L300 HydrophobicContact CD1-CD1 4.19Å; L275-L300 HydrophobicContact CD1-CD2 3.95Å; L275-L300 HydrophobicContact CD2-CD1 4.19Å; L275-L308 HydrophobicContact CB-CD2 3.75Å; L275-L308 HydrophobicContact CD1-CD2 4.1Å; L275-A366 HydrophobicContact CD2-CB 4.15Å; L275-A366 HydrophobicContact CG-CB 4.26Å; L275-L369 HydrophobicContact CD2-CD2 4.14Å; L275-L370 HydrophobicContact CD2-CD1 4.14Å; L275-L370 HydrophobicContact CD2-CD2 4.03Å; L275-L370 HydrophobicContact CD2-CG 3.97Å
276	L	95.1	Very high	90.4	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-65.4	-40.2	176.1	-65.9	176.3	0	0	0	111.1	A272 I273 V279 E280 L363 L370 L411 L414 K415 L418	A272-L276 WeakPolarHBondContact O-CG 3.46Å; A272-L276 PolarHBondContact O-N 3.31Å; I273-L276 WeakPolarHBondContact O-CB 3.4Å; I273-L276 PolarHBondContact O-N 3.27Å; L276-V279 PolarHBondContact O-N 3.06Å; L276-E280 PolarHBondContact O-N 2.91Å; L276-E280 VanDerWaalsContact O-N 3.09Å; L276-L363 HydrophobicContact CD2-CD1 3.69Å; L276-L370 HydrophobicContact CD2-CD1 4.22Å; L276-L370 HydrophobicContact CG-CD1 4.36Å; L276-L411 HydrophobicContact CB-CD1 3.73Å; L276-L411 HydrophobicContact CD2-CD1 3.95Å; L276-L411 HydrophobicContact CG-CD1 4.32Å; L276-L414 HydrophobicContact CD1-CB 3.96Å; L276-K415 HydrophobicContact CB-CD 4.35Å; L276-K415 HydrophobicContact CB-CG 4Å; L276-K415 HydrophobicContact CD1-CG 3.99Å; L276-L418 HydrophobicContact CD1-CD1 4.33Å
277	E	93.9	Very high	90	Very high	82 Å²	82	29.2 Å²	29.2	38%	0.383	15%	0.145	S	C	.	.	H	α-helix	trans	-64.5	-41.2	173.6	-70.2	171.6	171.4	0	0	112.2	I273 L275 V279 E280 D281 K415	I273-E277 HydrophobicContact CG2-CG 4.33Å; I273-E277 WeakPolarHBondContact CG2-OE1 3.34Å; I273-E277 WeakPolarHBondContact O-CG 3.26Å; I273-E277 PolarHBondContact O-N 3.07Å; L275-E277 VanDerWaalsContact C-N 3.35Å; E277-V279 VanDerWaalsContact C-N 3.35Å; E277-V279 PolarHBondContact O-N 3.34Å; E277-E280 WeakPolarHBondContact O-CB 3.33Å; E277-E280 PolarHBondContact O-N 2.87Å; E277-D281 PolarHBondContact O-N 2.86Å; E277-K415 HydrophobicContact CG-CD 4.24Å
278	F	94.4	Very high	89.6	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.2	-44.4	173.3	176.6	-110.9	0	0	0	112.2	L209 H214 G274 L275 E280 D281 V282 M292 M310 M313 I316	L209-F278 HydrophobicContact CD1-CD2 4.33Å; L209-F278 HydrophobicContact CD1-CE2 3.73Å; H214-F278 HydrophobicContact CB-CB 4.35Å; H214-F278 AromaticContact CD2-CD2 3.29Å; H214-F278 WeakPolarHBondContact CD2-CD2 3.37Å; H214-F278 AromaticContact CG-CD2 3.93Å; H214-F278 AromaticContact NE2-CD2 3.52Å; G274-F278 WeakPolarHBondContact O-CB 3.48Å; G274-F278 PolarHBondContact O-N 2.88Å; L275-F278 HydrophobicContact CD1-CD1 4.45Å; L275-F278 PolarHBondContact O-N 3.19Å; F278-E280 VanDerWaalsContact C-N 3.25Å; F278-E280 PolarHBondContact O-N 3Å; F278-D281 PolarHBondContact O-N 2.84Å; F278-V282 HydrophobicContact CD1-CG2 4.33Å; F278-V282 HydrophobicContact CD2-CG2 3.82Å; F278-V282 HydrophobicContact CE1-CG2 3.94Å; F278-V282 HydrophobicContact CE2-CG2 3.43Å; F278-V282 VanDerWaalsContact CE2-CG2 3.43Å; F278-V282 HydrophobicContact CG-CG2 4.31Å; F278-V282 HydrophobicContact CZ-CG2 3.51Å; F278-V282 WeakPolarHBondContact O-CB 3.14Å; F278-V282 VanDerWaalsContact O-CG2 3.25Å; F278-V282 WeakPolarHBondContact O-CG2 3.35Å; F278-V282 PolarHBondContact O-N 3.35Å; F278-M292 HydrophobicContact CD1-CE 4.2Å; F278-M292 HydrophobicContact CD1-SD 4.14Å; F278-M292 HydrophobicContact CE1-CE 3.88Å; F278-M292 HydrophobicContact CE1-CG 4.48Å; F278-M292 HydrophobicContact CE1-SD 3.9Å; F278-M310 HydrophobicContact CD1-CE 4.05Å; F278-M310 HydrophobicContact CD1-CG 4.18Å; F278-M310 HydrophobicContact CD1-SD 3.54Å; F278-M310 VanDerWaalsContact CD1-SD 3.54Å; F278-M310 HydrophobicContact CD2-CG 3.9Å; F278-M310 HydrophobicContact CD2-SD 4.32Å; F278-M310 HydrophobicContact CE1-CE 3.41Å; F278-M310 VanDerWaalsContact CE1-CE 3.41Å; F278-M310 HydrophobicContact CE1-CG 3.95Å; F278-M310 HydrophobicContact CE1-SD 3.49Å; F278-M310 WeakPolarHBondContact CE1-SD 3.26Å; F278-M310 HydrophobicContact CE2-CG 3.61Å; F278-M310 HydrophobicContact CE2-SD 4.24Å; F278-M310 HydrophobicContact CG-CG 4.13Å; F278-M310 HydrophobicContact CG-SD 3.94Å; F278-M310 HydrophobicContact CZ-CE 3.73Å; F278-M310 HydrophobicContact CZ-CG 3.62Å; F278-M310 HydrophobicContact CZ-SD 3.82Å; F278-M313 HydrophobicContact CE2-SD 4.3Å; F278-M313 HydrophobicContact CZ-SD 4.28Å; F278-I316 HydrophobicContact CE1-CD1 3.73Å; F278-I316 HydrophobicContact CZ-CD1 3.45Å; F278-I316 VanDerWaalsContact CZ-CD1 3.45Å
279	V	93.3	Very high	89.4	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.6	-39.1	176.9	168.2	0	0	0	0	111.2	L275 L276 E277 F283 M292 N362 L363 A366	L275-V279 WeakPolarHBondContact O-CG2 3.18Å; L275-V279 PolarHBondContact O-N 3.01Å; L276-V279 PolarHBondContact O-N 3.06Å; E277-V279 VanDerWaalsContact C-N 3.35Å; E277-V279 PolarHBondContact O-N 3.34Å; V279-F283 VanDerWaalsContact O-CB 3.28Å; V279-F283 WeakPolarHBondContact O-CB 3.48Å; V279-F283 PolarHBondContact O-N 2.85Å; V279-M292 HydrophobicContact CG2-SD 3.97Å; V279-N362 HydrophobicContact CG1-CB 3.89Å; V279-L363 HydrophobicContact CG1-CB 4.08Å; V279-A366 HydrophobicContact CG2-CB 3.85Å
280	E	90.6	Very high	89.3	Confident	61 Å²	61	27.2 Å²	27.2	29%	0.285	14%	0.144	S	C	.	.	H	α-helix	trans	-62.5	-50.1	175.3	-165.5	172.9	-178.3	0	0	111.9	L276 E277 F278 V282 F283 H284 L411 K415	L276-E280 PolarHBondContact O-N 2.91Å; L276-E280 VanDerWaalsContact O-N 3.09Å; E277-E280 WeakPolarHBondContact O-CB 3.33Å; E277-E280 PolarHBondContact O-N 2.87Å; F278-E280 VanDerWaalsContact C-N 3.25Å; F278-E280 PolarHBondContact O-N 3Å; E280-V282 VanDerWaalsContact C-N 3.28Å; E280-V282 PolarHBondContact O-N 2.84Å; E280-F283 PolarHBondContact O-N 3.1Å; E280-H284 WeakPolarHBondContact O-CB 3.2Å; E280-H284 PolarHBondContact O-N 3.19Å; E280-L411 HydrophobicContact CB-CD2 3.9Å; E280-L411 HydrophobicContact CG-CD2 3.91Å; E280-K415 IonicContact OE1-NZ 2.8Å; E280-K415 IonicContact OE2-NZ 3.09Å; E280-K415 PolarHBondContact OE2-NZ 2.78Å
281	D	90.9	Very high	89.2	Confident	40 Å²	40	25 Å²	25	21%	0.214	13%	0.134	C	C	.	.	H	α-helix	trans	-64.9	-30.9	-178.2	-81	-24.5	0	0	0	113.2	L209 K212 H214 E277 F278 G285	L209-D281 HydrophobicContact CD2-CB 4.14Å; K212-D281 WeakPolarHBondContact CD-OD2 3.31Å; K212-D281 WeakPolarHBondContact CE-OD2 3.25Å; K212-D281 IonicContact NZ-OD1 2.86Å; K212-D281 PolarHBondContact NZ-OD1 2.79Å; K212-D281 IonicContact NZ-OD2 3.51Å; K212-D281 PolarHBondContact NZ-OD2 2.89Å; H214-D281 IonicContact CE1-OD2 3.31Å; H214-D281 PolarHBondContact CE1-OD2 3.4Å; H214-D281 IonicContact NE2-OD2 2.8Å; E277-D281 PolarHBondContact O-N 2.86Å; F278-D281 PolarHBondContact O-N 2.84Å; D281-G285 VanDerWaalsContact O-CA 3.28Å; D281-G285 WeakPolarHBondContact O-CA 3.46Å; D281-G285 PolarHBondContact O-N 2.85Å
282	V	89.8	Confident	89.2	Confident	2 Å²	2	25 Å²	25	1%	0.012	14%	0.135	C	C	.	.	H	α-helix	trans	-83.4	-29	-180	170.1	0	0	0	0	112.3	L209 F278 E280 F290 I316	L209-V282 HydrophobicContact CD1-CG2 4.03Å; F278-V282 HydrophobicContact CD1-CG2 4.33Å; F278-V282 HydrophobicContact CD2-CG2 3.82Å; F278-V282 HydrophobicContact CE1-CG2 3.94Å; F278-V282 HydrophobicContact CE2-CG2 3.43Å; F278-V282 VanDerWaalsContact CE2-CG2 3.43Å; F278-V282 HydrophobicContact CG-CG2 4.31Å; F278-V282 HydrophobicContact CZ-CG2 3.51Å; F278-V282 WeakPolarHBondContact O-CB 3.14Å; F278-V282 VanDerWaalsContact O-CG2 3.25Å; F278-V282 WeakPolarHBondContact O-CG2 3.35Å; F278-V282 PolarHBondContact O-N 3.35Å; E280-V282 VanDerWaalsContact C-N 3.28Å; E280-V282 PolarHBondContact O-N 2.84Å; V282-F290 HydrophobicContact CG1-CB 3.41Å; V282-F290 VanDerWaalsContact CG1-CB 3.41Å; V282-F290 HydrophobicContact CG1-CG 4.48Å; V282-F290 PolarHBondContact O-N 2.85Å; V282-I316 HydrophobicContact CG1-CG2 4.05Å
283	F	82.6	Confident	89	Confident	33 Å²	33	25 Å²	25	15%	0.145	14%	0.135	C	C	.	.	H	α-helix	trans	-92.2	-36.9	179.7	-170.7	-100.4	0	0	0	112.9	V279 E280 N289 H407	V279-F283 VanDerWaalsContact O-CB 3.28Å; V279-F283 WeakPolarHBondContact O-CB 3.48Å; V279-F283 PolarHBondContact O-N 2.85Å; E280-F283 PolarHBondContact O-N 3.1Å; F283-N289 PolarHBondContact O-OD1 2.76Å; F283-H407 AromaticContact CD1-CE1 3.98Å
284	H	74.4	Confident	88.8	Confident	83 Å²	83	25.9 Å²	25.9	38%	0.384	14%	0.139	S	C	.	.	S	Bend	trans	-105.7	24.6	179	-64.5	-61.7	0	0	0	112.9	E280 H407	E280-H284 WeakPolarHBondContact O-CB 3.2Å; E280-H284 PolarHBondContact O-N 3.19Å; H284-H407 AromaticContact NE2-ND1 3.8Å
285	G	76.9	Confident	88.5	Confident	16 Å²	16	26.5 Å²	26.5	17%	0.165	14%	0.141	C	C	.	.			trans	-66.7	154.4	-177.8	0	0	0	0	0	113.3	D281 Y287 G288	D281-G285 VanDerWaalsContact O-CA 3.28Å; D281-G285 WeakPolarHBondContact O-CA 3.46Å; D281-G285 PolarHBondContact O-N 2.85Å; G285-Y287 PolarHBondContact O-N 2.9Å; G285-Y287 VanDerWaalsContact O-N 3.07Å; G285-G288 PolarHBondContact O-N 2.74Å
286	P	79.4	Confident	88.2	Confident	83 Å²	83	27.6 Å²	27.6	54%	0.539	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.3	-178.2	26.5	-34.7	0	0	0	114.1
287	Y	82.4	Confident	87.8	Confident	26 Å²	26	28 Å²	28	10%	0.102	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	15.2	-174.5	-49.5	-58.9	0	0	0	113.6	N166 L170 I208 G285	N166-Y287 HydrophobicContact CB-CE1 4.27Å; L170-Y287 HydrophobicContact CB-CD1 3.95Å; L170-Y287 HydrophobicContact CB-CE1 3.72Å; L170-Y287 HydrophobicContact CD1-CD2 4.33Å; L170-Y287 HydrophobicContact CD1-CE2 4.11Å; L170-Y287 HydrophobicContact CD2-CD1 4.23Å; L170-Y287 HydrophobicContact CD2-CD2 4.44Å; L170-Y287 HydrophobicContact CD2-CG 4.08Å; I208-Y287 HydrophobicContact CB-CD2 4.28Å; I208-Y287 HydrophobicContact CB-CE2 4.44Å; I208-Y287 HydrophobicContact CD1-CD2 3.91Å; I208-Y287 HydrophobicContact CG1-CD2 3.76Å; I208-Y287 HydrophobicContact CG1-CE2 4.05Å; I208-Y287 HydrophobicContact CG2-CD2 3.62Å; I208-Y287 HydrophobicContact CG2-CE2 3.92Å; G285-Y287 PolarHBondContact O-N 2.9Å; G285-Y287 VanDerWaalsContact O-N 3.07Å
288	G	83.1	Confident	87.5	Confident	6 Å²	6	30.2 Å²	30.2	6%	0.062	16%	0.161	C	C	.	.			trans	104.3	178.4	177.5	0	0	0	0	0	114.5	G285 F290	G285-G288 PolarHBondContact O-N 2.74Å; G288-F290 VanDerWaalsContact O-CD2 3.32Å; G288-F290 WeakPolarHBondContact O-CD2 3.39Å
289	N	87.9	Confident	87.3	Confident	54 Å²	54	30.8 Å²	30.8	29%	0.289	16%	0.164	S	C	.	.			trans	-82.8	130.8	-174	-57.3	-10.2	0	0	0	111.5	F283 E319	F283-N289 PolarHBondContact O-OD1 2.76Å; N289-E319 HydrophobicContact CB-CB 4.16Å; N289-E319 WeakPolarHBondContact CB-OE2 3.27Å; N289-E319 PolarHBondContact ND2-OE2 2.93Å; N289-E319 PolarHBondContact O-N 2.72Å
290	F	91.8	Very high	87.2	Confident	5 Å²	5	31 Å²	31	2%	0.022	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	145.4	171.1	-67.5	-97.9	0	0	0	110.3	L161 L205 I208 V282 G288 I316 V317 P318 N362	L161-F290 HydrophobicContact CD2-CE1 3.91Å; L161-F290 HydrophobicContact CD2-CE2 4.4Å; L161-F290 HydrophobicContact CD2-CZ 3.57Å; L205-F290 HydrophobicContact CD2-CD1 3.85Å; L205-F290 HydrophobicContact CD2-CD2 4.41Å; L205-F290 HydrophobicContact CD2-CE1 3.88Å; L205-F290 HydrophobicContact CD2-CE2 4.45Å; L205-F290 HydrophobicContact CD2-CG 4.13Å; L205-F290 HydrophobicContact CD2-CZ 4.19Å; L205-F290 HydrophobicContact CG-CE1 4.46Å; I208-F290 HydrophobicContact CD1-CE2 4.45Å; I208-F290 HydrophobicContact CD1-CZ 3.93Å; V282-F290 HydrophobicContact CG1-CB 3.41Å; V282-F290 VanDerWaalsContact CG1-CB 3.41Å; V282-F290 HydrophobicContact CG1-CG 4.48Å; V282-F290 PolarHBondContact O-N 2.85Å; G288-F290 VanDerWaalsContact O-CD2 3.32Å; G288-F290 WeakPolarHBondContact O-CD2 3.39Å; F290-I316 HydrophobicContact CB-CG2 3.93Å; F290-V317 CarbonylContact C-O 3.58Å; F290-V317 WeakPolarHBondContact CA-O 3.36Å; F290-P318 HydrophobicContact CD1-CB 4.44Å; F290-P318 HydrophobicContact CD1-CG 4.05Å; F290-P318 HydrophobicContact CE1-CB 4.43Å; F290-P318 HydrophobicContact CE1-CG 3.78Å; F290-N362 PolarHBondContact O-ND2 3.49Å
291	L	92.1	Very high	87.3	Confident	8 Å²	8	28 Å²	28	4%	0.042	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.1	-178.6	-63.8	174.6	0	0	0	110.2	C293 I316 V317 E319 L322 V358 N362	L291-C293 PolarHBondContact O-N 3.3Å; L291-I316 CarbonylContact O-C 3.49Å; L291-I316 VanDerWaalsContact O-CA 3.31Å; L291-I316 WeakPolarHBondContact O-CA 3.24Å; L291-V317 HydrophobicContact CB-CG2 4.35Å; L291-V317 PolarHBondContact N-O 3.05Å; L291-V317 PolarHBondContact O-N 3.24Å; L291-E319 HydrophobicContact CD1-CB 4.16Å; L291-E319 HydrophobicContact CD1-CG 4.04Å; L291-E319 HydrophobicContact CG-CB 4.27Å; L291-L322 HydrophobicContact CD1-CB 4.49Å; L291-L322 HydrophobicContact CD1-CD2 3.39Å; L291-V358 HydrophobicContact CD1-CB 4.48Å; L291-V358 HydrophobicContact CD1-CG2 3.75Å; L291-N362 WeakPolarHBondContact CA-OD1 3.25Å
292	M	93.4	Very high	87.4	Confident	4 Å²	4	27 Å²	27	2%	0.02	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	100.4	175.8	-62.7	175.8	66.7	0	0	109.8	F278 V279 T295 M310 I316 N362 K365	F278-M292 HydrophobicContact CD1-CE 4.2Å; F278-M292 HydrophobicContact CD1-SD 4.14Å; F278-M292 HydrophobicContact CE1-CE 3.88Å; F278-M292 HydrophobicContact CE1-CG 4.48Å; F278-M292 HydrophobicContact CE1-SD 3.9Å; V279-M292 HydrophobicContact CG2-SD 3.97Å; M292-T295 HydrophobicContact CE-CG2 4.34Å; M292-M310 HydrophobicContact CE-CE 4.33Å; M292-I316 HydrophobicContact CG-CD1 4.25Å; M292-I316 HydrophobicContact CG-CG1 4.23Å; M292-N362 PolarHBondContact N-OD1 3.37Å; M292-N362 HydrophobicContact SD-CB 4.37Å; M292-K365 WeakPolarHBondContact O-CE 3.48Å; M292-K365 PolarHBondContact O-NZ 3.03Å
293	C	91.4	Very high	87.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-99.4	16.2	-177.6	-57.3	0	0	0	0	114.3	L291 K315 V317 Y339 G340 T341 D342 C343	L291-C293 PolarHBondContact O-N 3.3Å; C293-K315 WeakPolarHBondContact CA-O 3.28Å; C293-K315 VanDerWaalsContact CB-O 3.3Å; C293-K315 WeakPolarHBondContact CB-O 3.29Å; C293-K315 PolarHBondContact N-O 3.15Å; C293-V317 VanDerWaalsContact SG-CG2 3.57Å; C293-Y339 HydrophobicContact CB-CD1 3.76Å; C293-Y339 HydrophobicContact CB-CE1 4.14Å; C293-G340 WeakPolarHBondContact O-CA 3.33Å; C293-T341 PolarHBondContact O-N 3.37Å; C293-D342 WeakPolarHBondContact CA-OD1 3.02Å; C293-C343 WeakPolarHBondContact CA-SG 3.39Å; C293-C343 HydrophobicContact CB-CB 3.67Å; C293-C343 WeakPolarHBondContact CB-SG 3.2Å; C293-C343 WeakPolarHBondContact SG-CB 3.41Å; C293-C343 CovalentContact SG-SG 2.04Å; C293-C343 PolarHBondContact SG-SG 2.9Å
294	D	90.6	Very high	87.8	Confident	28 Å²	28	31.6 Å²	31.6	15%	0.15	17%	0.171	C	C	.	.			trans	-151.8	78.7	163.1	-171.3	17.5	0	0	0	111.3	S296 K298 N299 K315 T341 D342	D294-S296 PolarHBondContact O-N 2.96Å; D294-K298 IonicContact OD2-NZ 3.27Å; D294-N299 PolarHBondContact O-ND2 2.91Å; D294-N299 PolarHBondContact OD2-ND2 3.03Å; D294-K315 HydrophobicContact CB-CB 3.67Å; D294-K315 HydrophobicContact CB-CG 4.1Å; D294-T341 WeakPolarHBondContact CA-OG1 3.08Å; D294-T341 WeakPolarHBondContact OD1-CG2 3.42Å; D294-T341 PolarHBondContact OD1-OG1 3.29Å; D294-D342 PolarHBondContact N-OD1 3.39Å
295	T	89.4	Confident	88.5	Confident	22 Å²	22	34.8 Å²	34.8	14%	0.135	18%	0.183	C	C	.	.			trans	-85.8	85.9	179	-44.1	0	0	0	0	110.2	M292 D342 K365 L369	M292-T295 HydrophobicContact CE-CG2 4.34Å; T295-D342 WeakPolarHBondContact CA-OD2 3.08Å; T295-D342 WeakPolarHBondContact CB-OD2 3.3Å; T295-D342 PolarHBondContact N-OD2 3.47Å; T295-D342 PolarHBondContact OG1-OD2 2.85Å; T295-K365 HydrophobicContact CG2-CB 4.25Å; T295-L369 HydrophobicContact CG2-CB 4.38Å; T295-L369 HydrophobicContact CG2-CD2 4.17Å
296	S	88.1	Confident	89.2	Confident	24 Å²	24	36 Å²	36	17%	0.168	18%	0.183	C	C	.	.			trans	-131.4	150.2	-179.7	66.9	0	0	0	0	112.4	D294 K298 N299	D294-S296 PolarHBondContact O-N 2.96Å; S296-K298 PolarHBondContact O-N 3.4Å; S296-K298 WeakPolarHBondContact OG-CE 3.47Å; S296-K298 WeakPolarHBondContact OG-CG 3.09Å; S296-N299 PolarHBondContact O-N 2.93Å; S296-N299 PolarHBondContact OG-ND2 2.93Å; S296-N299 VanDerWaalsContact OG-ND2 3.1Å
297	A	88.4	Confident	89.8	Confident	11 Å²	11	33.6 Å²	33.6	9%	0.091	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.2	-179	0	0	0	0	0	114.1	S235 L236 Y237 L300 L369	S235-A297 CarbonylContact C-O 3.6Å; S235-A297 VanDerWaalsContact CA-O 3.28Å; S235-A297 WeakPolarHBondContact CA-O 3.49Å; S235-A297 PolarHBondContact OG-O 3.47Å; L236-A297 HydrophobicContact CB-CB 4.21Å; L236-A297 PolarHBondContact N-O 3.35Å; Y237-A297 HydrophobicContact CD1-CB 3.99Å; Y237-A297 HydrophobicContact CD2-CB 4.12Å; Y237-A297 HydrophobicContact CE1-CB 3.68Å; Y237-A297 HydrophobicContact CE2-CB 3.8Å; Y237-A297 HydrophobicContact CG-CB 4.21Å; A297-L300 VanDerWaalsContact O-O 3.12Å; A297-L369 HydrophobicContact CB-CD1 4.27Å
298	K	86.2	Confident	90.4	Very high	129 Å²	129	32.6 Å²	32.6	56%	0.561	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-17.7	176.3	58.5	167	-170.8	-177.3	0	113.7	D294 S296	D294-K298 IonicContact OD2-NZ 3.27Å; S296-K298 PolarHBondContact O-N 3.4Å; S296-K298 WeakPolarHBondContact OG-CE 3.47Å; S296-K298 WeakPolarHBondContact OG-CG 3.09Å
299	N	89.9	Confident	91	Very high	12 Å²	12	33.3 Å²	33.3	6%	0.064	16%	0.164	C	C	.	.	S	Bend	trans	-93.6	-3.6	-179.8	-63.1	-15.3	0	0	0	111.7	D294 S296 V311 D312	D294-N299 PolarHBondContact O-ND2 2.91Å; D294-N299 PolarHBondContact OD2-ND2 3.03Å; S296-N299 PolarHBondContact O-N 2.93Å; S296-N299 PolarHBondContact OG-ND2 2.93Å; S296-N299 VanDerWaalsContact OG-ND2 3.1Å; N299-V311 PolarHBondContact O-N 3.49Å; N299-D312 HydrophobicContact CB-CB 4.17Å; N299-D312 PolarHBondContact O-N 3.41Å
300	L	92.3	Very high	91.3	Very high	3 Å²	3	31 Å²	31	2%	0.016	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.4	-172.5	-65.7	169.8	0	0	0	108.9	S235 L236 L275 A297 L308 M310 L369	S235-L300 CarbonylContact C-O 3.56Å; S235-L300 WeakPolarHBondContact CA-O 3.41Å; L236-L300 HydrophobicContact CD1-CB 3.64Å; L236-L300 HydrophobicContact CD1-CD1 3.49Å; L236-L300 VanDerWaalsContact CD1-CD1 3.49Å; L236-L300 HydrophobicContact CD1-CG 4.2Å; L236-L300 HydrophobicContact CD2-CB 4.2Å; L236-L300 HydrophobicContact CG-CB 3.52Å; L236-L300 HydrophobicContact CG-CD1 4.35Å; L236-L300 PolarHBondContact N-O 3.15Å; L275-L300 HydrophobicContact CD1-CD1 4.19Å; L275-L300 HydrophobicContact CD1-CD2 3.95Å; L275-L300 HydrophobicContact CD2-CD1 4.19Å; A297-L300 VanDerWaalsContact O-O 3.12Å; L300-L308 HydrophobicContact CB-CD1 4.4Å; L300-L308 HydrophobicContact CD2-CD1 4.33Å; L300-L308 HydrophobicContact CD2-CD2 4.48Å; L300-M310 HydrophobicContact CD2-CE 3.48Å; L300-M310 VanDerWaalsContact CD2-CE 3.48Å; L300-M310 HydrophobicContact CD2-SD 3.18Å; L300-M310 WeakPolarHBondContact CD2-SD 3.33Å; L300-L369 HydrophobicContact CD1-CD2 3.23Å
301	G	92.3	Very high	91.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	-175.5	179.9	0	0	0	0	0	111.7	Y233 L308 K309	Y233-G301 CarbonylContact O-C 3.46Å; Y233-G301 WeakPolarHBondContact O-CA 3.18Å; G301-L308 CarbonylContact O-C 3.52Å; G301-L308 WeakPolarHBondContact O-CD1 3.5Å; G301-K309 CarbonylContact C-O 3.6Å; G301-K309 WeakPolarHBondContact CA-O 3.35Å; G301-K309 PolarHBondContact N-O 2.88Å; G301-K309 PolarHBondContact O-N 3.41Å
302	Y	92.7	Very high	91.1	Very high	17 Å²	17	32.8 Å²	32.8	7%	0.067	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	159.7	175.4	56.6	-85.6	0	0	0	111	Y233 L236 I271 Y306 D307	Y233-Y302 WeakPolarHBondContact CB-O 3.49Å; Y233-Y302 HydrophobicContact CD1-CE2 4.12Å; Y233-Y302 AromaticContact CD1-CZ 3.98Å; Y233-Y302 AromaticContact CD2-CD2 3.61Å; Y233-Y302 HydrophobicContact CD2-CD2 3.61Å; Y233-Y302 AromaticContact CD2-CE2 3.28Å; Y233-Y302 HydrophobicContact CD2-CE2 3.28Å; Y233-Y302 HydrophobicContact CD2-CG 4.47Å; Y233-Y302 AromaticContact CD2-CZ 3.93Å; Y233-Y302 HydrophobicContact CE2-CD2 4.38Å; Y233-Y302 AromaticContact CE2-CE2 3.86Å; Y233-Y302 HydrophobicContact CE2-CE2 3.86Å; Y233-Y302 AromaticContact CG-CD2 3.99Å; Y233-Y302 HydrophobicContact CG-CD2 3.99Å; Y233-Y302 HydrophobicContact CG-CE1 4.19Å; Y233-Y302 AromaticContact CG-CE2 3.42Å; Y233-Y302 HydrophobicContact CG-CE2 3.42Å; Y233-Y302 VanDerWaalsContact CG-CE2 3.42Å; Y233-Y302 AromaticContact CG-CZ 3.53Å; Y233-Y302 PolarHBondContact N-O 3.06Å; Y233-Y302 PolarHBondContact O-N 3.38Å; L236-Y302 HydrophobicContact CD2-CD1 4.49Å; I271-Y302 HydrophobicContact CD1-CD1 3.84Å; I271-Y302 HydrophobicContact CD1-CD2 4.13Å; I271-Y302 HydrophobicContact CD1-CE1 4.28Å; I271-Y302 HydrophobicContact CD1-CG 3.77Å; I271-Y302 HydrophobicContact CG1-CG 4.34Å; Y302-Y306 AromaticContact CD2-CD1 3.7Å; Y302-Y306 HydrophobicContact CD2-CD1 3.7Å; Y302-Y306 HydrophobicContact CD2-CE1 4.14Å; Y302-Y306 AromaticContact CE2-CD1 3.71Å; Y302-Y306 HydrophobicContact CE2-CD1 3.71Å; Y302-Y306 AromaticContact CE2-CE1 3.69Å; Y302-Y306 HydrophobicContact CE2-CE1 3.69Å; Y302-D307 WeakPolarHBondContact CA-O 3.31Å; Y302-D307 VanDerWaalsContact CB-O 3.3Å; Y302-D307 WeakPolarHBondContact CB-O 3.41Å
303	N	91.5	Very high	91	Very high	27 Å²	27	32.7 Å²	32.7	14%	0.144	16%	0.161	C	C	.	.			trans	-91.5	178.7	176.2	70.8	7.8	0	0	0	112.5	E232 K305 Y306 D307	E232-N303 WeakPolarHBondContact OE2-CA 3.29Å; E232-N303 WeakPolarHBondContact OE2-CB 3.45Å; N303-K305 PolarHBondContact O-N 2.9Å; N303-K305 VanDerWaalsContact O-N 3.11Å; N303-K305 VanDerWaalsContact OD1-C 3.32Å; N303-K305 WeakPolarHBondContact OD1-CA 3.3Å; N303-K305 WeakPolarHBondContact OD1-CB 3.31Å; N303-K305 PolarHBondContact OD1-N 2.97Å; N303-Y306 WeakPolarHBondContact O-CA 3.5Å; N303-Y306 PolarHBondContact O-N 3.33Å; N303-Y306 PolarHBondContact OD1-N 3.03Å; N303-D307 PolarHBondContact N-O 2.99Å; N303-D307 PolarHBondContact ND2-OD2 3.49Å; N303-D307 PolarHBondContact OD1-N 2.96Å; N303-D307 PolarHBondContact OD1-OD2 3.35Å
304	D	89.2	Confident	90.9	Very high	105 Å²	105	35.1 Å²	35.1	56%	0.561	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.4	177.4	-72.2	-22.4	0	0	0	114.1	Y306	D304-Y306 VanDerWaalsContact C-N 3.31Å
305	K	90.6	Very high	90.9	Very high	151 Å²	151	35.7 Å²	35.7	66%	0.657	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	1.4	174.9	-61.2	-179	-178.6	178.6	0	113.1	K270 N303 D307	K270-K305 PolarHBondContact NZ-O 2.98Å; N303-K305 PolarHBondContact O-N 2.9Å; N303-K305 VanDerWaalsContact O-N 3.11Å; N303-K305 VanDerWaalsContact OD1-C 3.32Å; N303-K305 WeakPolarHBondContact OD1-CA 3.3Å; N303-K305 WeakPolarHBondContact OD1-CB 3.31Å; N303-K305 PolarHBondContact OD1-N 2.97Å; K305-D307 WeakPolarHBondContact CB-OD2 3.34Å; K305-D307 PolarHBondContact O-N 2.73Å
306	Y	90.8	Very high	91.1	Very high	41 Å²	41	35 Å²	35	16%	0.161	17%	0.167	C	C	.	.			trans	61.7	28.9	-175.2	-55	-81.5	0	0	0	113.8	P263 R267 I271 Y302 N303 D304	P263-Y306 HydrophobicContact CB-CD1 4.19Å; P263-Y306 HydrophobicContact CB-CE1 3.67Å; P263-Y306 HydrophobicContact CG-CD1 4.34Å; P263-Y306 HydrophobicContact CG-CE1 4.22Å; R267-Y306 HydrophobicContact CB-CD1 3.91Å; R267-Y306 HydrophobicContact CB-CD2 4.13Å; R267-Y306 HydrophobicContact CB-CE1 4.3Å; R267-Y306 HydrophobicContact CB-CG 3.81Å; R267-Y306 VanDerWaalsContact CD-CZ 3.44Å; R267-Y306 HydrophobicContact CG-CD1 4.31Å; R267-Y306 HydrophobicContact CG-CD2 3.67Å; R267-Y306 HydrophobicContact CG-CE1 4.49Å; R267-Y306 HydrophobicContact CG-CE2 3.88Å; R267-Y306 HydrophobicContact CG-CG 3.91Å; R267-Y306 PolarHBondContact NH1-OH 3.43Å; I271-Y306 HydrophobicContact CD1-CD1 4.04Å; I271-Y306 VanDerWaalsContact CG1-O 3.26Å; I271-Y306 WeakPolarHBondContact CG1-O 3.38Å; Y302-Y306 AromaticContact CD2-CD1 3.7Å; Y302-Y306 HydrophobicContact CD2-CD1 3.7Å; Y302-Y306 HydrophobicContact CD2-CE1 4.14Å; Y302-Y306 AromaticContact CE2-CD1 3.71Å; Y302-Y306 HydrophobicContact CE2-CD1 3.71Å; Y302-Y306 AromaticContact CE2-CE1 3.69Å; Y302-Y306 HydrophobicContact CE2-CE1 3.69Å; N303-Y306 WeakPolarHBondContact O-CA 3.5Å; N303-Y306 PolarHBondContact O-N 3.33Å; N303-Y306 PolarHBondContact OD1-N 3.03Å; D304-Y306 VanDerWaalsContact C-N 3.31Å
307	D	92.4	Very high	91.2	Very high	33 Å²	33	33.9 Å²	33.9	18%	0.176	16%	0.159	C	C	.	.			trans	-80.8	131.7	166.1	-45.5	-41.1	0	0	0	107.8	K270 Y302 N303 K305	K270-D307 WeakPolarHBondContact CE-OD1 3.32Å; K270-D307 IonicContact NZ-OD1 3.13Å; K270-D307 PolarHBondContact NZ-OD1 2.93Å; Y302-D307 WeakPolarHBondContact CA-O 3.31Å; Y302-D307 VanDerWaalsContact CB-O 3.3Å; Y302-D307 WeakPolarHBondContact CB-O 3.41Å; N303-D307 PolarHBondContact N-O 2.99Å; N303-D307 PolarHBondContact ND2-OD2 3.49Å; N303-D307 PolarHBondContact OD1-N 2.96Å; N303-D307 PolarHBondContact OD1-OD2 3.35Å; K305-D307 WeakPolarHBondContact CB-OD2 3.34Å; K305-D307 PolarHBondContact O-N 2.73Å
308	L	95.2	Very high	91.3	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	146	178.5	-176.8	79.5	0	0	0	110.1	H214 L236 I271 L275 L300 G301 M310	H214-L308 VanDerWaalsContact CA-O 3.26Å; H214-L308 WeakPolarHBondContact CA-O 3.48Å; H214-L308 HydrophobicContact CB-CD2 4.38Å; L236-L308 HydrophobicContact CD2-CD1 3.98Å; I271-L308 HydrophobicContact CG2-CB 4.36Å; I271-L308 HydrophobicContact CG2-CD1 3.61Å; L275-L308 HydrophobicContact CB-CD2 3.75Å; L275-L308 HydrophobicContact CD1-CD2 4.1Å; L300-L308 HydrophobicContact CB-CD1 4.4Å; L300-L308 HydrophobicContact CD2-CD1 4.33Å; L300-L308 HydrophobicContact CD2-CD2 4.48Å; G301-L308 CarbonylContact O-C 3.52Å; G301-L308 WeakPolarHBondContact O-CD1 3.5Å; L308-M310 HydrophobicContact CD2-SD 4.34Å
309	K	94.8	Very high	91.4	Very high	22 Å²	22	29.5 Å²	29.5	10%	0.096	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	130.8	167	-67.8	-68.5	-178.7	168.7	0	110.8	E213 H214 T215 E229 V231 G301 V311	E213-K309 WeakPolarHBondContact O-CD 3.31Å; E213-K309 WeakPolarHBondContact O-CE 3.42Å; E213-K309 PolarHBondContact O-NZ 3.48Å; H214-K309 CarbonylContact O-C 3.2Å; H214-K309 WeakPolarHBondContact O-CA 3.43Å; T215-K309 PolarHBondContact O-NZ 2.84Å; E229-K309 WeakPolarHBondContact OE1-CE 3.21Å; E229-K309 IonicContact OE1-NZ 2.75Å; E229-K309 PolarHBondContact OE1-NZ 3.29Å; V231-K309 HydrophobicContact CB-CB 4.48Å; V231-K309 HydrophobicContact CG1-CB 3.85Å; V231-K309 HydrophobicContact CG1-CG 4.34Å; V231-K309 HydrophobicContact CG2-CB 3.73Å; V231-K309 HydrophobicContact CG2-CG 4.22Å; G301-K309 CarbonylContact C-O 3.6Å; G301-K309 WeakPolarHBondContact CA-O 3.35Å; G301-K309 PolarHBondContact N-O 2.88Å; G301-K309 PolarHBondContact O-N 3.41Å; K309-V311 PolarHBondContact O-N 2.83Å
310	M	94	Very high	91.3	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.02	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	108.5	173.4	-62.5	-58.3	-56.9	0	0	110.2	H214 P216 F278 M292 L300 L308 M313 I316	H214-M310 WeakPolarHBondContact O-CG 2.93Å; H214-M310 PolarHBondContact O-N 3.47Å; P216-M310 WeakPolarHBondContact CD-O 3.12Å; P216-M310 WeakPolarHBondContact CG-O 3.28Å; F278-M310 HydrophobicContact CD1-CE 4.05Å; F278-M310 HydrophobicContact CD1-CG 4.18Å; F278-M310 HydrophobicContact CD1-SD 3.54Å; F278-M310 VanDerWaalsContact CD1-SD 3.54Å; F278-M310 HydrophobicContact CD2-CG 3.9Å; F278-M310 HydrophobicContact CD2-SD 4.32Å; F278-M310 HydrophobicContact CE1-CE 3.41Å; F278-M310 VanDerWaalsContact CE1-CE 3.41Å; F278-M310 HydrophobicContact CE1-CG 3.95Å; F278-M310 HydrophobicContact CE1-SD 3.49Å; F278-M310 WeakPolarHBondContact CE1-SD 3.26Å; F278-M310 HydrophobicContact CE2-CG 3.61Å; F278-M310 HydrophobicContact CE2-SD 4.24Å; F278-M310 HydrophobicContact CG-CG 4.13Å; F278-M310 HydrophobicContact CG-SD 3.94Å; F278-M310 HydrophobicContact CZ-CE 3.73Å; F278-M310 HydrophobicContact CZ-CG 3.62Å; F278-M310 HydrophobicContact CZ-SD 3.82Å; M292-M310 HydrophobicContact CE-CE 4.33Å; L300-M310 HydrophobicContact CD2-CE 3.48Å; L300-M310 VanDerWaalsContact CD2-CE 3.48Å; L300-M310 HydrophobicContact CD2-SD 3.18Å; L300-M310 WeakPolarHBondContact CD2-SD 3.33Å; L308-M310 HydrophobicContact CD2-SD 4.34Å; M310-M313 HydrophobicContact CB-CG 3.64Å; M310-M313 HydrophobicContact CB-SD 3.79Å; M310-M313 HydrophobicContact CE-CG 4.4Å; M310-M313 HydrophobicContact CG-CG 4.35Å; M310-M313 HydrophobicContact CG-SD 4.22Å; M310-I316 HydrophobicContact CE-CD1 4.15Å
311	V	90.9	Very high	91	Very high	26 Å²	26	33 Å²	33	16%	0.158	16%	0.159	C	C	.	.	S	Bend	trans	-79.4	-36	-176.2	178.7	0	0	0	0	111.5	K113 V231 N299 K309	K113-V311 PolarHBondContact NZ-O 2.83Å; V231-V311 HydrophobicContact CB-CG2 4.44Å; V231-V311 HydrophobicContact CG1-CG2 4.27Å; V231-V311 HydrophobicContact CG2-CG2 4.48Å; N299-V311 PolarHBondContact O-N 3.49Å; K309-V311 PolarHBondContact O-N 2.83Å
312	D	89.3	Confident	90.8	Very high	25 Å²	25	33.1 Å²	33.1	13%	0.134	16%	0.16	C	C	.	.			trans	-137.2	116.9	179.5	-171.9	-13.1	0	0	0	110.3	N299 R314	N299-D312 HydrophobicContact CB-CB 4.17Å; N299-D312 PolarHBondContact O-N 3.41Å; D312-R314 VanDerWaalsContact OD1-CB 3.3Å; D312-R314 WeakPolarHBondContact OD1-CB 3.17Å; D312-R314 VanDerWaalsContact OD1-CG 3.22Å; D312-R314 WeakPolarHBondContact OD1-CG 3.34Å; D312-R314 IonicContact OD1-CZ 2.88Å; D312-R314 PolarHBondContact OD1-N 2.86Å; D312-R314 IonicContact OD1-NE 3.38Å; D312-R314 PolarHBondContact OD1-NE 3.32Å; D312-R314 IonicContact OD1-NH2 3.73Å; D312-R314 IonicContact OD2-CZ 2.84Å; D312-R314 VanDerWaalsContact OD2-CZ 3.27Å; D312-R314 IonicContact OD2-NE 3.48Å; D312-R314 PolarHBondContact OD2-NE 3.3Å; D312-R314 VanDerWaalsContact OD2-NE 3.11Å; D312-R314 IonicContact OD2-NH2 2.63Å; D312-R314 PolarHBondContact OD2-NH2 2.92Å
313	M	92.2	Very high	90.6	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	17%	0.171	C	C	.	.			trans	-111.8	10.1	178.1	-63.2	-174.1	-73.5	0	0	113.2	E202 L205 M206 T215 F278 M310 K315 I316	E202-M313 HydrophobicContact CB-CB 4.27Å; E202-M313 HydrophobicContact CG-CB 4.16Å; E202-M313 PolarHBondContact OE1-N 2.99Å; L205-M313 HydrophobicContact CB-CE 4.31Å; L205-M313 HydrophobicContact CB-SD 4.13Å; L205-M313 HydrophobicContact CD1-CB 4.1Å; M206-M313 HydrophobicContact CB-CE 4.48Å; M206-M313 HydrophobicContact CG-CE 3.44Å; M206-M313 VanDerWaalsContact CG-CE 3.44Å; T215-M313 HydrophobicContact CG2-CE 3.97Å; F278-M313 HydrophobicContact CE2-SD 4.3Å; F278-M313 HydrophobicContact CZ-SD 4.28Å; M310-M313 HydrophobicContact CB-CG 3.64Å; M310-M313 HydrophobicContact CB-SD 3.79Å; M310-M313 HydrophobicContact CE-CG 4.4Å; M310-M313 HydrophobicContact CG-CG 4.35Å; M310-M313 HydrophobicContact CG-SD 4.22Å; M313-K315 VanDerWaalsContact C-N 3.3Å; M313-K315 PolarHBondContact O-N 3.22Å; M313-I316 HydrophobicContact CB-CD1 3.95Å; M313-I316 HydrophobicContact CB-CG1 4.42Å; M313-I316 HydrophobicContact CG-CD1 3.95Å; M313-I316 WeakPolarHBondContact O-CB 3.29Å; M313-I316 PolarHBondContact O-N 3.36Å
314	R	88.4	Confident	90.4	Very high	51 Å²	51	40.3 Å²	40.3	19%	0.192	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-34.8	-171.7	-66.5	176.8	-66.8	-175	-5.6	113.9	N98 E202 D312 I316	N98-R314 PolarHBondContact ND2-NH1 3.19Å; E202-R314 HydrophobicContact CB-CG 3.91Å; E202-R314 HydrophobicContact CG-CG 4.45Å; E202-R314 WeakPolarHBondContact OE2-CG 3.45Å; D312-R314 VanDerWaalsContact OD1-CB 3.3Å; D312-R314 WeakPolarHBondContact OD1-CB 3.17Å; D312-R314 VanDerWaalsContact OD1-CG 3.22Å; D312-R314 WeakPolarHBondContact OD1-CG 3.34Å; D312-R314 IonicContact OD1-CZ 2.88Å; D312-R314 PolarHBondContact OD1-N 2.86Å; D312-R314 IonicContact OD1-NE 3.38Å; D312-R314 PolarHBondContact OD1-NE 3.32Å; D312-R314 IonicContact OD1-NH2 3.73Å; D312-R314 IonicContact OD2-CZ 2.84Å; D312-R314 VanDerWaalsContact OD2-CZ 3.27Å; D312-R314 IonicContact OD2-NE 3.48Å; D312-R314 PolarHBondContact OD2-NE 3.3Å; D312-R314 VanDerWaalsContact OD2-NE 3.11Å; D312-R314 IonicContact OD2-NH2 2.63Å; D312-R314 PolarHBondContact OD2-NH2 2.92Å; R314-I316 VanDerWaalsContact C-N 3.28Å
315	K	90.6	Very high	90.2	Very high	41 Å²	41	38.5 Å²	38.5	18%	0.178	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	17.1	179	-64	-62.5	-173.6	179.9	0	112.5	E129 C293 D294 M313	E129-K315 IonicContact OE1-NZ 3.87Å; E129-K315 PolarHBondContact OE1-NZ 3.49Å; C293-K315 WeakPolarHBondContact CA-O 3.28Å; C293-K315 VanDerWaalsContact CB-O 3.3Å; C293-K315 WeakPolarHBondContact CB-O 3.29Å; C293-K315 PolarHBondContact N-O 3.15Å; D294-K315 HydrophobicContact CB-CB 3.67Å; D294-K315 HydrophobicContact CB-CG 4.1Å; M313-K315 VanDerWaalsContact C-N 3.3Å; M313-K315 PolarHBondContact O-N 3.22Å
316	I	92.6	Very high	90	Very high	7 Å²	7	31.6 Å²	31.6	4%	0.036	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	117.8	164.6	-54.7	-178.4	0	0	0	107.1	N201 L205 F278 V282 F290 L291 M292 M310 M313 R314	N201-I316 WeakPolarHBondContact CB-O 3.26Å; N201-I316 PolarHBondContact ND2-O 2.77Å; L205-I316 HydrophobicContact CD1-CB 3.5Å; L205-I316 VanDerWaalsContact CD1-CB 3.5Å; L205-I316 HydrophobicContact CD1-CD1 4.36Å; L205-I316 HydrophobicContact CD1-CG1 4.46Å; L205-I316 HydrophobicContact CD1-CG2 3.53Å; L205-I316 HydrophobicContact CD2-CG2 4.49Å; F278-I316 HydrophobicContact CE1-CD1 3.73Å; F278-I316 HydrophobicContact CZ-CD1 3.45Å; F278-I316 VanDerWaalsContact CZ-CD1 3.45Å; V282-I316 HydrophobicContact CG1-CG2 4.05Å; F290-I316 HydrophobicContact CB-CG2 3.93Å; L291-I316 CarbonylContact O-C 3.49Å; L291-I316 VanDerWaalsContact O-CA 3.31Å; L291-I316 WeakPolarHBondContact O-CA 3.24Å; M292-I316 HydrophobicContact CG-CD1 4.25Å; M292-I316 HydrophobicContact CG-CG1 4.23Å; M310-I316 HydrophobicContact CE-CD1 4.15Å; M313-I316 HydrophobicContact CB-CD1 3.95Å; M313-I316 HydrophobicContact CB-CG1 4.42Å; M313-I316 HydrophobicContact CG-CD1 3.95Å; M313-I316 WeakPolarHBondContact O-CB 3.29Å; M313-I316 PolarHBondContact O-N 3.36Å; R314-I316 VanDerWaalsContact C-N 3.28Å
317	V	90.9	Very high	89.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.9	-168.2	-60	0	0	0	0	110.8	F290 L291 C293 L322 Y339	F290-V317 CarbonylContact C-O 3.58Å; F290-V317 WeakPolarHBondContact CA-O 3.36Å; L291-V317 HydrophobicContact CB-CG2 4.35Å; L291-V317 PolarHBondContact N-O 3.05Å; L291-V317 PolarHBondContact O-N 3.24Å; C293-V317 VanDerWaalsContact SG-CG2 3.57Å; V317-L322 HydrophobicContact CG2-CB 4.06Å; V317-L322 HydrophobicContact CG2-CD1 4.23Å; V317-L322 HydrophobicContact CG2-CD2 4.43Å; V317-L322 HydrophobicContact CG2-CG 4.48Å; V317-Y339 HydrophobicContact CG1-CE1 3.75Å; V317-Y339 HydrophobicContact CG2-CE1 4.28Å
318	P	90.4	Very high	89.1	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	140.1	170.8	-22.4	32.5	0	0	0	111.3	K160 L161 F290 T320 N321 L322	K160-P318 WeakPolarHBondContact O-CB 3.45Å; L161-P318 HydrophobicContact CD2-CB 3.88Å; L161-P318 HydrophobicContact CD2-CG 3.65Å; F290-P318 HydrophobicContact CD1-CB 4.44Å; F290-P318 HydrophobicContact CD1-CG 4.05Å; F290-P318 HydrophobicContact CE1-CB 4.43Å; F290-P318 HydrophobicContact CE1-CG 3.78Å; P318-T320 VanDerWaalsContact C-N 3.32Å; P318-T320 PolarHBondContact O-N 2.86Å; P318-N321 HydrophobicContact CB-CB 4.12Å; P318-N321 HydrophobicContact CG-CB 4.37Å; P318-N321 PolarHBondContact O-N 3.48Å; P318-L322 PolarHBondContact O-N 3.38Å
319	E	89.3	Confident	88.7	Confident	48 Å²	48	42.8 Å²	42.8	22%	0.224	20%	0.203	C	C	.	.	H	α-helix	trans	-57.5	-44.8	179.6	-175.3	-178	165.9	0	0	111.8	N289 L291 N321 L322 K323	N289-E319 HydrophobicContact CB-CB 4.16Å; N289-E319 WeakPolarHBondContact CB-OE2 3.27Å; N289-E319 PolarHBondContact ND2-OE2 2.93Å; N289-E319 PolarHBondContact O-N 2.72Å; L291-E319 HydrophobicContact CD1-CB 4.16Å; L291-E319 HydrophobicContact CD1-CG 4.04Å; L291-E319 HydrophobicContact CG-CB 4.27Å; E319-N321 PolarHBondContact O-N 3.26Å; E319-L322 PolarHBondContact O-N 2.89Å; E319-K323 HydrophobicContact CG-CD 4.4Å; E319-K323 WeakPolarHBondContact O-CG 3.33Å; E319-K323 PolarHBondContact O-N 3.41Å; E319-K323 WeakPolarHBondContact OE1-CE 3.35Å; E319-K323 IonicContact OE1-NZ 2.73Å; E319-K323 PolarHBondContact OE1-NZ 3.48Å
320	T	87.1	Confident	88.6	Confident	47 Å²	47	47.7 Å²	47.7	29%	0.288	23%	0.225	S	C	.	.	H	α-helix	trans	-57.9	-45.9	178.3	-49.2	0	0	0	0	112.1	L161 P318 K323 E324	L161-T320 PolarHBondContact O-OG1 3.2Å; P318-T320 VanDerWaalsContact C-N 3.32Å; P318-T320 PolarHBondContact O-N 2.86Å; T320-K323 PolarHBondContact O-N 3.21Å; T320-E324 PolarHBondContact O-N 2.87Å
321	N	86.8	Confident	88.5	Confident	41 Å²	41	47.6 Å²	47.6	22%	0.219	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-38.5	179.1	-172.5	38.1	0	0	0	111.9	P318 E319 E324 L325	P318-N321 HydrophobicContact CB-CB 4.12Å; P318-N321 HydrophobicContact CG-CB 4.37Å; P318-N321 PolarHBondContact O-N 3.48Å; E319-N321 PolarHBondContact O-N 3.26Å; N321-E324 PolarHBondContact O-N 3.26Å; N321-L325 VanDerWaalsContact O-CG 3.24Å; N321-L325 WeakPolarHBondContact O-CG 3.38Å; N321-L325 PolarHBondContact O-N 2.94Å
322	L	88.1	Confident	88.6	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-63.3	-42.4	176.1	-175.7	66.8	0	0	0	111.9	L291 V317 P318 E319 E324 L325 I326 Y339 C343 V358	L291-L322 HydrophobicContact CD1-CB 4.49Å; L291-L322 HydrophobicContact CD1-CD2 3.39Å; V317-L322 HydrophobicContact CG2-CB 4.06Å; V317-L322 HydrophobicContact CG2-CD1 4.23Å; V317-L322 HydrophobicContact CG2-CD2 4.43Å; V317-L322 HydrophobicContact CG2-CG 4.48Å; P318-L322 PolarHBondContact O-N 3.38Å; E319-L322 PolarHBondContact O-N 2.89Å; L322-E324 VanDerWaalsContact C-N 3.32Å; L322-E324 PolarHBondContact O-N 2.87Å; L322-L325 PolarHBondContact O-N 3.3Å; L322-L325 VanDerWaalsContact O-N 3.16Å; L322-I326 HydrophobicContact CD1-CD1 3.59Å; L322-I326 HydrophobicContact CD1-CG1 4.04Å; L322-I326 HydrophobicContact CD2-CD1 4.37Å; L322-I326 HydrophobicContact CG-CD1 3.83Å; L322-I326 HydrophobicContact CG-CG1 4.4Å; L322-I326 PolarHBondContact O-N 3.39Å; L322-Y339 HydrophobicContact CD1-CD1 3.55Å; L322-Y339 HydrophobicContact CD1-CD2 4.16Å; L322-Y339 HydrophobicContact CD1-CE1 4.23Å; L322-Y339 HydrophobicContact CD1-CG 3.52Å; L322-C343 HydrophobicContact CD2-CB 4.28Å; L322-V358 HydrophobicContact CD2-CG2 3.67Å
323	K	88.5	Confident	88.7	Confident	70 Å²	70	54.5 Å²	54.5	30%	0.304	26%	0.26	S	S	.	.	H	α-helix	trans	-56.3	-47.8	177.6	-72.9	178.1	176.7	170.8	0	111.2	E319 T320 L325 I326 K327 S356	E319-K323 HydrophobicContact CG-CD 4.4Å; E319-K323 WeakPolarHBondContact O-CG 3.33Å; E319-K323 PolarHBondContact O-N 3.41Å; E319-K323 WeakPolarHBondContact OE1-CE 3.35Å; E319-K323 IonicContact OE1-NZ 2.73Å; E319-K323 PolarHBondContact OE1-NZ 3.48Å; T320-K323 PolarHBondContact O-N 3.21Å; K323-L325 VanDerWaalsContact C-N 3.34Å; K323-L325 PolarHBondContact O-N 3.01Å; K323-I326 PolarHBondContact O-N 3.47Å; K323-K327 WeakPolarHBondContact O-CB 3.25Å; K323-K327 PolarHBondContact O-N 3.2Å; K323-S356 WeakPolarHBondContact CG-O 3.22Å
324	E	86.3	Confident	88.6	Confident	126 Å²	126	58.5 Å²	58.5	59%	0.589	28%	0.281	S	S	*	.	H	α-helix	trans	-65.8	-35.1	177.8	-68.7	-60.1	145.9	0	0	112.7	T320 N321 L322	T320-E324 PolarHBondContact O-N 2.87Å; N321-E324 PolarHBondContact O-N 3.26Å; L322-E324 VanDerWaalsContact C-N 3.32Å; L322-E324 PolarHBondContact O-N 2.87Å
325	L	84.3	Confident	88.6	Confident	67 Å²	67	62.6 Å²	62.6	35%	0.351	31%	0.306	S	S	.	.	H	α-helix	trans	-71.5	-31.3	178.5	-71.8	170.2	0	0	0	113.6	P130 N321 L322 K323 Y339	P130-L325 HydrophobicContact CG-CD2 3.98Å; N321-L325 VanDerWaalsContact O-CG 3.24Å; N321-L325 WeakPolarHBondContact O-CG 3.38Å; N321-L325 PolarHBondContact O-N 2.94Å; L322-L325 PolarHBondContact O-N 3.3Å; L322-L325 VanDerWaalsContact O-N 3.16Å; K323-L325 VanDerWaalsContact C-N 3.34Å; K323-L325 PolarHBondContact O-N 3.01Å; L325-Y339 HydrophobicContact CD1-CE2 4.26Å
326	I	87.7	Confident	88.5	Confident	5 Å²	5	63.6 Å²	63.6	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-96.5	-36.2	-173.5	-67.9	-177	0	0	0	113.1	L322 K323 D328 R329 T345 C354 T355	L322-I326 HydrophobicContact CD1-CD1 3.59Å; L322-I326 HydrophobicContact CD1-CG1 4.04Å; L322-I326 HydrophobicContact CD2-CD1 4.37Å; L322-I326 HydrophobicContact CG-CD1 3.83Å; L322-I326 HydrophobicContact CG-CG1 4.4Å; L322-I326 PolarHBondContact O-N 3.39Å; K323-I326 PolarHBondContact O-N 3.47Å; I326-D328 PolarHBondContact O-N 3.01Å; I326-R329 VanDerWaalsContact O-CB 3.31Å; I326-R329 WeakPolarHBondContact O-CB 3.36Å; I326-R329 PolarHBondContact O-N 3.14Å; I326-T345 HydrophobicContact CD1-CG2 3.92Å; I326-T345 HydrophobicContact CG2-CG2 4.05Å; I326-T345 WeakPolarHBondContact CG2-OG1 3.02Å; I326-C354 HydrophobicContact CG2-CB 3.45Å; I326-C354 VanDerWaalsContact CG2-CB 3.45Å; I326-T355 WeakPolarHBondContact CG2-O 3.44Å
327	K	83.1	Confident	88.4	Confident	107 Å²	107	63.3 Å²	63.3	47%	0.465	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-27.8	-166.9	177	-179.5	168.9	-172.1	0	115.9	K323	K323-K327 WeakPolarHBondContact O-CB 3.25Å; K323-K327 PolarHBondContact O-N 3.2Å
328	D	80.6	Confident	88.3	Confident	105 Å²	105	65 Å²	65	56%	0.561	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	9.6	-178.8	-76.2	-54.7	0	0	0	114.2	I326 H330 K353	I326-D328 PolarHBondContact O-N 3.01Å; D328-H330 PolarHBondContact O-N 3.15Å; D328-K353 IonicContact OD1-NZ 2.63Å; D328-K353 PolarHBondContact OD1-NZ 3.02Å
329	R	87.8	Confident	88.3	Confident	102 Å²	102	67 Å²	67	39%	0.385	33%	0.33	S	S	.	.			trans	-74.3	127.5	176.5	-171.2	172.8	177.6	179.5	-5.4	110	I326 V338 K353 C354	I326-R329 VanDerWaalsContact O-CB 3.31Å; I326-R329 WeakPolarHBondContact O-CB 3.36Å; I326-R329 PolarHBondContact O-N 3.14Å; R329-V338 PolarHBondContact NH1-O 3.32Å; R329-K353 WeakPolarHBondContact O-CA 3.12Å; R329-C354 HydrophobicContact CB-CB 4.5Å; R329-C354 PolarHBondContact O-N 3.43Å
330	H	91.1	Very high	88	Confident	124 Å²	124	66.2 Å²	66.2	57%	0.574	34%	0.336	S	S	*	.	B	Isolated β-bridge	trans	-67.6	138.5	173	-174.5	59.8	0	0	0	110.7	D328 M352	D328-H330 PolarHBondContact O-N 3.15Å; H330-M352 WeakPolarHBondContact CA-O 3.45Å; H330-M352 PolarHBondContact ND1-O 3.06Å
331	C	93.3	Very high	87.9	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.014	35%	0.345	C	S	.	.			trans	-142.2	149.1	178.4	58.5	0	0	0	0	111	D336 C337 C347 M352 K353 C354	C331-D336 HydrophobicContact CB-CB 3.92Å; C331-C337 WeakPolarHBondContact CB-SG 3.43Å; C331-C347 VanDerWaalsContact C-SG 3.52Å; C331-C347 HydrophobicContact CB-CB 3.85Å; C331-C347 WeakPolarHBondContact CB-SG 3.39Å; C331-C347 PolarHBondContact O-SG 3.27Å; C331-C347 VanDerWaalsContact O-SG 3.38Å; C331-C347 WeakPolarHBondContact SG-CA 3.02Å; C331-C347 WeakPolarHBondContact SG-CB 2.95Å; C331-C347 CovalentContact SG-SG 2.03Å; C331-C347 PolarHBondContact SG-SG 3.45Å; C331-M352 PolarHBondContact N-O 2.91Å; C331-M352 VanDerWaalsContact N-O 3.11Å; C331-M352 WeakPolarHBondContact O-CE 3.42Å; C331-K353 PolarHBondContact SG-O 3.36Å; C331-C354 PolarHBondContact SG-N 3.16Å; C331-C354 VanDerWaalsContact SG-N 3.43Å
332	E	91.8	Very high	88	Confident	148 Å²	148	66.8 Å²	66.8	69%	0.692	34%	0.34	S	S	*	.	S	Bend	trans	-103.8	-29.6	168	-63.2	-177.4	178.9	0	0	110.7	D336 M352	E332-D336 PolarHBondContact N-OD2 3.35Å; E332-M352 HydrophobicContact CB-CE 4.33Å; E332-M352 HydrophobicContact CG-CE 4.01Å
333	S	91.6	Very high	88.1	Confident	48 Å²	48	66.8 Å²	66.8	34%	0.336	34%	0.34	S	S	.	.	S	Bend	trans	-139.8	162.7	179.5	73.6	0	0	0	0	112.2	L335 D336	S333-L335 PolarHBondContact O-N 3.44Å; S333-L335 PolarHBondContact OG-N 3.18Å; S333-D336 PolarHBondContact N-OD2 2.94Å; S333-D336 WeakPolarHBondContact O-CB 3.33Å; S333-D336 PolarHBondContact O-N 3.08Å; S333-D336 PolarHBondContact OG-OD2 2.9Å
334	D	89.7	Confident	88.2	Confident	86 Å²	86	69.1 Å²	69.1	46%	0.46	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-22.5	174.2	-66	-16.2	0	0	0	113.1	D336 C337 C347	D334-D336 PolarHBondContact O-N 3.44Å; D334-C337 PolarHBondContact O-N 2.71Å; D334-C347 PolarHBondContact OD1-N 2.01Å
335	L	88.9	Confident	88.5	Confident	137 Å²	137	63.1 Å²	63.1	72%	0.717	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-19	178.7	-60.9	176.5	0	0	0	112.8	S333 C337 V338	S333-L335 PolarHBondContact O-N 3.44Å; S333-L335 PolarHBondContact OG-N 3.18Å; L335-C337 VanDerWaalsContact C-N 3.34Å; L335-V338 WeakPolarHBondContact O-CG2 3.4Å
336	D	88.3	Confident	88.8	Confident	63 Å²	63	61.9 Å²	61.9	34%	0.337	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-21	178.2	-54.2	-41.8	0	0	0	111.7	C331 E332 S333 D334 V338	C331-D336 HydrophobicContact CB-CB 3.92Å; E332-D336 PolarHBondContact N-OD2 3.35Å; S333-D336 PolarHBondContact N-OD2 2.94Å; S333-D336 WeakPolarHBondContact O-CB 3.33Å; S333-D336 PolarHBondContact O-N 3.08Å; S333-D336 PolarHBondContact OG-OD2 2.9Å; D334-D336 PolarHBondContact O-N 3.44Å; D336-V338 VanDerWaalsContact C-N 3.26Å; D336-V338 PolarHBondContact O-N 3.22Å; D336-V338 VanDerWaalsContact O-N 3.1Å
337	C	90.5	Very high	89.1	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.007	32%	0.319	C	S	.	.			trans	-88.9	56.2	-176.8	-63.1	0	0	0	0	112.2	C331 D334 L335 R344 T345 C354	C331-C337 WeakPolarHBondContact CB-SG 3.43Å; D334-C337 PolarHBondContact O-N 2.71Å; L335-C337 VanDerWaalsContact C-N 3.34Å; C337-R344 WeakPolarHBondContact O-CA 3.19Å; C337-T345 WeakPolarHBondContact CB-O 3.4Å; C337-T345 WeakPolarHBondContact CB-OG1 3.36Å; C337-T345 PolarHBondContact O-N 2.86Å; C337-C354 WeakPolarHBondContact CA-SG 3.49Å; C337-C354 HydrophobicContact CB-CB 3.8Å; C337-C354 WeakPolarHBondContact CB-SG 3.47Å; C337-C354 WeakPolarHBondContact SG-CA 3.27Å; C337-C354 WeakPolarHBondContact SG-CB 3.4Å; C337-C354 CovalentContact SG-SG 2.04Å; C337-C354 PolarHBondContact SG-SG 3.22Å
338	V	90.3	Very high	89.5	Confident	35 Å²	35	60 Å²	60	21%	0.212	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	134.4	-179.6	-172.3	0	0	0	0	110.7	R329 L335 D336 C343 R344	R329-V338 PolarHBondContact NH1-O 3.32Å; L335-V338 WeakPolarHBondContact O-CG2 3.4Å; D336-V338 VanDerWaalsContact C-N 3.26Å; D336-V338 PolarHBondContact O-N 3.22Å; D336-V338 VanDerWaalsContact O-N 3.1Å; V338-C343 WeakPolarHBondContact CA-O 3.02Å; V338-R344 HydrophobicContact CG1-CG 4.42Å; V338-R344 HydrophobicContact CG2-CG 4.06Å
339	Y	88.5	Confident	90.1	Very high	42 Å²	42	62.5 Å²	62.5	17%	0.165	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.7	169.4	-179.2	-91	0	0	0	110	C293 V317 L322 L325 T341 C343	C293-Y339 HydrophobicContact CB-CD1 3.76Å; C293-Y339 HydrophobicContact CB-CE1 4.14Å; V317-Y339 HydrophobicContact CG1-CE1 3.75Å; V317-Y339 HydrophobicContact CG2-CE1 4.28Å; L322-Y339 HydrophobicContact CD1-CD1 3.55Å; L322-Y339 HydrophobicContact CD1-CD2 4.16Å; L322-Y339 HydrophobicContact CD1-CE1 4.23Å; L322-Y339 HydrophobicContact CD1-CG 3.52Å; L325-Y339 HydrophobicContact CD1-CE2 4.26Å; Y339-T341 PolarHBondContact O-N 2.04Å; Y339-C343 PolarHBondContact N-O 3.39Å; Y339-C343 WeakPolarHBondContact O-CB 3.39Å; Y339-C343 PolarHBondContact O-N 2.69Å
340	G	84.4	Confident	90.3	Very high	33 Å²	33	62.4 Å²	62.4	34%	0.34	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	-128.7	-172.7	0	0	0	0	0	111	C293	C293-G340 WeakPolarHBondContact O-CA 3.33Å
341	T	85.5	Confident	90.3	Very high	78 Å²	78	60.2 Å²	60.2	48%	0.479	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-28.3	-179.5	59.5	0	0	0	0	113.5	C293 D294 Y339	C293-T341 PolarHBondContact O-N 3.37Å; D294-T341 WeakPolarHBondContact CA-OG1 3.08Å; D294-T341 WeakPolarHBondContact OD1-CG2 3.42Å; D294-T341 PolarHBondContact OD1-OG1 3.29Å; Y339-T341 PolarHBondContact O-N 2.04Å
342	D	87.6	Confident	90.3	Very high	22 Å²	22	63.4 Å²	63.4	12%	0.118	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	-7.1	-165.7	60.2	-4.2	0	0	0	115.1	C293 D294 T295 R344 K365	C293-D342 WeakPolarHBondContact CA-OD1 3.02Å; D294-D342 PolarHBondContact N-OD1 3.39Å; T295-D342 WeakPolarHBondContact CA-OD2 3.08Å; T295-D342 WeakPolarHBondContact CB-OD2 3.3Å; T295-D342 PolarHBondContact N-OD2 3.47Å; T295-D342 PolarHBondContact OG1-OD2 2.85Å; D342-R344 PolarHBondContact O-N 2.94Å; D342-K365 HydrophobicContact CB-CD 4.17Å
343	C	90.9	Very high	90.3	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.007	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	106.3	171.7	-77.9	0	0	0	0	110.5	C293 L322 V338 Y339	C293-C343 WeakPolarHBondContact CA-SG 3.39Å; C293-C343 HydrophobicContact CB-CB 3.67Å; C293-C343 WeakPolarHBondContact CB-SG 3.2Å; C293-C343 WeakPolarHBondContact SG-CB 3.41Å; C293-C343 CovalentContact SG-SG 2.04Å; C293-C343 PolarHBondContact SG-SG 2.9Å; L322-C343 HydrophobicContact CD2-CB 4.28Å; V338-C343 WeakPolarHBondContact CA-O 3.02Å; Y339-C343 PolarHBondContact N-O 3.39Å; Y339-C343 WeakPolarHBondContact O-CB 3.39Å; Y339-C343 PolarHBondContact O-N 2.69Å
344	R	90.7	Very high	90.4	Very high	119 Å²	119	58.2 Å²	58.2	45%	0.449	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137.7	-176.5	-51.6	-173.3	177.2	169.8	-1	111.7	C337 V338 D342 I359	C337-R344 WeakPolarHBondContact O-CA 3.19Å; V338-R344 HydrophobicContact CG1-CG 4.42Å; V338-R344 HydrophobicContact CG2-CG 4.06Å; D342-R344 PolarHBondContact O-N 2.94Å; R344-I359 PolarHBondContact O-N 3.34Å
345	T	91.3	Very high	90.4	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	31%	0.306	C	S	.	.			trans	-119	177.8	167.4	73.2	0	0	0	0	109.7	I326 C337 T355 E357 V358	I326-T345 HydrophobicContact CD1-CG2 3.92Å; I326-T345 HydrophobicContact CG2-CG2 4.05Å; I326-T345 WeakPolarHBondContact CG2-OG1 3.02Å; C337-T345 WeakPolarHBondContact CB-O 3.4Å; C337-T345 WeakPolarHBondContact CB-OG1 3.36Å; C337-T345 PolarHBondContact O-N 2.86Å; T345-T355 WeakPolarHBondContact CB-O 3.02Å; T345-T355 WeakPolarHBondContact CG2-O 3.26Å; T345-T355 PolarHBondContact OG1-O 2.94Å; T345-E357 WeakPolarHBondContact CB-O 3.13Å; T345-E357 WeakPolarHBondContact CG2-O 3.44Å; T345-V358 HydrophobicContact CG2-CG2 4.22Å
346	S	91.4	Very high	90.3	Very high	41 Å²	41	51.6 Å²	51.6	29%	0.287	29%	0.286	S	S	.	.			trans	-95.9	152	177.6	55	0	0	0	0	111.6	C354 T355	S346-C354 CarbonylContact O-C 3.48Å; S346-C354 WeakPolarHBondContact O-CA 3.22Å; S346-T355 PolarHBondContact N-OG1 3.33Å; S346-T355 VanDerWaalsContact N-OG1 3.16Å; S346-T355 WeakPolarHBondContact O-CG2 3.36Å; S346-T355 PolarHBondContact O-N 3.45Å; S346-T355 PolarHBondContact O-OG1 3.43Å; S346-T355 VanDerWaalsContact O-OG1 3.06Å; S346-T355 VanDerWaalsContact OG-CG2 3.32Å; S346-T355 WeakPolarHBondContact OG-CG2 3.5Å; S346-T355 PolarHBondContact OG-OG1 3.44Å
347	C	93.3	Very high	90.1	Very high	12 Å²	12	55.1 Å²	55.1	8%	0.081	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.1	171.5	-173.6	0	0	0	0	109.7	C331 D334 Q349	C331-C347 VanDerWaalsContact C-SG 3.52Å; C331-C347 HydrophobicContact CB-CB 3.85Å; C331-C347 WeakPolarHBondContact CB-SG 3.39Å; C331-C347 PolarHBondContact O-SG 3.27Å; C331-C347 VanDerWaalsContact O-SG 3.38Å; C331-C347 WeakPolarHBondContact SG-CA 3.02Å; C331-C347 WeakPolarHBondContact SG-CB 2.95Å; C331-C347 CovalentContact SG-SG 2.03Å; C331-C347 PolarHBondContact SG-SG 3.45Å; D334-C347 PolarHBondContact OD1-N 2.01Å; C347-Q349 PolarHBondContact O-N 3.4Å
348	D	93.2	Very high	90	Very high	59 Å²	59	55.8 Å²	55.8	32%	0.316	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	104.4	169.8	175.2	10.7	0	0	0	109.1	S350 T351 M352 K353 T355	D348-S350 VanDerWaalsContact CG-OG 3.23Å; D348-S350 PolarHBondContact O-N 2.86Å; D348-S350 VanDerWaalsContact O-N 3.16Å; D348-S350 WeakPolarHBondContact OD1-CB 3.39Å; D348-S350 PolarHBondContact OD1-N 3.27Å; D348-S350 PolarHBondContact OD1-OG 3.18Å; D348-S350 PolarHBondContact OD2-OG 3.38Å; D348-S350 VanDerWaalsContact OD2-OG 3.1Å; D348-T351 WeakPolarHBondContact CB-OG1 3.43Å; D348-T351 VanDerWaalsContact CG-OG1 3.24Å; D348-T351 PolarHBondContact O-N 3.3Å; D348-T351 WeakPolarHBondContact OD2-CG2 3.49Å; D348-T351 PolarHBondContact OD2-OG1 3.42Å; D348-M352 VanDerWaalsContact O-CA 3.3Å; D348-M352 WeakPolarHBondContact O-CA 3.46Å; D348-M352 PolarHBondContact O-N 2.91Å; D348-K353 WeakPolarHBondContact CB-O 3.24Å; D348-K353 PolarHBondContact N-O 3.01Å; D348-K353 PolarHBondContact O-N 3.42Å; D348-T355 HydrophobicContact CB-CG2 4.26Å
349	Q	91.4	Very high	89.8	Confident	158 Å²	158	57.2 Å²	57.2	74%	0.738	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20	-178.9	-64.5	-175.9	-11.7	0	0	113.3	C347	C347-Q349 PolarHBondContact O-N 3.4Å
350	S	92.8	Very high	89.8	Confident	101 Å²	101	58.4 Å²	58.4	71%	0.706	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-36.4	178.9	72.4	0	0	0	0	112.3	D348	D348-S350 VanDerWaalsContact CG-OG 3.23Å; D348-S350 PolarHBondContact O-N 2.86Å; D348-S350 VanDerWaalsContact O-N 3.16Å; D348-S350 WeakPolarHBondContact OD1-CB 3.39Å; D348-S350 PolarHBondContact OD1-N 3.27Å; D348-S350 PolarHBondContact OD1-OG 3.18Å; D348-S350 PolarHBondContact OD2-OG 3.38Å; D348-S350 VanDerWaalsContact OD2-OG 3.1Å
351	T	91.8	Very high	90	Very high	78 Å²	78	57.5 Å²	57.5	48%	0.479	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-9.8	-179.6	57.9	0	0	0	0	113	D348 K353	D348-T351 WeakPolarHBondContact CB-OG1 3.43Å; D348-T351 VanDerWaalsContact CG-OG1 3.24Å; D348-T351 PolarHBondContact O-N 3.3Å; D348-T351 WeakPolarHBondContact OD2-CG2 3.49Å; D348-T351 PolarHBondContact OD2-OG1 3.42Å; T351-K353 PolarHBondContact O-N 3.46Å
352	M	92.4	Very high	90.4	Very high	68 Å²	68	53.8 Å²	53.8	34%	0.335	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	40	-170.9	-60.9	-70.9	-72.1	0	0	111.6	H330 C331 E332 D348	H330-M352 WeakPolarHBondContact CA-O 3.45Å; H330-M352 PolarHBondContact ND1-O 3.06Å; C331-M352 PolarHBondContact N-O 2.91Å; C331-M352 VanDerWaalsContact N-O 3.11Å; C331-M352 WeakPolarHBondContact O-CE 3.42Å; E332-M352 HydrophobicContact CB-CE 4.33Å; E332-M352 HydrophobicContact CG-CE 4.01Å; D348-M352 VanDerWaalsContact O-CA 3.3Å; D348-M352 WeakPolarHBondContact O-CA 3.46Å; D348-M352 PolarHBondContact O-N 2.91Å
353	K	93	Very high	90.6	Very high	84 Å²	84	52.7 Å²	52.7	37%	0.365	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.9	-178.2	-73	-176.5	172.5	-165	0	111.4	D328 R329 C331 D348 T351	D328-K353 IonicContact OD1-NZ 2.63Å; D328-K353 PolarHBondContact OD1-NZ 3.02Å; R329-K353 WeakPolarHBondContact O-CA 3.12Å; C331-K353 PolarHBondContact SG-O 3.36Å; D348-K353 WeakPolarHBondContact CB-O 3.24Å; D348-K353 PolarHBondContact N-O 3.01Å; D348-K353 PolarHBondContact O-N 3.42Å; T351-K353 PolarHBondContact O-N 3.46Å
354	C	92.4	Very high	90.7	Very high	4 Å²	4	52.8 Å²	52.8	3%	0.027	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.8	175.7	-62.7	0	0	0	0	111.4	I326 R329 C331 C337 S346	I326-C354 HydrophobicContact CG2-CB 3.45Å; I326-C354 VanDerWaalsContact CG2-CB 3.45Å; R329-C354 HydrophobicContact CB-CB 4.5Å; R329-C354 PolarHBondContact O-N 3.43Å; C331-C354 PolarHBondContact SG-N 3.16Å; C331-C354 VanDerWaalsContact SG-N 3.43Å; C337-C354 WeakPolarHBondContact CA-SG 3.49Å; C337-C354 HydrophobicContact CB-CB 3.8Å; C337-C354 WeakPolarHBondContact CB-SG 3.47Å; C337-C354 WeakPolarHBondContact SG-CA 3.27Å; C337-C354 WeakPolarHBondContact SG-CB 3.4Å; C337-C354 CovalentContact SG-SG 2.04Å; C337-C354 PolarHBondContact SG-SG 3.22Å; S346-C354 CarbonylContact O-C 3.48Å; S346-C354 WeakPolarHBondContact O-CA 3.22Å
355	T	90.6	Very high	90.8	Very high	41 Å²	41	47.7 Å²	47.7	25%	0.252	26%	0.258	S	S	.	.			trans	-72.6	159.5	170.8	64.6	0	0	0	0	110.6	I326 T345 S346 D348	I326-T355 WeakPolarHBondContact CG2-O 3.44Å; T345-T355 WeakPolarHBondContact CB-O 3.02Å; T345-T355 WeakPolarHBondContact CG2-O 3.26Å; T345-T355 PolarHBondContact OG1-O 2.94Å; S346-T355 PolarHBondContact N-OG1 3.33Å; S346-T355 VanDerWaalsContact N-OG1 3.16Å; S346-T355 WeakPolarHBondContact O-CG2 3.36Å; S346-T355 PolarHBondContact O-N 3.45Å; S346-T355 PolarHBondContact O-OG1 3.43Å; S346-T355 VanDerWaalsContact O-OG1 3.06Å; S346-T355 VanDerWaalsContact OG-CG2 3.32Å; S346-T355 WeakPolarHBondContact OG-CG2 3.5Å; S346-T355 PolarHBondContact OG-OG1 3.44Å; D348-T355 HydrophobicContact CB-CG2 4.26Å
356	S	86.3	Confident	91	Very high	42 Å²	42	47.7 Å²	47.7	29%	0.294	26%	0.258	S	S	.	.	S	Bend	trans	-88.5	-8.5	179	54.2	0	0	0	0	113.4	K323	K323-S356 WeakPolarHBondContact CG-O 3.22Å
357	E	84.9	Confident	91.1	Very high	138 Å²	138	45.7 Å²	45.7	65%	0.645	25%	0.245	S	C	*	.			trans	-87.9	123.4	-178	-65.5	-172.8	175.6	0	0	111.1	T345	T345-E357 WeakPolarHBondContact CB-O 3.13Å; T345-E357 WeakPolarHBondContact CG2-O 3.44Å
358	V	87.8	Confident	91.2	Very high	14 Å²	14	49.9 Å²	49.9	9%	0.085	26%	0.263	C	S	.	.			trans	-79.3	131.6	177.8	179.8	0	0	0	0	109.3	L291 L322 T345 V398	L291-V358 HydrophobicContact CD1-CB 4.48Å; L291-V358 HydrophobicContact CD1-CG2 3.75Å; L322-V358 HydrophobicContact CD2-CG2 3.67Å; T345-V358 HydrophobicContact CG2-CG2 4.22Å; V358-V398 WeakPolarHBondContact O-CB 3.46Å; V358-V398 WeakPolarHBondContact O-CG2 3.38Å
359	I	86.7	Confident	91.1	Very high	66 Å²	66	48 Å²	48	34%	0.338	25%	0.252	S	S	.	.	S	Bend	trans	-76.2	-35.7	-172.6	-61.6	167.2	0	0	0	112.1	R344 V398	R344-I359 PolarHBondContact O-N 3.34Å; I359-V398 PolarHBondContact O-N 3.37Å
360	Q	86.9	Confident	91.2	Very high	67 Å²	67	40.6 Å²	40.6	31%	0.313	22%	0.218	S	C	.	.	S	Bend	trans	-117.6	126.8	-171.2	-69.6	-174	-38.2	0	0	112.5
361	P	90.1	Very high	91.2	Very high	13 Å²	13	37.6 Å²	37.6	8%	0.084	19%	0.192	C	C	.	.			trans	-74.5	164.3	176.8	31.2	-34	0	0	0	112.2	L363 A364 K365 L396 V398	P361-L363 VanDerWaalsContact C-N 3.3Å; P361-L363 PolarHBondContact O-N 3.07Å; P361-A364 HydrophobicContact CG-CB 3.87Å; P361-A364 PolarHBondContact O-N 2.96Å; P361-K365 WeakPolarHBondContact O-CE 3.44Å; P361-K365 PolarHBondContact O-N 3.37Å; P361-L396 WeakPolarHBondContact CD-O 3.03Å; P361-L396 HydrophobicContact CG-CB 3.91Å; P361-V398 HydrophobicContact CB-CG2 4.32Å
362	N	92.1	Very high	91	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.5	-42	177.7	-69.5	-15.3	0	0	0	112.7	V279 F290 L291 M292 A364 K365 A366	V279-N362 HydrophobicContact CG1-CB 3.89Å; F290-N362 PolarHBondContact O-ND2 3.49Å; L291-N362 WeakPolarHBondContact CA-OD1 3.25Å; M292-N362 PolarHBondContact N-OD1 3.37Å; M292-N362 HydrophobicContact SD-CB 4.37Å; N362-A364 PolarHBondContact O-N 3.47Å; N362-K365 VanDerWaalsContact CA-CE 3.5Å; N362-K365 PolarHBondContact O-N 3.26Å; N362-K365 WeakPolarHBondContact OD1-CE 3.15Å; N362-K365 PolarHBondContact OD1-NZ 3.02Å; N362-A366 PolarHBondContact O-N 3.47Å
363	L	92.7	Very high	90.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-40.6	179.6	178.6	57.1	0	0	0	112.8	L276 V279 P361 K365 A366 C367 C393 L396 H407 I410 L411	L276-L363 HydrophobicContact CD2-CD1 3.69Å; V279-L363 HydrophobicContact CG1-CB 4.08Å; P361-L363 VanDerWaalsContact C-N 3.3Å; P361-L363 PolarHBondContact O-N 3.07Å; L363-K365 VanDerWaalsContact C-N 3.32Å; L363-K365 PolarHBondContact O-N 3.37Å; L363-A366 PolarHBondContact O-N 2.95Å; L363-C367 WeakPolarHBondContact O-CB 3.35Å; L363-C367 PolarHBondContact O-N 2.91Å; L363-C367 PolarHBondContact O-SG 3.45Å; L363-C367 VanDerWaalsContact O-SG 3.4Å; L363-C393 WeakPolarHBondContact CG-SG 3.08Å; L363-C393 PolarHBondContact O-SG 2.78Å; L363-L396 HydrophobicContact CD2-CD1 3.96Å; L363-L396 HydrophobicContact CG-CD1 4.32Å; L363-H407 WeakPolarHBondContact CB-NE2 3.31Å; L363-H407 VanDerWaalsContact CD2-CD2 3.44Å; L363-H407 WeakPolarHBondContact CD2-CD2 3.39Å; L363-I410 HydrophobicContact CD2-CG2 4.41Å; L363-L411 HydrophobicContact CD1-CD1 3.77Å; L363-L411 HydrophobicContact CD2-CB 4.01Å; L363-L411 HydrophobicContact CD2-CD1 4.45Å
364	A	92.9	Very high	90.8	Very high	3 Å²	3	31.3 Å²	31.3	3%	0.025	16%	0.161	C	C	.	.	H	α-helix	trans	-61.1	-42.6	175.9	0	0	0	0	0	111.7	P361 N362 C367 Q368 C393 L396	P361-A364 HydrophobicContact CG-CB 3.87Å; P361-A364 PolarHBondContact O-N 2.96Å; N362-A364 PolarHBondContact O-N 3.47Å; A364-C367 PolarHBondContact O-N 3.41Å; A364-Q368 WeakPolarHBondContact O-CB 3.49Å; A364-Q368 PolarHBondContact O-N 2.79Å; A364-C393 WeakPolarHBondContact CA-O 3.27Å; A364-L396 HydrophobicContact CB-CB 4.31Å
365	K	93.1	Very high	90.7	Very high	12 Å²	12	32.7 Å²	32.7	5%	0.052	17%	0.168	C	C	.	.	H	α-helix	trans	-65.7	-42.8	177.2	-65.2	174	-66.7	-170.9	0	111.6	M292 T295 D342 P361 N362 L363 Q368 L369	M292-K365 WeakPolarHBondContact O-CE 3.48Å; M292-K365 PolarHBondContact O-NZ 3.03Å; T295-K365 HydrophobicContact CG2-CB 4.25Å; D342-K365 HydrophobicContact CB-CD 4.17Å; P361-K365 WeakPolarHBondContact O-CE 3.44Å; P361-K365 PolarHBondContact O-N 3.37Å; N362-K365 VanDerWaalsContact CA-CE 3.5Å; N362-K365 PolarHBondContact O-N 3.26Å; N362-K365 WeakPolarHBondContact OD1-CE 3.15Å; N362-K365 PolarHBondContact OD1-NZ 3.02Å; L363-K365 VanDerWaalsContact C-N 3.32Å; L363-K365 PolarHBondContact O-N 3.37Å; K365-Q368 PolarHBondContact O-N 3.2Å; K365-L369 PolarHBondContact O-N 2.67Å; K365-L369 VanDerWaalsContact O-N 3.08Å
366	A	94.6	Very high	90.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.9	-45.3	175.4	0	0	0	0	0	111.9	L275 V279 N362 L363 Q368 L369 L370	L275-A366 HydrophobicContact CD2-CB 4.15Å; L275-A366 HydrophobicContact CG-CB 4.26Å; V279-A366 HydrophobicContact CG2-CB 3.85Å; N362-A366 PolarHBondContact O-N 3.47Å; L363-A366 PolarHBondContact O-N 2.95Å; A366-Q368 VanDerWaalsContact C-N 3.33Å; A366-Q368 PolarHBondContact O-N 3.28Å; A366-L369 WeakPolarHBondContact O-CB 3.15Å; A366-L369 PolarHBondContact O-N 3.43Å; A366-L370 WeakPolarHBondContact O-CB 3.31Å; A366-L370 VanDerWaalsContact O-CG 3.29Å; A366-L370 WeakPolarHBondContact O-CG 3.06Å; A366-L370 PolarHBondContact O-N 3.01Å
367	C	95.1	Very high	90.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-37.3	176.2	-73.5	0	0	0	0	112.8	L363 A364 L369 L370 K371 L390 C393 I394	L363-C367 WeakPolarHBondContact O-CB 3.35Å; L363-C367 PolarHBondContact O-N 2.91Å; L363-C367 PolarHBondContact O-SG 3.45Å; L363-C367 VanDerWaalsContact O-SG 3.4Å; A364-C367 PolarHBondContact O-N 3.41Å; C367-L369 VanDerWaalsContact C-N 3.3Å; C367-L369 PolarHBondContact O-N 3.36Å; C367-L370 PolarHBondContact O-N 3.08Å; C367-K371 PolarHBondContact O-N 3.24Å; C367-L390 HydrophobicContact CB-CD2 4.25Å; C367-C393 HydrophobicContact CB-CB 3.58Å; C367-C393 WeakPolarHBondContact CB-SG 3.4Å; C367-C393 WeakPolarHBondContact SG-CB 3.42Å; C367-C393 CovalentContact SG-SG 2.01Å; C367-C393 PolarHBondContact SG-SG 3.05Å; C367-I394 HydrophobicContact CB-CG1 3.91Å
368	Q	93.6	Very high	90.7	Very high	100 Å²	100	31.8 Å²	31.8	47%	0.467	17%	0.169	S	C	.	.	H	α-helix	trans	-60.7	-41.5	174	-178.5	65	26.7	0	0	111.3	A364 K365 A366 I394	A364-Q368 WeakPolarHBondContact O-CB 3.49Å; A364-Q368 PolarHBondContact O-N 2.79Å; K365-Q368 PolarHBondContact O-N 3.2Å; A366-Q368 VanDerWaalsContact C-N 3.33Å; A366-Q368 PolarHBondContact O-N 3.28Å; Q368-I394 HydrophobicContact CB-CG1 4.2Å; Q368-I394 VanDerWaalsContact OE1-CG2 3.28Å
369	L	92.4	Very high	90.9	Very high	18 Å²	18	32.5 Å²	32.5	9%	0.094	17%	0.174	C	C	.	.	H	α-helix	trans	-67.2	-41.3	175.5	-178.6	73.5	0	0	0	112.3	L236 Y237 L275 T295 A297 L300 K365 A366 C367	L236-L369 HydrophobicContact CD1-CD2 3.94Å; Y237-L369 HydrophobicContact CE1-CD1 4.3Å; Y237-L369 WeakPolarHBondContact OH-CD1 3.25Å; L275-L369 HydrophobicContact CD2-CD2 4.14Å; T295-L369 HydrophobicContact CG2-CB 4.38Å; T295-L369 HydrophobicContact CG2-CD2 4.17Å; A297-L369 HydrophobicContact CB-CD1 4.27Å; L300-L369 HydrophobicContact CD1-CD2 3.23Å; K365-L369 PolarHBondContact O-N 2.67Å; K365-L369 VanDerWaalsContact O-N 3.08Å; A366-L369 WeakPolarHBondContact O-CB 3.15Å; A366-L369 PolarHBondContact O-N 3.43Å; C367-L369 VanDerWaalsContact C-N 3.3Å; C367-L369 PolarHBondContact O-N 3.36Å
370	L	93.1	Very high	91	Very high	4 Å²	4	34 Å²	34	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-76	-20	-177.2	-70.9	176.7	0	0	0	113.7	A272 L275 L276 A366 C367 D372 Y373 L374 L390	A272-L370 HydrophobicContact CB-CD1 4Å; A272-L370 HydrophobicContact CB-CD2 3.64Å; A272-L370 HydrophobicContact CB-CG 4.44Å; L275-L370 HydrophobicContact CD2-CD1 4.14Å; L275-L370 HydrophobicContact CD2-CD2 4.03Å; L275-L370 HydrophobicContact CD2-CG 3.97Å; L276-L370 HydrophobicContact CD2-CD1 4.22Å; L276-L370 HydrophobicContact CG-CD1 4.36Å; A366-L370 WeakPolarHBondContact O-CB 3.31Å; A366-L370 VanDerWaalsContact O-CG 3.29Å; A366-L370 WeakPolarHBondContact O-CG 3.06Å; A366-L370 PolarHBondContact O-N 3.01Å; C367-L370 PolarHBondContact O-N 3.08Å; L370-D372 PolarHBondContact O-N 3.48Å; L370-Y373 HydrophobicContact CD2-CD1 4.13Å; L370-Y373 WeakPolarHBondContact O-CB 3.44Å; L370-Y373 PolarHBondContact O-N 2.98Å; L370-L374 HydrophobicContact CB-CD1 4.03Å; L370-L374 HydrophobicContact CB-CG 4.37Å; L370-L374 HydrophobicContact CD1-CD1 4.48Å; L370-L374 WeakPolarHBondContact O-CB 3.34Å; L370-L374 PolarHBondContact O-N 3.03Å; L370-L390 HydrophobicContact CB-CD2 4.49Å
371	K	92.7	Very high	91.2	Very high	37 Å²	37	37 Å²	37	16%	0.161	20%	0.204	C	C	.	.	H	α-helix	trans	-51.6	-63.4	-173.1	-170.5	-171.9	70.8	169.7	0	113	C367 Y373 L375 Y391 I394	C367-K371 PolarHBondContact O-N 3.24Å; K371-Y373 VanDerWaalsContact C-N 3.26Å; K371-Y373 PolarHBondContact O-N 3.4Å; K371-L375 HydrophobicContact CG-CD1 3.84Å; K371-L375 WeakPolarHBondContact O-CB 3.47Å; K371-L375 WeakPolarHBondContact O-CG 3.46Å; K371-L375 PolarHBondContact O-N 3.26Å; K371-Y391 HydrophobicContact CD-CE1 4.14Å; K371-I394 HydrophobicContact CB-CD1 4.2Å; K371-I394 HydrophobicContact CD-CD1 3.86Å; K371-I394 HydrophobicContact CG-CD1 4.28Å
372	D	87.4	Confident	91.2	Very high	87 Å²	87	37.3 Å²	37.3	47%	0.465	21%	0.205	S	C	.	.	H	α-helix	trans	-71.8	-27.3	-177.3	-64.1	-19.8	0	0	0	111.5	L370 R376	L370-D372 PolarHBondContact O-N 3.48Å; D372-R376 WeakPolarHBondContact O-CB 3.41Å
373	Y	88.9	Confident	91.3	Very high	10 Å²	10	44.2 Å²	44.2	4%	0.039	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-44.4	179.5	-176.6	-106.7	0	0	0	112.2	Y237 T262 K268 I271 L370 K371	Y237-Y373 AromaticContact CD1-CD2 3.64Å; Y237-Y373 HydrophobicContact CD1-CD2 3.64Å; Y237-Y373 HydrophobicContact CD1-CE2 4.17Å; Y237-Y373 HydrophobicContact CD1-CG 4.45Å; Y237-Y373 HydrophobicContact CE1-CD2 4.22Å; T262-Y373 HydrophobicContact CG2-CD2 4.46Å; T262-Y373 HydrophobicContact CG2-CE2 4.16Å; K268-Y373 HydrophobicContact CB-CD1 4.21Å; K268-Y373 HydrophobicContact CB-CE1 3.5Å; K268-Y373 VanDerWaalsContact CB-CE1 3.5Å; K268-Y373 HydrophobicContact CD-CE1 4.25Å; K268-Y373 HydrophobicContact CD-CE2 4.27Å; K268-Y373 WeakPolarHBondContact CD-O 3.31Å; K268-Y373 HydrophobicContact CG-CE1 3.91Å; K268-Y373 HydrophobicContact CG-CE2 4.26Å; I271-Y373 WeakPolarHBondContact CD1-OH 3.08Å; L370-Y373 HydrophobicContact CD2-CD1 4.13Å; L370-Y373 WeakPolarHBondContact O-CB 3.44Å; L370-Y373 PolarHBondContact O-N 2.98Å; K371-Y373 VanDerWaalsContact C-N 3.26Å; K371-Y373 PolarHBondContact O-N 3.4Å
374	L	91.9	Very high	91.3	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-87	-37.6	-177.6	-71.2	178.2	0	0	0	113.5	W265 K268 A272 L370 R376 L386 L418	W265-L374 PolarHBondContact NE1-O 3.46Å; K268-L374 HydrophobicContact CB-CD2 4.37Å; A272-L374 HydrophobicContact CB-CD1 3.97Å; A272-L374 HydrophobicContact CB-CD2 3.81Å; A272-L374 HydrophobicContact CB-CG 4.22Å; L370-L374 HydrophobicContact CB-CD1 4.03Å; L370-L374 HydrophobicContact CB-CG 4.37Å; L370-L374 HydrophobicContact CD1-CD1 4.48Å; L370-L374 WeakPolarHBondContact O-CB 3.34Å; L370-L374 PolarHBondContact O-N 3.03Å; L374-R376 VanDerWaalsContact C-N 3.27Å; L374-R376 PolarHBondContact O-N 2.92Å; L374-L386 HydrophobicContact CB-CD2 4.17Å; L374-L386 HydrophobicContact CD1-CD1 4.47Å; L374-L418 HydrophobicContact CD1-CD1 4.22Å; L374-L418 HydrophobicContact CD1-CD2 4.29Å; L374-L418 HydrophobicContact CD2-CD2 4.43Å
375	L	91.4	Very high	91.3	Very high	33 Å²	33	55.7 Å²	55.7	17%	0.173	28%	0.284	C	S	.	.	H	α-helix	trans	-67.4	-30	-178.4	-68.7	178	0	0	0	112.4	K371 G377 A378 L386 E387 L390	K371-L375 HydrophobicContact CG-CD1 3.84Å; K371-L375 WeakPolarHBondContact O-CB 3.47Å; K371-L375 WeakPolarHBondContact O-CG 3.46Å; K371-L375 PolarHBondContact O-N 3.26Å; L375-G377 PolarHBondContact O-N 3.45Å; L375-A378 WeakPolarHBondContact O-CB 3.18Å; L375-A378 PolarHBondContact O-N 3.48Å; L375-L386 HydrophobicContact CD2-CD2 4.49Å; L375-L386 HydrophobicContact CD2-CG 4.37Å; L375-E387 HydrophobicContact CD1-CB 4.5Å; L375-E387 HydrophobicContact CD1-CG 4.19Å; L375-E387 HydrophobicContact CD2-CB 3.76Å; L375-E387 HydrophobicContact CD2-CG 4.33Å; L375-L390 HydrophobicContact CD2-CD1 4.19Å; L375-L390 HydrophobicContact CG-CD1 4.17Å
376	R	86.3	Confident	91.4	Very high	126 Å²	126	55.1 Å²	55.1	48%	0.475	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	113.1	177.4	-174.5	-177.2	-72.1	-97.5	4.8	111.2	K268 D372 L374	K268-R376 PolarHBondContact NZ-O 2.86Å; D372-R376 WeakPolarHBondContact O-CB 3.41Å; L374-R376 VanDerWaalsContact C-N 3.27Å; L374-R376 PolarHBondContact O-N 2.92Å
377	G	84.8	Confident	91.4	Very high	59 Å²	59	58.6 Å²	58.6	61%	0.608	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	12	-177.2	0	0	0	0	0	113.2	W265 L375	W265-G377 WeakPolarHBondContact CB-O 3.39Å; W265-G377 VanDerWaalsContact CD1-O 3.25Å; L375-G377 PolarHBondContact O-N 3.45Å
378	A	90.4	Very high	91.4	Very high	16 Å²	16	64.8 Å²	64.8	13%	0.132	33%	0.325	C	S	.	.			trans	-62.7	134.7	174.6	0	0	0	0	0	111.5	W265 L375 R383	W265-A378 VanDerWaalsContact NE1-CA 3.35Å; L375-A378 WeakPolarHBondContact O-CB 3.18Å; L375-A378 PolarHBondContact O-N 3.48Å; A378-R383 HydrophobicContact CB-CB 4.19Å; A378-R383 HydrophobicContact CB-CG 4.1Å
379	P	91.1	Very high	91.4	Very high	29 Å²	29	61.4 Å²	61.4	19%	0.188	31%	0.309	C	S	.	.			trans	-54.4	138.3	169.1	-20.2	27.8	0	0	0	111.2	W265 E381 I382 R383 K421	W265-P379 HydrophobicContact CD2-CG 4.24Å; W265-P379 HydrophobicContact CE3-CG 4.04Å; W265-P379 HydrophobicContact CZ3-CG 4.34Å; P379-E381 VanDerWaalsContact CB-OE2 3.31Å; P379-E381 WeakPolarHBondContact CB-OE2 3.38Å; P379-E381 PolarHBondContact O-N 3.4Å; P379-E381 VanDerWaalsContact O-N 3.15Å; P379-I382 HydrophobicContact CB-CG1 4.21Å; P379-I382 HydrophobicContact CG-CD1 4.25Å; P379-I382 HydrophobicContact CG-CG1 4.31Å; P379-I382 PolarHBondContact O-N 2.88Å; P379-R383 PolarHBondContact O-N 2.93Å; P379-R383 VanDerWaalsContact O-N 3.14Å; P379-K421 HydrophobicContact CG-CD 4.37Å; P379-K421 HydrophobicContact CG-CG 4.4Å
380	S	89.7	Confident	91.5	Very high	97 Å²	97	60.6 Å²	60.6	68%	0.678	31%	0.305	S	S	*	.	H	α-helix	trans	-53.7	-36.5	-178.7	28.7	0	0	0	0	113	I382	S380-I382 VanDerWaalsContact C-N 3.28Å; S380-I382 PolarHBondContact O-N 2.85Å
381	E	89.9	Confident	91.6	Very high	130 Å²	130	65.7 Å²	65.7	61%	0.607	32%	0.324	S	S	*	.	H	α-helix	trans	-63.5	-30.1	-175.5	-49.4	78.4	-114	0	0	113.7	P379 K421	P379-E381 VanDerWaalsContact CB-OE2 3.31Å; P379-E381 WeakPolarHBondContact CB-OE2 3.38Å; P379-E381 PolarHBondContact O-N 3.4Å; P379-E381 VanDerWaalsContact O-N 3.15Å; E381-K421 IonicContact OE2-NZ 3.58Å; E381-K421 PolarHBondContact OE2-NZ 3.16Å
382	I	91.8	Very high	91.6	Very high	20 Å²	20	66.7 Å²	66.7	10%	0.103	34%	0.336	C	S	.	.	H	α-helix	trans	-114	-9.1	-174.8	62.5	168.5	0	0	0	113.1	W265 P379 S380 E384 E385 L386 L417 K421	W265-I382 HydrophobicContact CH2-CD1 3.17Å; W265-I382 HydrophobicContact CZ2-CD1 3.41Å; W265-I382 VanDerWaalsContact CZ2-CD1 3.41Å; W265-I382 HydrophobicContact CZ3-CD1 3.99Å; P379-I382 HydrophobicContact CB-CG1 4.21Å; P379-I382 HydrophobicContact CG-CD1 4.25Å; P379-I382 HydrophobicContact CG-CG1 4.31Å; P379-I382 PolarHBondContact O-N 2.88Å; S380-I382 VanDerWaalsContact C-N 3.28Å; S380-I382 PolarHBondContact O-N 2.85Å; I382-E384 VanDerWaalsContact C-N 3.35Å; I382-E384 PolarHBondContact O-N 3.31Å; I382-E385 PolarHBondContact O-N 3.29Å; I382-L386 WeakPolarHBondContact O-CB 3.39Å; I382-L386 PolarHBondContact O-N 3.09Å; I382-L417 HydrophobicContact CG2-CD1 4.35Å; I382-K421 HydrophobicContact CD1-CB 4.21Å; I382-K421 HydrophobicContact CD1-CD 4.42Å; I382-K421 HydrophobicContact CD1-CG 4Å
383	R	92.8	Very high	91.9	Very high	145 Å²	145	62.5 Å²	62.5	55%	0.547	31%	0.314	S	S	.	.	H	α-helix	trans	-58.3	-45.7	-170.5	-172.2	179.4	77	172.8	4.3	112.4	A378 P379 E387	A378-R383 HydrophobicContact CB-CB 4.19Å; A378-R383 HydrophobicContact CB-CG 4.1Å; P379-R383 PolarHBondContact O-N 2.93Å; P379-R383 VanDerWaalsContact O-N 3.14Å; R383-E387 VanDerWaalsContact O-CB 3.26Å; R383-E387 WeakPolarHBondContact O-CB 3.22Å; R383-E387 PolarHBondContact O-N 2.87Å
384	E	93.3	Very high	92.1	Very high	165 Å²	165	63.6 Å²	63.6	77%	0.771	32%	0.32	S	S	*	.	H	α-helix	trans	-66.9	-47.2	-178	-172.5	179.1	175.3	0	0	111.9	I382 E387 K388	I382-E384 VanDerWaalsContact C-N 3.35Å; I382-E384 PolarHBondContact O-N 3.31Å; E384-E387 PolarHBondContact O-N 2.81Å; E384-K388 PolarHBondContact O-N 2.88Å
385	E	93.5	Very high	92	Very high	80 Å²	80	67 Å²	67	37%	0.374	35%	0.348	S	S	.	.	H	α-helix	trans	-65	-42.7	177.8	-174.5	58	-150.1	0	0	111.3	I382 E387 K388 Q389 L417	I382-E385 PolarHBondContact O-N 3.29Å; E385-E387 PolarHBondContact O-N 3.3Å; E385-K388 PolarHBondContact O-N 3.03Å; E385-Q389 HydrophobicContact CG-CG 4.47Å; E385-Q389 VanDerWaalsContact O-CG 3.27Å; E385-Q389 WeakPolarHBondContact O-CG 3.39Å; E385-Q389 PolarHBondContact O-N 3.15Å; E385-Q389 PolarHBondContact OE1-NE2 3.46Å; E385-L417 HydrophobicContact CG-CD1 4.42Å; E385-L417 HydrophobicContact CG-CD2 4.16Å
386	L	94.5	Very high	91.9	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-44.3	177	179.6	60.6	0	0	0	111.7	W265 L374 L375 I382 Q389 L390 L414 L417 L418	W265-L386 HydrophobicContact CZ2-CD2 4.12Å; L374-L386 HydrophobicContact CB-CD2 4.17Å; L374-L386 HydrophobicContact CD1-CD1 4.47Å; L375-L386 HydrophobicContact CD2-CD2 4.49Å; L375-L386 HydrophobicContact CD2-CG 4.37Å; I382-L386 WeakPolarHBondContact O-CB 3.39Å; I382-L386 PolarHBondContact O-N 3.09Å; L386-Q389 PolarHBondContact O-N 3.44Å; L386-L390 HydrophobicContact CD1-CD1 3.93Å; L386-L390 HydrophobicContact CD1-CG 4.18Å; L386-L390 HydrophobicContact CG-CD1 3.82Å; L386-L390 HydrophobicContact CG-CG 4.49Å; L386-L390 WeakPolarHBondContact O-CB 3.43Å; L386-L390 WeakPolarHBondContact O-CD1 3.35Å; L386-L390 VanDerWaalsContact O-CG 3.22Å; L386-L390 WeakPolarHBondContact O-CG 3.42Å; L386-L390 PolarHBondContact O-N 3.5Å; L386-L414 HydrophobicContact CD1-CD2 4.24Å; L386-L417 HydrophobicContact CB-CD2 4.04Å; L386-L417 HydrophobicContact CD1-CD2 4.18Å; L386-L418 HydrophobicContact CD1-CD2 4.2Å
387	E	95	Very high	91.5	Very high	73 Å²	73	67.2 Å²	67.2	34%	0.341	35%	0.352	S	S	.	.	H	α-helix	trans	-60.3	-47.3	176.9	-175.5	167.5	-168.1	0	0	111.4	L375 R383 E384 E385 Q389 L390 Y391	L375-E387 HydrophobicContact CD1-CB 4.5Å; L375-E387 HydrophobicContact CD1-CG 4.19Å; L375-E387 HydrophobicContact CD2-CB 3.76Å; L375-E387 HydrophobicContact CD2-CG 4.33Å; R383-E387 VanDerWaalsContact O-CB 3.26Å; R383-E387 WeakPolarHBondContact O-CB 3.22Å; R383-E387 PolarHBondContact O-N 2.87Å; E384-E387 PolarHBondContact O-N 2.81Å; E385-E387 PolarHBondContact O-N 3.3Å; E387-Q389 PolarHBondContact O-N 2.9Å; E387-L390 PolarHBondContact O-N 2.97Å; E387-Y391 HydrophobicContact CG-CD2 3.69Å; E387-Y391 HydrophobicContact CG-CE2 3.44Å; E387-Y391 VanDerWaalsContact CG-CE2 3.44Å; E387-Y391 WeakPolarHBondContact O-CD2 3.4Å; E387-Y391 PolarHBondContact O-N 2.94Å; E387-Y391 WeakPolarHBondContact OE1-CE2 3.4Å
388	K	94.5	Very high	90.7	Very high	130 Å²	130	66.9 Å²	66.9	57%	0.565	34%	0.338	S	S	*	.	H	α-helix	trans	-58.5	-49.8	176.9	-176.2	-177.1	176	-172.2	0	111.9	E384 E385 L390 Y391 S392	E384-K388 PolarHBondContact O-N 2.88Å; E385-K388 PolarHBondContact O-N 3.03Å; K388-L390 VanDerWaalsContact C-N 3.34Å; K388-L390 PolarHBondContact O-N 3.34Å; K388-Y391 PolarHBondContact O-N 3.44Å; K388-S392 PolarHBondContact O-N 3.33Å; K388-S392 PolarHBondContact O-OG 2.99Å
389	Q	93.7	Very high	89.3	Confident	28 Å²	28	70.7 Å²	70.7	13%	0.131	36%	0.36	C	S	.	.	H	α-helix	trans	-63.1	-39.7	179.7	-65.6	-64	-33.6	0	0	111.9	E385 L386 E387 S392 C393 L414	E385-Q389 HydrophobicContact CG-CG 4.47Å; E385-Q389 VanDerWaalsContact O-CG 3.27Å; E385-Q389 WeakPolarHBondContact O-CG 3.39Å; E385-Q389 PolarHBondContact O-N 3.15Å; E385-Q389 PolarHBondContact OE1-NE2 3.46Å; L386-Q389 PolarHBondContact O-N 3.44Å; E387-Q389 PolarHBondContact O-N 2.9Å; Q389-S392 PolarHBondContact O-N 3.3Å; Q389-C393 VanDerWaalsContact O-CB 3.27Å; Q389-C393 WeakPolarHBondContact O-CB 3.12Å; Q389-C393 PolarHBondContact O-N 2.93Å; Q389-L414 HydrophobicContact CB-CD2 3.53Å; Q389-L414 HydrophobicContact CB-CG 4.22Å
390	L	95.1	Very high	87.6	Confident	1 Å²	1	73.7 Å²	73.7	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-65	-42.5	176.6	-74.7	165.7	0	0	0	112.2	C367 L370 L375 L386 E387 K388 C393 I394 L414	C367-L390 HydrophobicContact CB-CD2 4.25Å; L370-L390 HydrophobicContact CB-CD2 4.49Å; L375-L390 HydrophobicContact CD2-CD1 4.19Å; L375-L390 HydrophobicContact CG-CD1 4.17Å; L386-L390 HydrophobicContact CD1-CD1 3.93Å; L386-L390 HydrophobicContact CD1-CG 4.18Å; L386-L390 HydrophobicContact CG-CD1 3.82Å; L386-L390 HydrophobicContact CG-CG 4.49Å; L386-L390 WeakPolarHBondContact O-CB 3.43Å; L386-L390 WeakPolarHBondContact O-CD1 3.35Å; L386-L390 VanDerWaalsContact O-CG 3.22Å; L386-L390 WeakPolarHBondContact O-CG 3.42Å; L386-L390 PolarHBondContact O-N 3.5Å; E387-L390 PolarHBondContact O-N 2.97Å; K388-L390 VanDerWaalsContact C-N 3.34Å; K388-L390 PolarHBondContact O-N 3.34Å; L390-C393 WeakPolarHBondContact O-CB 3.42Å; L390-C393 PolarHBondContact O-N 2.92Å; L390-I394 WeakPolarHBondContact O-CD1 3.29Å; L390-I394 WeakPolarHBondContact O-CG1 3.16Å; L390-I394 PolarHBondContact O-N 2.96Å; L390-L414 HydrophobicContact CD2-CD2 4.44Å; L390-L414 HydrophobicContact CG-CD2 4.44Å
391	Y	94.9	Very high	85.9	Confident	111 Å²	111	76.5 Å²	76.5	44%	0.435	40%	0.395	S	S	.	.	H	α-helix	trans	-66.4	-41.3	176	-80.9	-65	0	0	0	112.5	K371 E387 K388 C393 I394 A395	K371-Y391 HydrophobicContact CD-CE1 4.14Å; E387-Y391 HydrophobicContact CG-CD2 3.69Å; E387-Y391 HydrophobicContact CG-CE2 3.44Å; E387-Y391 VanDerWaalsContact CG-CE2 3.44Å; E387-Y391 WeakPolarHBondContact O-CD2 3.4Å; E387-Y391 PolarHBondContact O-N 2.94Å; E387-Y391 WeakPolarHBondContact OE1-CE2 3.4Å; K388-Y391 PolarHBondContact O-N 3.44Å; Y391-C393 VanDerWaalsContact C-N 3.28Å; Y391-C393 PolarHBondContact O-N 3.03Å; Y391-I394 PolarHBondContact O-N 3.43Å; Y391-A395 WeakPolarHBondContact O-CB 3.31Å; Y391-A395 PolarHBondContact O-N 3.33Å
392	S	92.6	Very high	84.2	Confident	58 Å²	58	76.7 Å²	76.7	41%	0.406	40%	0.395	S	S	.	.	H	α-helix	trans	-59.4	-41.5	172.4	-68.5	0	0	0	0	111.6	K388 Q389 A395	K388-S392 PolarHBondContact O-N 3.33Å; K388-S392 PolarHBondContact O-OG 2.99Å; Q389-S392 PolarHBondContact O-N 3.3Å; S392-A395 PolarHBondContact O-N 3.36Å
393	C	93.6	Very high	82.9	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-63.6	-44.3	176.4	-176.8	0	0	0	0	113.2	L363 A364 C367 Q389 L390 Y391 A395 L396 I410 L414	L363-C393 WeakPolarHBondContact CG-SG 3.08Å; L363-C393 PolarHBondContact O-SG 2.78Å; A364-C393 WeakPolarHBondContact CA-O 3.27Å; C367-C393 HydrophobicContact CB-CB 3.58Å; C367-C393 WeakPolarHBondContact CB-SG 3.4Å; C367-C393 WeakPolarHBondContact SG-CB 3.42Å; C367-C393 CovalentContact SG-SG 2.01Å; C367-C393 PolarHBondContact SG-SG 3.05Å; Q389-C393 VanDerWaalsContact O-CB 3.27Å; Q389-C393 WeakPolarHBondContact O-CB 3.12Å; Q389-C393 PolarHBondContact O-N 2.93Å; L390-C393 WeakPolarHBondContact O-CB 3.42Å; L390-C393 PolarHBondContact O-N 2.92Å; Y391-C393 VanDerWaalsContact C-N 3.28Å; Y391-C393 PolarHBondContact O-N 3.03Å; C393-A395 VanDerWaalsContact C-N 3.27Å; C393-A395 PolarHBondContact O-N 3.28Å; C393-L396 VanDerWaalsContact O-CB 3.31Å; C393-L396 WeakPolarHBondContact O-CB 3.19Å; C393-L396 WeakPolarHBondContact O-CG 3.26Å; C393-L396 PolarHBondContact O-N 2.99Å; C393-I410 HydrophobicContact CB-CG2 3.69Å; C393-L414 HydrophobicContact CB-CD1 4.16Å
394	I	93.1	Very high	81.8	Confident	32 Å²	32	77.6 Å²	77.6	16%	0.164	41%	0.406	C	S	.	.	H	α-helix	trans	-65.7	-32.5	178.5	-68.8	160.5	0	0	0	111.5	C367 Q368 K371 L390 Y391 L396	C367-I394 HydrophobicContact CB-CG1 3.91Å; Q368-I394 HydrophobicContact CB-CG1 4.2Å; Q368-I394 VanDerWaalsContact OE1-CG2 3.28Å; K371-I394 HydrophobicContact CB-CD1 4.2Å; K371-I394 HydrophobicContact CD-CD1 3.86Å; K371-I394 HydrophobicContact CG-CD1 4.28Å; L390-I394 WeakPolarHBondContact O-CD1 3.29Å; L390-I394 WeakPolarHBondContact O-CG1 3.16Å; L390-I394 PolarHBondContact O-N 2.96Å; Y391-I394 PolarHBondContact O-N 3.43Å; I394-L396 PolarHBondContact O-N 3.04Å
395	A	90.7	Very high	80.8	Confident	73 Å²	73	76.6 Å²	76.6	60%	0.603	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-6.6	179.7	0	0	0	0	0	113.9	Y391 S392 C393 K397	Y391-A395 WeakPolarHBondContact O-CB 3.31Å; Y391-A395 PolarHBondContact O-N 3.33Å; S392-A395 PolarHBondContact O-N 3.36Å; C393-A395 VanDerWaalsContact C-N 3.27Å; C393-A395 PolarHBondContact O-N 3.28Å; A395-K397 PolarHBondContact O-N 2.89Å
396	L	87.9	Confident	80.2	Confident	19 Å²	19	77.3 Å²	77.3	10%	0.099	41%	0.406	C	S	.	.			trans	-58.9	129.3	176.7	-72.9	173.2	0	0	0	110.9	P361 L363 A364 C393 I394 I410	P361-L396 WeakPolarHBondContact CD-O 3.03Å; P361-L396 HydrophobicContact CG-CB 3.91Å; L363-L396 HydrophobicContact CD2-CD1 3.96Å; L363-L396 HydrophobicContact CG-CD1 4.32Å; A364-L396 HydrophobicContact CB-CB 4.31Å; C393-L396 VanDerWaalsContact O-CB 3.31Å; C393-L396 WeakPolarHBondContact O-CB 3.19Å; C393-L396 WeakPolarHBondContact O-CG 3.26Å; C393-L396 PolarHBondContact O-N 2.99Å; I394-L396 PolarHBondContact O-N 3.04Å; L396-I410 HydrophobicContact CD1-CD1 3.94Å; L396-I410 HydrophobicContact CD2-CD1 3.79Å; L396-I410 HydrophobicContact CG-CD1 4.01Å
397	K	79.9	Confident	79.6	Confident	145 Å²	145	77.8 Å²	77.8	63%	0.63	41%	0.408	S	S	*	.			trans	-122.1	153.9	175.7	-70	-174.9	178.7	-176.8	0	109.8	A395 T399	A395-K397 PolarHBondContact O-N 2.89Å; K397-T399 PolarHBondContact O-N 3.45Å
398	V	67.9	Low	79.2	Confident	53 Å²	53	76.2 Å²	76.2	32%	0.321	41%	0.406	S	S	.	.			trans	-79.1	103	178.3	-177.4	0	0	0	0	110.5	V358 I359 P361 M403	V358-V398 WeakPolarHBondContact O-CB 3.46Å; V358-V398 WeakPolarHBondContact O-CG2 3.38Å; I359-V398 PolarHBondContact O-N 3.37Å; P361-V398 HydrophobicContact CB-CG2 4.32Å; V398-M403 WeakPolarHBondContact CA-SD 3.43Å; V398-M403 HydrophobicContact CB-CE 4.42Å; V398-M403 HydrophobicContact CB-SD 3.97Å; V398-M403 HydrophobicContact CG1-CE 3.61Å; V398-M403 HydrophobicContact CG1-SD 3.75Å; V398-M403 HydrophobicContact CG2-SD 4.36Å
399	T	60.9	Low	78.9	Confident	95 Å²	95	74.9 Å²	74.9	58%	0.583	40%	0.404	S	S	*	.			trans	-134.3	128.6	171.6	52.9	0	0	0	0	113.2	K397 N401 M403	K397-T399 PolarHBondContact O-N 3.45Å; T399-N401 PolarHBondContact O-N 3.26Å; T399-M403 VanDerWaalsContact N-CE 3.32Å; T399-M403 PolarHBondContact N-SD 3.35Å; T399-M403 WeakPolarHBondContact O-CE 3.5Å; T399-M403 WeakPolarHBondContact O-CG 3.45Å
400	A	55.3	Low	78.8	Confident	92 Å²	92	74.5 Å²	74.5	76%	0.76	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-13.7	-151.9	0	0	0	0	0	120.5
401	N	52.3	Low	78.6	Confident	157 Å²	157	74.5 Å²	74.5	84%	0.84	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	-11.5	-164.4	-76.3	-4	0	0	0	117.9	T399	T399-N401 PolarHBondContact O-N 3.26Å
402	Q	55.7	Low	78.5	Confident	134 Å²	134	72.6 Å²	72.6	63%	0.626	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.3	-0.8	-179	-76.7	175.6	-33.9	0	0	114.2	E406	Q402-E406 PolarHBondContact O-N 3.13Å
403	M	64.8	Low	78.5	Confident	50 Å²	50	73 Å²	73	25%	0.246	40%	0.398	C	S	.	.	H	α-helix	trans	-69.1	-44.3	-168.2	-85.7	-172	-72.2	0	0	116.2	V398 T399 M405 E406 H407	V398-M403 WeakPolarHBondContact CA-SD 3.43Å; V398-M403 HydrophobicContact CB-CE 4.42Å; V398-M403 HydrophobicContact CB-SD 3.97Å; V398-M403 HydrophobicContact CG1-CE 3.61Å; V398-M403 HydrophobicContact CG1-SD 3.75Å; V398-M403 HydrophobicContact CG2-SD 4.36Å; T399-M403 VanDerWaalsContact N-CE 3.32Å; T399-M403 PolarHBondContact N-SD 3.35Å; T399-M403 WeakPolarHBondContact O-CE 3.5Å; T399-M403 WeakPolarHBondContact O-CG 3.45Å; M403-M405 PolarHBondContact O-N 3.4Å; M403-E406 PolarHBondContact O-N 2.99Å; M403-H407 WeakPolarHBondContact O-CB 3.04Å; M403-H407 PolarHBondContact O-N 3.24Å
404	E	69.1	Low	78.6	Confident	134 Å²	134	73.2 Å²	73.2	63%	0.626	40%	0.399	S	S	*	.	H	α-helix	trans	-64	-35.1	-171	-68.5	-177.8	172.7	0	0	111.3	S408	E404-S408 VanDerWaalsContact O-CB 3.28Å; E404-S408 WeakPolarHBondContact O-CB 3.48Å; E404-S408 PolarHBondContact O-N 2.91Å; E404-S408 PolarHBondContact O-OG 3.35Å
405	M	72.4	Confident	78.6	Confident	143 Å²	143	73.3 Å²	73.3	70%	0.704	40%	0.398	S	S	*	.	H	α-helix	trans	-69.5	-46.5	174.4	-67.6	-168.8	-66.7	0	0	112	M403 S408 L409	M403-M405 PolarHBondContact O-N 3.4Å; M405-S408 PolarHBondContact O-N 3.3Å; M405-L409 VanDerWaalsContact O-CB 3.25Å; M405-L409 WeakPolarHBondContact O-CB 3.49Å; M405-L409 PolarHBondContact O-N 3.48Å
406	E	79.9	Confident	78.7	Confident	96 Å²	96	74.1 Å²	74.1	45%	0.449	40%	0.396	S	S	.	.	H	α-helix	trans	-65.3	-42	178.9	-72	-172.5	170.1	0	0	112.2	Q402 M403 L409 I410	Q402-E406 PolarHBondContact O-N 3.13Å; M403-E406 PolarHBondContact O-N 2.99Å; E406-L409 PolarHBondContact O-N 3.17Å; E406-I410 WeakPolarHBondContact O-CB 3.18Å; E406-I410 WeakPolarHBondContact O-CG1 3.02Å; E406-I410 PolarHBondContact O-N 3.49Å
407	H	82.9	Confident	78.9	Confident	9 Å²	9	74.8 Å²	74.8	4%	0.042	40%	0.399	C	S	.	.	H	α-helix	trans	-57.1	-53.5	174.6	-179.3	-94	0	0	0	110.8	F283 H284 L363 M403 L409 I410 L411	F283-H407 AromaticContact CD1-CE1 3.98Å; H284-H407 AromaticContact NE2-ND1 3.8Å; L363-H407 WeakPolarHBondContact CB-NE2 3.31Å; L363-H407 VanDerWaalsContact CD2-CD2 3.44Å; L363-H407 WeakPolarHBondContact CD2-CD2 3.39Å; M403-H407 WeakPolarHBondContact O-CB 3.04Å; M403-H407 PolarHBondContact O-N 3.24Å; H407-L409 VanDerWaalsContact C-N 3.32Å; H407-L409 PolarHBondContact O-N 3.15Å; H407-I410 PolarHBondContact O-N 3.1Å; H407-L411 WeakPolarHBondContact O-CB 3.46Å; H407-L411 PolarHBondContact O-N 3.41Å
408	S	85.6	Confident	79.6	Confident	40 Å²	40	67.9 Å²	67.9	28%	0.28	37%	0.369	S	S	.	.	H	α-helix	trans	-62.8	-38.8	179.7	-58.4	0	0	0	0	112.1	E404 M405 N412	E404-S408 VanDerWaalsContact O-CB 3.28Å; E404-S408 WeakPolarHBondContact O-CB 3.48Å; E404-S408 PolarHBondContact O-N 2.91Å; E404-S408 PolarHBondContact O-OG 3.35Å; M405-S408 PolarHBondContact O-N 3.3Å; S408-N412 VanDerWaalsContact O-CB 3.26Å; S408-N412 WeakPolarHBondContact O-CB 3.35Å; S408-N412 VanDerWaalsContact O-CG 3.25Å; S408-N412 PolarHBondContact O-N 3.01Å; S408-N412 PolarHBondContact O-ND2 3.06Å
409	L	89.2	Confident	80.6	Confident	102 Å²	102	73 Å²	73	53%	0.534	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-51.2	179.1	179.8	64.1	0	0	0	111.7	M405 E406 H407 N412 N413	M405-L409 VanDerWaalsContact O-CB 3.25Å; M405-L409 WeakPolarHBondContact O-CB 3.49Å; M405-L409 PolarHBondContact O-N 3.48Å; E406-L409 PolarHBondContact O-N 3.17Å; H407-L409 VanDerWaalsContact C-N 3.32Å; H407-L409 PolarHBondContact O-N 3.15Å; L409-N412 PolarHBondContact O-N 3.47Å; L409-N413 WeakPolarHBondContact O-CB 3.35Å; L409-N413 PolarHBondContact O-N 2.78Å; L409-N413 PolarHBondContact O-ND2 3Å
410	I	90.6	Very high	82	Confident	20 Å²	20	74.8 Å²	74.8	10%	0.103	38%	0.382	C	S	.	.	H	α-helix	trans	-63.7	-44.5	-179.8	-70.9	167.5	0	0	0	110.4	L363 C393 L396 E406 H407 N412 N413 L414	L363-I410 HydrophobicContact CD2-CG2 4.41Å; C393-I410 HydrophobicContact CB-CG2 3.69Å; L396-I410 HydrophobicContact CD1-CD1 3.94Å; L396-I410 HydrophobicContact CD2-CD1 3.79Å; L396-I410 HydrophobicContact CG-CD1 4.01Å; E406-I410 WeakPolarHBondContact O-CB 3.18Å; E406-I410 WeakPolarHBondContact O-CG1 3.02Å; E406-I410 PolarHBondContact O-N 3.49Å; H407-I410 PolarHBondContact O-N 3.1Å; I410-N412 PolarHBondContact O-N 2.96Å; I410-N413 PolarHBondContact O-N 3.37Å; I410-L414 HydrophobicContact CG2-CD1 3.9Å; I410-L414 HydrophobicContact CG2-CG 4.42Å; I410-L414 WeakPolarHBondContact O-CB 3.32Å; I410-L414 WeakPolarHBondContact O-CG 3.31Å; I410-L414 PolarHBondContact O-N 3.16Å
411	L	91.6	Very high	83.4	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-56.2	-51.3	176.8	-177	72.8	0	0	0	111.4	L276 E280 L363 H407 L414 K415	L276-L411 HydrophobicContact CB-CD1 3.73Å; L276-L411 HydrophobicContact CD2-CD1 3.95Å; L276-L411 HydrophobicContact CG-CD1 4.32Å; E280-L411 HydrophobicContact CB-CD2 3.9Å; E280-L411 HydrophobicContact CG-CD2 3.91Å; L363-L411 HydrophobicContact CD1-CD1 3.77Å; L363-L411 HydrophobicContact CD2-CB 4.01Å; L363-L411 HydrophobicContact CD2-CD1 4.45Å; H407-L411 WeakPolarHBondContact O-CB 3.46Å; H407-L411 PolarHBondContact O-N 3.41Å; L411-L414 PolarHBondContact O-N 2.92Å; L411-K415 WeakPolarHBondContact O-CG 3.44Å; L411-K415 PolarHBondContact O-N 2.04Å
412	N	92.2	Very high	85.1	Confident	70 Å²	70	66.8 Å²	66.8	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-67.8	-37.4	-178.8	-74.6	-34	0	0	0	112.7	S408 L409 I410 K415 T416	S408-N412 VanDerWaalsContact O-CB 3.26Å; S408-N412 WeakPolarHBondContact O-CB 3.35Å; S408-N412 VanDerWaalsContact O-CG 3.25Å; S408-N412 PolarHBondContact O-N 3.01Å; S408-N412 PolarHBondContact O-ND2 3.06Å; L409-N412 PolarHBondContact O-N 3.47Å; I410-N412 PolarHBondContact O-N 2.96Å; N412-K415 VanDerWaalsContact OD1-CE 3.25Å; N412-K415 WeakPolarHBondContact OD1-CE 3.37Å; N412-K415 PolarHBondContact OD1-NZ 2.77Å; N412-T416 VanDerWaalsContact O-CB 3.26Å; N412-T416 WeakPolarHBondContact O-CB 3.07Å; N412-T416 PolarHBondContact O-N 3.11Å; N412-T416 PolarHBondContact O-OG1 3.25Å
413	N	93.4	Very high	86.3	Confident	68 Å²	68	63.4 Å²	63.4	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-63.3	-45.5	174.9	-74.4	-17.6	0	0	0	111.6	L409 I410 T416 L417	L409-N413 WeakPolarHBondContact O-CB 3.35Å; L409-N413 PolarHBondContact O-N 2.78Å; L409-N413 PolarHBondContact O-ND2 3Å; I410-N413 PolarHBondContact O-N 3.37Å; N413-T416 PolarHBondContact O-N 3.4Å; N413-L417 VanDerWaalsContact O-CB 3.31Å; N413-L417 WeakPolarHBondContact O-CB 3.42Å; N413-L417 PolarHBondContact O-N 2.87Å
414	L	94.4	Very high	86.2	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.016	34%	0.337	C	S	.	.	H	α-helix	trans	-61.8	-49.9	176.3	-77.2	171.9	0	0	0	111.5	L276 L386 Q389 L390 C393 I410 L411 T416 L417 L418	L276-L414 HydrophobicContact CD1-CB 3.96Å; L386-L414 HydrophobicContact CD1-CD2 4.24Å; Q389-L414 HydrophobicContact CB-CD2 3.53Å; Q389-L414 HydrophobicContact CB-CG 4.22Å; L390-L414 HydrophobicContact CD2-CD2 4.44Å; L390-L414 HydrophobicContact CG-CD2 4.44Å; C393-L414 HydrophobicContact CB-CD1 4.16Å; I410-L414 HydrophobicContact CG2-CD1 3.9Å; I410-L414 HydrophobicContact CG2-CG 4.42Å; I410-L414 WeakPolarHBondContact O-CB 3.32Å; I410-L414 WeakPolarHBondContact O-CG 3.31Å; I410-L414 PolarHBondContact O-N 3.16Å; L411-L414 PolarHBondContact O-N 2.92Å; L414-T416 VanDerWaalsContact C-N 3.33Å; L414-T416 PolarHBondContact O-N 3.06Å; L414-L417 PolarHBondContact O-N 2.98Å; L414-L418 WeakPolarHBondContact O-CG 3.39Å; L414-L418 PolarHBondContact O-N 3.38Å
415	K	93.9	Very high	85.8	Confident	34 Å²	34	65.6 Å²	65.6	15%	0.148	32%	0.321	C	S	.	.	H	α-helix	trans	-56.4	-47.4	176.4	-73.8	-171.9	-58.8	-178.5	0	111.3	L276 E277 E280 L411 N412 L417 L418 W419	L276-K415 HydrophobicContact CB-CD 4.35Å; L276-K415 HydrophobicContact CB-CG 4Å; L276-K415 HydrophobicContact CD1-CG 3.99Å; E277-K415 HydrophobicContact CG-CD 4.24Å; E280-K415 IonicContact OE1-NZ 2.8Å; E280-K415 IonicContact OE2-NZ 3.09Å; E280-K415 PolarHBondContact OE2-NZ 2.78Å; L411-K415 WeakPolarHBondContact O-CG 3.44Å; L411-K415 PolarHBondContact O-N 2.04Å; N412-K415 VanDerWaalsContact OD1-CE 3.25Å; N412-K415 WeakPolarHBondContact OD1-CE 3.37Å; N412-K415 PolarHBondContact OD1-NZ 2.77Å; K415-L417 PolarHBondContact O-N 3.43Å; K415-L418 PolarHBondContact O-N 2.95Å; K415-W419 WeakPolarHBondContact O-CB 3.47Å; K415-W419 PolarHBondContact O-N 3.22Å
416	T	92.8	Very high	84.7	Confident	90 Å²	90	66.7 Å²	66.7	55%	0.552	33%	0.33	S	S	*	.	H	α-helix	trans	-64.2	-42	-179.3	-57	0	0	0	0	112	N412 N413 L414 K420	N412-T416 VanDerWaalsContact O-CB 3.26Å; N412-T416 WeakPolarHBondContact O-CB 3.07Å; N412-T416 PolarHBondContact O-N 3.11Å; N412-T416 PolarHBondContact O-OG1 3.25Å; N413-T416 PolarHBondContact O-N 3.4Å; L414-T416 VanDerWaalsContact C-N 3.33Å; L414-T416 PolarHBondContact O-N 3.06Å; T416-K420 WeakPolarHBondContact O-CB 3.3Å; T416-K420 PolarHBondContact O-N 2.77Å
417	L	92.6	Very high	83.1	Confident	33 Å²	33	67.7 Å²	67.7	17%	0.173	34%	0.339	C	S	.	.	H	α-helix	trans	-62.4	-45.8	178.4	-176.5	66.9	0	0	0	111.4	I382 E385 L386 N413 L414 K415 K421	I382-L417 HydrophobicContact CG2-CD1 4.35Å; E385-L417 HydrophobicContact CG-CD1 4.42Å; E385-L417 HydrophobicContact CG-CD2 4.16Å; L386-L417 HydrophobicContact CB-CD2 4.04Å; L386-L417 HydrophobicContact CD1-CD2 4.18Å; N413-L417 VanDerWaalsContact O-CB 3.31Å; N413-L417 WeakPolarHBondContact O-CB 3.42Å; N413-L417 PolarHBondContact O-N 2.87Å; L414-L417 PolarHBondContact O-N 2.98Å; K415-L417 PolarHBondContact O-N 3.43Å; L417-K421 PolarHBondContact O-N 2.85Å
418	L	93.3	Very high	81	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.005	39%	0.385	C	S	.	.	H	α-helix	trans	-67.1	-48.4	177.7	-65.3	176.5	0	0	0	111.2	W265 A269 A272 I273 L276 L374 L386 L414 K415 K420 K421 I422	W265-L418 HydrophobicContact CH2-CD2 4.04Å; W265-L418 HydrophobicContact CZ2-CD2 4.12Å; A269-L418 HydrophobicContact CB-CB 4.44Å; A269-L418 HydrophobicContact CB-CD2 4.08Å; A272-L418 HydrophobicContact CB-CD1 4.12Å; I273-L418 HydrophobicContact CD1-CB 3.76Å; I273-L418 HydrophobicContact CG1-CB 3.77Å; I273-L418 HydrophobicContact CG1-CD1 3.97Å; L276-L418 HydrophobicContact CD1-CD1 4.33Å; L374-L418 HydrophobicContact CD1-CD1 4.22Å; L374-L418 HydrophobicContact CD1-CD2 4.29Å; L374-L418 HydrophobicContact CD2-CD2 4.43Å; L386-L418 HydrophobicContact CD1-CD2 4.2Å; L414-L418 WeakPolarHBondContact O-CG 3.39Å; L414-L418 PolarHBondContact O-N 3.38Å; K415-L418 PolarHBondContact O-N 2.95Å; L418-K420 PolarHBondContact O-N 3.11Å; L418-K421 PolarHBondContact O-N 2.86Å; L418-I422 PolarHBondContact O-N 3.24Å; L418-I422 VanDerWaalsContact O-N 3.15Å
419	W	90.9	Very high	80.8	Confident	160 Å²	160	76 Å²	76	61%	0.606	39%	0.391	S	S	*	.	H	α-helix	trans	-58.4	-46.6	179.8	-173.5	-103.5	0	0	0	111.8	I273 K415 K421 I422 S423	I273-W419 HydrophobicContact CD1-CB 4.33Å; I273-W419 HydrophobicContact CD1-CE3 4.06Å; K415-W419 WeakPolarHBondContact O-CB 3.47Å; K415-W419 PolarHBondContact O-N 3.22Å; W419-K421 PolarHBondContact O-N 3.47Å; W419-K421 VanDerWaalsContact O-N 3.15Å; W419-I422 HydrophobicContact CE3-CD1 3.76Å; W419-I422 HydrophobicContact CE3-CG1 4.2Å; W419-I422 HydrophobicContact CZ3-CD1 4.07Å; W419-I422 WeakPolarHBondContact O-CG1 3Å; W419-I422 PolarHBondContact O-N 3.41Å; W419-S423 WeakPolarHBondContact O-CB 3.44Å; W419-S423 PolarHBondContact O-N 2.77Å; W419-S423 PolarHBondContact O-OG 2.03Å
420	K	88.7	Confident	80.3	Confident	132 Å²	132	74.6 Å²	74.6	57%	0.574	38%	0.383	S	S	*	.	H	α-helix	trans	-57.9	-29.9	177.2	-175.6	179	179.6	-177.5	0	112	T416 L418 S423 Y424	T416-K420 WeakPolarHBondContact O-CB 3.3Å; T416-K420 PolarHBondContact O-N 2.77Å; L418-K420 PolarHBondContact O-N 3.11Å; K420-S423 PolarHBondContact O-OG 3.36Å; K420-Y424 HydrophobicContact CG-CE2 4.05Å; K420-Y424 WeakPolarHBondContact O-CD2 3.38Å; K420-Y424 WeakPolarHBondContact O-CE2 3.45Å
421	K	86.1	Confident	79.8	Confident	64 Å²	64	77.6 Å²	77.6	28%	0.278	40%	0.399	S	S	.	.	H	α-helix	trans	-82	-38.2	178.6	-170	68.5	-168.5	-169.2	0	112.3	W265 P379 E381 I382 L417 L418 W419	W265-K421 HydrophobicContact CE3-CG 4.38Å; W265-K421 HydrophobicContact CH2-CB 4.12Å; W265-K421 HydrophobicContact CH2-CG 4Å; W265-K421 HydrophobicContact CZ3-CB 3.9Å; W265-K421 HydrophobicContact CZ3-CG 3.47Å; W265-K421 VanDerWaalsContact CZ3-CG 3.47Å; P379-K421 HydrophobicContact CG-CD 4.37Å; P379-K421 HydrophobicContact CG-CG 4.4Å; E381-K421 IonicContact OE2-NZ 3.58Å; E381-K421 PolarHBondContact OE2-NZ 3.16Å; I382-K421 HydrophobicContact CD1-CB 4.21Å; I382-K421 HydrophobicContact CD1-CD 4.42Å; I382-K421 HydrophobicContact CD1-CG 4Å; L417-K421 PolarHBondContact O-N 2.85Å; L418-K421 PolarHBondContact O-N 2.86Å; W419-K421 PolarHBondContact O-N 3.47Å; W419-K421 VanDerWaalsContact O-N 3.15Å
422	I	88	Confident	79.1	Confident	18 Å²	18	82.1 Å²	82.1	9%	0.092	42%	0.421	C	S	.	.	H	α-helix	trans	-80.1	-25.7	-177.8	64.5	175.5	0	0	0	113.3	P266 A269 K270 I273 L418 W419 Y424 T425	P266-I422 HydrophobicContact CB-CG2 4.16Å; A269-I422 HydrophobicContact CB-CG2 3.65Å; K270-I422 HydrophobicContact CB-CD1 4.46Å; I273-I422 HydrophobicContact CD1-CD1 3.6Å; L418-I422 PolarHBondContact O-N 3.24Å; L418-I422 VanDerWaalsContact O-N 3.15Å; W419-I422 HydrophobicContact CE3-CD1 3.76Å; W419-I422 HydrophobicContact CE3-CG1 4.2Å; W419-I422 HydrophobicContact CZ3-CD1 4.07Å; W419-I422 WeakPolarHBondContact O-CG1 3Å; W419-I422 PolarHBondContact O-N 3.41Å; I422-Y424 PolarHBondContact O-N 3.1Å; I422-T425 WeakPolarHBondContact CA-OG1 3.38Å; I422-T425 PolarHBondContact O-N 2.76Å; I422-T425 VanDerWaalsContact O-N 3.14Å; I422-T425 PolarHBondContact O-OG1 2.95Å
423	S	79.1	Confident	78.2	Confident	62 Å²	62	82.8 Å²	82.8	43%	0.434	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-19.4	180	64.6	0	0	0	0	114.2	W419 K420	W419-S423 WeakPolarHBondContact O-CB 3.44Å; W419-S423 PolarHBondContact O-N 2.77Å; W419-S423 PolarHBondContact O-OG 2.03Å; K420-S423 PolarHBondContact O-OG 3.36Å
424	Y	62.8	Low	77.2	Confident	182 Å²	182	83.8 Å²	83.8	71%	0.714	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-4.3	175.3	-63.8	-75.6	0	0	0	113.9	K420 I422	K420-Y424 HydrophobicContact CG-CE2 4.05Å; K420-Y424 WeakPolarHBondContact O-CD2 3.38Å; K420-Y424 WeakPolarHBondContact O-CE2 3.45Å; I422-Y424 PolarHBondContact O-N 3.1Å
425	T	61.1	Low	76	Confident	48 Å²	48	89.6 Å²	89.6	29%	0.294	46%	0.458	S	S	.	.	S	Bend	trans	-99.6	121.9	174.4	38	0	0	0	0	108.9	P266 I422 D427	P266-T425 HydrophobicContact CG-CG2 4.49Å; I422-T425 WeakPolarHBondContact CA-OG1 3.38Å; I422-T425 PolarHBondContact O-N 2.76Å; I422-T425 VanDerWaalsContact O-N 3.14Å; I422-T425 PolarHBondContact O-OG1 2.95Å; T425-D427 PolarHBondContact O-N 2.65Å
426	N	48.9	Very low	74.6	Confident	166 Å²	166	93.8 Å²	93.8	89%	0.888	48%	0.482	S	S	*	.	S	Bend	trans	-64.9	21.5	179.9	-76.9	-15.3	0	0	0	114.9
427	D	46.8	Very low	73.1	Confident	118 Å²	118	94.2 Å²	94.2	63%	0.631	48%	0.476	S	S	*	.			trans	-106	22	-177.7	-70.7	-23.7	0	0	0	112	T425	T425-D427 PolarHBondContact O-N 2.65Å
428	S	39.2	Very low	71.3	Confident	146 Å²	146	99.7 Å²	99.7	100%	1.021	50%	0.503	S	S	*	.			trans	-74.2	0	177.3	60.6	0	0	0	0	113.1

Retrieved 428 of 428 residues in 76.3 ms (Link to these results)

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