A0A061I4W1_CRIGR Loading...

Zinc finger protein 26

AlphaFold DB , UniProt , Accession A0A061I4W1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Znf26, Length 540 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	34.9	Very low	33.9	Very low	236 Å²	236	162.7 Å²	162.7	100%	1.163	86%	0.855	S	S	*	*				0	71	0	-65.5	177.6	163.5	0	0	105.9
2	E	32	Very low	34.7	Very low	201 Å²	201	154.8 Å²	154.8	94%	0.939	84%	0.842	S	S	*	*				39.1	101.6	71.6	-80.2	-170	169.2	0	0	111.9
3	A	27.9	Very low	36.4	Very low	99 Å²	99	152.3 Å²	152.3	82%	0.818	83%	0.827	S	S	*	*			trans	-135.7	108.7	161.8	0	0	0	0	0	107
4	E	36.7	Very low	38.1	Very low	175 Å²	175	148.1 Å²	148.1	82%	0.818	80%	0.803	S	S	*	*			trans	-57.7	167.6	162.4	-81.3	-143.8	155.5	0	0	111.8
5	P	36.3	Very low	40.2	Very low	113 Å²	113	141.1 Å²	141.1	73%	0.734	77%	0.769	S	S	*	*				-135.6	125.3	121.7	32.5	-17.8	0	0	0	115.1
6	R	30.5	Very low	42.1	Very low	228 Å²	228	132.9 Å²	132.9	86%	0.86	72%	0.724	S	S	*	*				72.5	104.6	121.1	-65.3	-178.9	177.6	-179.8	-1	118
7	S	33.3	Very low	43.9	Very low	121 Å²	121	134.2 Å²	134.2	85%	0.846	72%	0.721	S	S	*	*			trans	-48.7	131	153.2	56	0	0	0	0	113.8
8	A	31	Very low	45.4	Very low	98 Å²	98	132.7 Å²	132.7	81%	0.81	71%	0.712	S	S	*	*			trans	-104.6	131.4	155.8	0	0	0	0	0	109.1
9	S	32.8	Very low	46.7	Very low	114 Å²	114	128 Å²	128	80%	0.797	69%	0.689	S	S	*	*			trans	-68.8	139.2	-174.3	65.7	0	0	0	0	113.2
10	F	39.6	Very low	48.1	Very low	155 Å²	155	122.3 Å²	122.3	68%	0.68	66%	0.659	S	S	*	*			trans	-46	134.5	167.5	-92.1	-107	0	0	0	113.3	L13	F10-L13 HydrophobicContact CD1-CG 4.24Å; F10-L13 HydrophobicContact CE1-CD2 4.21Å; F10-L13 HydrophobicContact CE1-CG 4.25Å
11	R	38.4	Very low	49.1	Very low	250 Å²	250	121.2 Å²	121.2	94%	0.943	66%	0.657	S	S	*	*			trans	-131.3	114.7	156.8	-105.9	-176.1	-167	-138.6	2.2	109.4
12	G	43.2	Very low	50.7	Low	68 Å²	68	116 Å²	116	70%	0.701	63%	0.629	S	S	*	*			trans	85.9	87.7	169.8	0	0	0	0	0	115	L14	G12-L14 PolarHBondContact O-N 3.02Å
13	L	57.1	Low	52.3	Low	122 Å²	122	109.1 Å²	109.1	64%	0.639	60%	0.599	S	S	*	*			trans	-70.3	96.6	164.3	-90	152.7	0	0	0	108.2	F10 S15	F10-L13 HydrophobicContact CD1-CG 4.24Å; F10-L13 HydrophobicContact CE1-CD2 4.21Å; F10-L13 HydrophobicContact CE1-CG 4.25Å; L13-S15 PolarHBondContact O-N 2.88Å
14	L	59.3	Low	53.9	Low	94 Å²	94	106.8 Å²	106.8	49%	0.492	58%	0.576	S	S	.	*			trans	-56.8	117.3	166.4	-82.4	157	0	0	0	108.4	G12 D18 V19 L50	G12-L14 PolarHBondContact O-N 3.02Å; L14-D18 HydrophobicContact CD2-CB 4.4Å; L14-V19 HydrophobicContact CD2-CG1 4.32Å; L14-L50 HydrophobicContact CB-CD2 3.78Å
15	S	69.9	Low	54.5	Low	42 Å²	42	101.1 Å²	101.1	29%	0.294	56%	0.556	S	S	.	*			trans	-88.9	158.3	175.1	81.3	0	0	0	0	110.1	L13 K17 D18	L13-S15 PolarHBondContact O-N 2.88Å; S15-K17 PolarHBondContact O-N 3.42Å; S15-D18 WeakPolarHBondContact CA-OD2 3.16Å; S15-D18 VanDerWaalsContact CB-OD2 3.29Å; S15-D18 WeakPolarHBondContact CB-OD2 3.5Å; S15-D18 PolarHBondContact N-OD2 2.97Å; S15-D18 WeakPolarHBondContact O-CB 3.44Å; S15-D18 PolarHBondContact O-N 3.14Å; S15-D18 VanDerWaalsContact OG-CG 3.25Å; S15-D18 PolarHBondContact OG-OD2 3.21Å
16	F	71.1	Confident	55.5	Low	11 Å²	11	103.1 Å²	103.1	5%	0.048	56%	0.555	C	S	.	*	G	3₁₀ helix	trans	-57.3	-33.4	176.8	-179.6	-109.4	0	0	0	112.7	D18 V19 S20 I43 Y47 L50 P60 L62 I63	F16-D18 PolarHBondContact O-N 3.07Å; F16-V19 PolarHBondContact O-N 3.23Å; F16-S20 VanDerWaalsContact O-CB 3.27Å; F16-S20 WeakPolarHBondContact O-CB 3.37Å; F16-S20 PolarHBondContact O-N 3.32Å; F16-S20 VanDerWaalsContact O-N 3.09Å; F16-S20 PolarHBondContact O-OG 3.09Å; F16-I43 HydrophobicContact CE2-CG2 4.42Å; F16-I43 HydrophobicContact CZ-CG2 3.86Å; F16-Y47 AromaticContact CD2-CD2 3.83Å; F16-Y47 HydrophobicContact CD2-CD2 3.83Å; F16-Y47 HydrophobicContact CE2-CD2 4.12Å; F16-Y47 HydrophobicContact CE2-CG 4.43Å; F16-L50 HydrophobicContact CB-CD1 4.17Å; F16-L50 HydrophobicContact CD2-CD1 3.89Å; F16-P60 HydrophobicContact CB-CG 3.96Å; F16-P60 HydrophobicContact CD1-CB 3.84Å; F16-P60 HydrophobicContact CD1-CG 3.46Å; F16-P60 VanDerWaalsContact CD1-CG 3.46Å; F16-P60 HydrophobicContact CD2-CG 4.32Å; F16-P60 HydrophobicContact CE1-CB 4Å; F16-P60 HydrophobicContact CE1-CG 4Å; F16-P60 HydrophobicContact CG-CB 4.49Å; F16-P60 HydrophobicContact CG-CG 3.63Å; F16-L62 HydrophobicContact CE1-CD2 4.2Å; F16-L62 HydrophobicContact CZ-CD2 4.49Å; F16-I63 HydrophobicContact CE1-CD1 4.48Å; F16-I63 HydrophobicContact CE1-CG1 4.36Å; F16-I63 HydrophobicContact CE2-CD1 3.67Å; F16-I63 HydrophobicContact CE2-CG1 3.97Å; F16-I63 HydrophobicContact CZ-CD1 3.48Å; F16-I63 VanDerWaalsContact CZ-CD1 3.48Å; F16-I63 HydrophobicContact CZ-CG1 3.75Å
17	K	71.8	Confident	57	Low	155 Å²	155	97 Å²	97	67%	0.674	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-64.4	-25.6	177.6	-70.1	-173.2	171.9	-170.2	0	113.4	S15 V19	S15-K17 PolarHBondContact O-N 3.42Å; K17-V19 VanDerWaalsContact C-N 3.28Å; K17-V19 PolarHBondContact O-N 3.33Å
18	D	72.1	Confident	58.8	Low	106 Å²	106	91.4 Å²	91.4	57%	0.567	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-77.5	-16.4	-178.7	-55.8	-49.1	0	0	0	112.7	L14 S15 F16	L14-D18 HydrophobicContact CD2-CB 4.4Å; S15-D18 WeakPolarHBondContact CA-OD2 3.16Å; S15-D18 VanDerWaalsContact CB-OD2 3.29Å; S15-D18 WeakPolarHBondContact CB-OD2 3.5Å; S15-D18 PolarHBondContact N-OD2 2.97Å; S15-D18 WeakPolarHBondContact O-CB 3.44Å; S15-D18 PolarHBondContact O-N 3.14Å; S15-D18 VanDerWaalsContact OG-CG 3.25Å; S15-D18 PolarHBondContact OG-OD2 3.21Å; F16-D18 PolarHBondContact O-N 3.07Å
19	V	68.9	Low	60.5	Low	44 Å²	44	93.5 Å²	93.5	27%	0.267	49%	0.49	S	S	.	.	S	Bend	trans	-126.7	7.9	-176.3	-56.6	0	0	0	0	113	L14 F16 K17 N46 L50	L14-V19 HydrophobicContact CD2-CG1 4.32Å; F16-V19 PolarHBondContact O-N 3.23Å; K17-V19 VanDerWaalsContact C-N 3.28Å; K17-V19 PolarHBondContact O-N 3.33Å; V19-N46 HydrophobicContact CG2-CB 4.44Å; V19-N46 PolarHBondContact O-ND2 2.93Å; V19-L50 HydrophobicContact CG1-CD2 4.44Å; V19-L50 HydrophobicContact CG2-CD1 3.19Å; V19-L50 HydrophobicContact CG2-CD2 4.13Å; V19-L50 HydrophobicContact CG2-CG 3.69Å
20	S	74.5	Confident	61.9	Low	13 Å²	13	95.1 Å²	95.1	9%	0.091	49%	0.489	C	S	.	.			trans	-115.8	133.6	176.3	70.8	0	0	0	0	110.4	F16	F16-S20 VanDerWaalsContact O-CB 3.27Å; F16-S20 WeakPolarHBondContact O-CB 3.37Å; F16-S20 PolarHBondContact O-N 3.32Å; F16-S20 VanDerWaalsContact O-N 3.09Å; F16-S20 PolarHBondContact O-OG 3.09Å
21	V	70.8	Confident	63.3	Low	101 Å²	101	89.9 Å²	89.9	61%	0.612	47%	0.468	S	S	*	.			trans	-92.1	111.4	167.7	180	0	0	0	0	107.2	L23 Y39	V21-L23 HydrophobicContact CG1-CD2 4.47Å; V21-Y39 WeakPolarHBondContact O-CE2 3.42Å; V21-Y39 VanDerWaalsContact O-CZ 3.29Å; V21-Y39 PolarHBondContact O-OH 3.26Å
22	E	66.8	Low	64.6	Low	125 Å²	125	82.2 Å²	82.2	58%	0.584	45%	0.445	S	S	*	.			trans	-78.8	128.5	174.3	-67.8	-176.1	178	0	0	109.2
23	L	66.6	Low	65.6	Low	57 Å²	57	83.8 Å²	83.8	30%	0.298	45%	0.446	S	S	.	.			trans	-106.3	136.9	175.5	-67.7	174.2	0	0	0	109.7	V21 E27 W28 L31 Y39	V21-L23 HydrophobicContact CG1-CD2 4.47Å; L23-E27 HydrophobicContact CD2-CB 4.18Å; L23-W28 HydrophobicContact CD1-CE3 3.78Å; L23-W28 HydrophobicContact CD1-CZ3 4.11Å; L23-L31 HydrophobicContact CD1-CD1 3.65Å; L23-Y39 HydrophobicContact CD1-CD2 3.52Å; L23-Y39 HydrophobicContact CD1-CE1 4.47Å; L23-Y39 HydrophobicContact CD1-CE2 3.42Å; L23-Y39 VanDerWaalsContact CD1-CE2 3.42Å; L23-Y39 HydrophobicContact CD1-CG 4.11Å; L23-Y39 HydrophobicContact CG-CD2 4.25Å; L23-Y39 HydrophobicContact CG-CE2 3.67Å
24	S	61.1	Low	65.9	Low	50 Å²	50	81.4 Å²	81.4	35%	0.35	44%	0.443	S	S	.	.			trans	-71.5	165.6	169.8	66.4	0	0	0	0	111.6	E26 E27 W28	S24-E26 PolarHBondContact O-N 2.9Å; S24-E27 WeakPolarHBondContact CB-OE2 3.43Å; S24-E27 PolarHBondContact N-OE2 3.47Å; S24-E27 PolarHBondContact O-N 3.43Å; S24-E27 VanDerWaalsContact OG-CD 3.25Å; S24-E27 VanDerWaalsContact OG-CG 3.27Å; S24-E27 WeakPolarHBondContact OG-CG 2.91Å; S24-E27 PolarHBondContact OG-N 3Å; S24-E27 PolarHBondContact OG-OE2 3.46Å; S24-W28 WeakPolarHBondContact O-CB 3.45Å; S24-W28 PolarHBondContact O-N 2.89Å
25	C	49.8	Very low	66	Low	57 Å²	57	81.2 Å²	81.2	39%	0.385	44%	0.44	S	S	.	.	H	α-helix	trans	-58.4	-39.2	176.5	-171.5	0	0	0	0	111.7	W28 Q29	C25-W28 PolarHBondContact O-N 3.49Å; C25-Q29 WeakPolarHBondContact O-CG 3.25Å; C25-Q29 PolarHBondContact O-N 3.33Å
26	E	57.8	Low	66.2	Low	155 Å²	155	80.7 Å²	80.7	72%	0.724	43%	0.433	S	S	*	.	H	α-helix	trans	-68.1	-41.6	-179.1	-67.8	158.9	-165	0	0	111.1	S24 L30	S24-E26 PolarHBondContact O-N 2.9Å; E26-L30 WeakPolarHBondContact O-CG 3.38Å
27	E	61.8	Low	66.3	Low	98 Å²	98	85.1 Å²	85.1	46%	0.458	45%	0.454	S	S	.	.	H	α-helix	trans	-70.4	-35.7	176.8	-68.1	163.6	137.1	0	0	112.4	L23 S24 Q29 L30	L23-E27 HydrophobicContact CD2-CB 4.18Å; S24-E27 WeakPolarHBondContact CB-OE2 3.43Å; S24-E27 PolarHBondContact N-OE2 3.47Å; S24-E27 PolarHBondContact O-N 3.43Å; S24-E27 VanDerWaalsContact OG-CD 3.25Å; S24-E27 VanDerWaalsContact OG-CG 3.27Å; S24-E27 WeakPolarHBondContact OG-CG 2.91Å; S24-E27 PolarHBondContact OG-N 3Å; S24-E27 PolarHBondContact OG-OE2 3.46Å; E27-Q29 VanDerWaalsContact C-N 3.34Å; E27-Q29 PolarHBondContact O-N 2.94Å; E27-L30 PolarHBondContact O-N 3.2Å
28	W	71.3	Confident	66.4	Low	5 Å²	5	83 Å²	83	2%	0.019	45%	0.449	C	S	.	.	H	α-helix	trans	-64.8	-36.8	178	-174	-96.1	0	0	0	112.8	L23 S24 C25 L30 L31 Q36 Y39 R40 P72 W73	L23-W28 HydrophobicContact CD1-CE3 3.78Å; L23-W28 HydrophobicContact CD1-CZ3 4.11Å; S24-W28 WeakPolarHBondContact O-CB 3.45Å; S24-W28 PolarHBondContact O-N 2.89Å; C25-W28 PolarHBondContact O-N 3.49Å; W28-L30 VanDerWaalsContact C-N 3.27Å; W28-L30 PolarHBondContact O-N 2.85Å; W28-L31 HydrophobicContact CE3-CD1 4.22Å; W28-L31 HydrophobicContact CZ3-CD1 4.41Å; W28-L31 PolarHBondContact O-N 2.78Å; W28-Q36 HydrophobicContact CD2-CG 4.36Å; W28-Q36 HydrophobicContact CH2-CB 3.84Å; W28-Q36 HydrophobicContact CH2-CG 4.04Å; W28-Q36 HydrophobicContact CZ2-CB 3.7Å; W28-Q36 HydrophobicContact CZ2-CG 3.69Å; W28-Q36 HydrophobicContact CZ3-CG 4.48Å; W28-Q36 PolarHBondContact O-NE2 3.46Å; W28-Y39 HydrophobicContact CE3-CD1 4.35Å; W28-Y39 HydrophobicContact CE3-CE1 4.48Å; W28-Y39 AromaticContact CH2-CD1 3.76Å; W28-Y39 HydrophobicContact CH2-CD1 3.76Å; W28-Y39 HydrophobicContact CH2-CE1 4.41Å; W28-Y39 HydrophobicContact CH2-CG 4.38Å; W28-Y39 AromaticContact CZ3-CD1 3.25Å; W28-Y39 HydrophobicContact CZ3-CD1 3.25Å; W28-Y39 AromaticContact CZ3-CE1 3.7Å; W28-Y39 HydrophobicContact CZ3-CE1 3.7Å; W28-Y39 AromaticContact CZ3-CG 3.7Å; W28-Y39 HydrophobicContact CZ3-CG 3.7Å; W28-R40 HydrophobicContact CH2-CG 4.21Å; W28-P72 HydrophobicContact CD2-CG 4.02Å; W28-P72 HydrophobicContact CE3-CG 3.97Å; W28-P72 HydrophobicContact CH2-CG 3.76Å; W28-P72 HydrophobicContact CZ2-CG 3.8Å; W28-P72 HydrophobicContact CZ3-CG 3.86Å; W28-W73 AromaticContact CD1-CZ3 3.83Å
29	Q	65.4	Low	66.8	Low	141 Å²	141	79.3 Å²	79.3	66%	0.659	43%	0.427	S	S	*	.	H	α-helix	trans	-71.5	-21.3	178.5	-72.4	-180	9.4	0	0	113.2	C25 E27 L31	C25-Q29 WeakPolarHBondContact O-CG 3.25Å; C25-Q29 PolarHBondContact O-N 3.33Å; E27-Q29 VanDerWaalsContact C-N 3.34Å; E27-Q29 PolarHBondContact O-N 2.94Å; Q29-L31 VanDerWaalsContact C-N 3.32Å
30	L	62.7	Low	67	Low	148 Å²	148	80 Å²	80	78%	0.775	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-12.4	175.8	-66.2	171.3	0	0	0	113	E26 E27 W28	E26-L30 WeakPolarHBondContact O-CG 3.38Å; E27-L30 PolarHBondContact O-N 3.2Å; W28-L30 VanDerWaalsContact C-N 3.27Å; W28-L30 PolarHBondContact O-N 2.85Å
31	L	68.6	Low	67.1	Low	46 Å²	46	84 Å²	84	24%	0.241	44%	0.443	C	S	.	.	S	Bend	trans	-84.8	134.7	178.1	-62.6	-179.5	0	0	0	111.6	L23 W28 Q29 Q35 Q36	L23-L31 HydrophobicContact CD1-CD1 3.65Å; W28-L31 HydrophobicContact CE3-CD1 4.22Å; W28-L31 HydrophobicContact CZ3-CD1 4.41Å; W28-L31 PolarHBondContact O-N 2.78Å; Q29-L31 VanDerWaalsContact C-N 3.32Å; L31-Q35 HydrophobicContact CB-CB 4.04Å; L31-Q35 HydrophobicContact CD2-CB 4.08Å; L31-Q35 HydrophobicContact CG-CB 4.48Å; L31-Q36 HydrophobicContact CB-CG 3.67Å; L31-Q36 PolarHBondContact O-NE2 2.85Å
32	D	66.8	Low	67.5	Low	88 Å²	88	82.1 Å²	82.1	47%	0.471	43%	0.431	S	S	.	.			trans	-72.1	168.8	171	72.8	44	0	0	0	112.1	A34 Q35 Q36	D32-A34 PolarHBondContact O-N 3.3Å; D32-A34 VanDerWaalsContact O-N 3.14Å; D32-A34 WeakPolarHBondContact OD1-CA 3.3Å; D32-A34 WeakPolarHBondContact OD1-CB 3.36Å; D32-A34 PolarHBondContact OD1-N 2.97Å; D32-Q35 PolarHBondContact O-N 2.77Å; D32-Q35 VanDerWaalsContact O-N 3.14Å; D32-Q35 WeakPolarHBondContact OD1-CG 3.38Å; D32-Q35 PolarHBondContact OD1-N 3.29Å; D32-Q36 WeakPolarHBondContact O-CG 3.31Å; D32-Q36 PolarHBondContact O-N 3.12Å
33	S	63.8	Low	68	Low	102 Å²	102	76.4 Å²	76.4	71%	0.713	40%	0.404	S	S	*	.	H	α-helix	trans	-60.9	-26.9	-175.8	-51.9	0	0	0	0	114.1	H37	S33-H37 WeakPolarHBondContact O-CB 3.36Å; S33-H37 PolarHBondContact O-N 3.12Å
34	A	63.7	Low	68.5	Low	71 Å²	71	75.9 Å²	75.9	59%	0.587	40%	0.402	S	S	*	.	H	α-helix	trans	-78.4	-40.6	177.4	0	0	0	0	0	111	D32 H37 L38	D32-A34 PolarHBondContact O-N 3.3Å; D32-A34 VanDerWaalsContact O-N 3.14Å; D32-A34 WeakPolarHBondContact OD1-CA 3.3Å; D32-A34 WeakPolarHBondContact OD1-CB 3.36Å; D32-A34 PolarHBondContact OD1-N 2.97Å; A34-H37 PolarHBondContact O-N 2.94Å; A34-L38 WeakPolarHBondContact O-CB 3.46Å; A34-L38 PolarHBondContact O-N 3.45Å
35	Q	61.9	Low	69.5	Low	90 Å²	90	79.2 Å²	79.2	42%	0.421	41%	0.412	S	S	.	.	H	α-helix	trans	-66.3	-41.2	175.7	-67.2	173.9	-35.3	0	0	112	L31 D32 H37 L38 Y39	L31-Q35 HydrophobicContact CB-CB 4.04Å; L31-Q35 HydrophobicContact CD2-CB 4.08Å; L31-Q35 HydrophobicContact CG-CB 4.48Å; D32-Q35 PolarHBondContact O-N 2.77Å; D32-Q35 VanDerWaalsContact O-N 3.14Å; D32-Q35 WeakPolarHBondContact OD1-CG 3.38Å; D32-Q35 PolarHBondContact OD1-N 3.29Å; Q35-H37 VanDerWaalsContact C-N 3.35Å; Q35-H37 PolarHBondContact O-N 3.46Å; Q35-L38 PolarHBondContact O-N 3.03Å; Q35-Y39 PolarHBondContact O-N 2.8Å
36	Q	73.2	Confident	70.8	Confident	32 Å²	32	79 Å²	79	15%	0.15	41%	0.406	C	S	.	.	H	α-helix	trans	-62.2	-42.4	173.3	-70.6	-179.6	-5.8	0	0	111.5	W28 L31 D32 Y39 R40	W28-Q36 HydrophobicContact CD2-CG 4.36Å; W28-Q36 HydrophobicContact CH2-CB 3.84Å; W28-Q36 HydrophobicContact CH2-CG 4.04Å; W28-Q36 HydrophobicContact CZ2-CB 3.7Å; W28-Q36 HydrophobicContact CZ2-CG 3.69Å; W28-Q36 HydrophobicContact CZ3-CG 4.48Å; W28-Q36 PolarHBondContact O-NE2 3.46Å; L31-Q36 HydrophobicContact CB-CG 3.67Å; L31-Q36 PolarHBondContact O-NE2 2.85Å; D32-Q36 WeakPolarHBondContact O-CG 3.31Å; D32-Q36 PolarHBondContact O-N 3.12Å; Q36-Y39 PolarHBondContact O-N 3.48Å; Q36-R40 VanDerWaalsContact O-CG 3.3Å; Q36-R40 WeakPolarHBondContact O-CG 3.48Å; Q36-R40 PolarHBondContact O-N 3.18Å; Q36-R40 VanDerWaalsContact O-N 3.13Å
37	H	73.1	Confident	71.8	Confident	104 Å²	104	72.4 Å²	72.4	48%	0.481	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-41.9	175.8	-171.4	-30.9	0	0	0	111.4	S33 A34 Q35 R40 E41	S33-H37 WeakPolarHBondContact O-CB 3.36Å; S33-H37 PolarHBondContact O-N 3.12Å; A34-H37 PolarHBondContact O-N 2.94Å; Q35-H37 VanDerWaalsContact C-N 3.35Å; Q35-H37 PolarHBondContact O-N 3.46Å; H37-R40 PolarHBondContact O-N 3.26Å; H37-E41 IonicContact CE1-OE1 3.68Å; H37-E41 IonicContact CE1-OE2 3Å; H37-E41 PolarHBondContact O-N 3.4Å
38	L	74.4	Confident	72.5	Confident	110 Å²	110	70.8 Å²	70.8	58%	0.576	38%	0.375	S	S	*	.	H	α-helix	trans	-62.2	-45.8	178.1	-177.8	62.2	0	0	0	111.3	A34 Q35 R40 E41 V42	A34-L38 WeakPolarHBondContact O-CB 3.46Å; A34-L38 PolarHBondContact O-N 3.45Å; Q35-L38 PolarHBondContact O-N 3.03Å; L38-R40 VanDerWaalsContact C-N 3.28Å; L38-R40 PolarHBondContact O-N 3.31Å; L38-E41 PolarHBondContact O-N 3.4Å; L38-V42 HydrophobicContact CD1-CG2 4.07Å; L38-V42 HydrophobicContact CG-CG2 4.33Å; L38-V42 VanDerWaalsContact O-CG2 3.3Å; L38-V42 WeakPolarHBondContact O-CG2 3.27Å; L38-V42 PolarHBondContact O-N 3.43Å
39	Y	79.1	Confident	72.8	Confident	29 Å²	29	74.5 Å²	74.5	11%	0.114	40%	0.395	C	S	.	.	H	α-helix	trans	-55.1	-44.2	174.6	178	-88.9	0	0	0	111.8	V21 L23 W28 Q35 Q36 V42 I43 L66	V21-Y39 WeakPolarHBondContact O-CE2 3.42Å; V21-Y39 VanDerWaalsContact O-CZ 3.29Å; V21-Y39 PolarHBondContact O-OH 3.26Å; L23-Y39 HydrophobicContact CD1-CD2 3.52Å; L23-Y39 HydrophobicContact CD1-CE1 4.47Å; L23-Y39 HydrophobicContact CD1-CE2 3.42Å; L23-Y39 VanDerWaalsContact CD1-CE2 3.42Å; L23-Y39 HydrophobicContact CD1-CG 4.11Å; L23-Y39 HydrophobicContact CG-CD2 4.25Å; L23-Y39 HydrophobicContact CG-CE2 3.67Å; W28-Y39 HydrophobicContact CE3-CD1 4.35Å; W28-Y39 HydrophobicContact CE3-CE1 4.48Å; W28-Y39 AromaticContact CH2-CD1 3.76Å; W28-Y39 HydrophobicContact CH2-CD1 3.76Å; W28-Y39 HydrophobicContact CH2-CE1 4.41Å; W28-Y39 HydrophobicContact CH2-CG 4.38Å; W28-Y39 AromaticContact CZ3-CD1 3.25Å; W28-Y39 HydrophobicContact CZ3-CD1 3.25Å; W28-Y39 AromaticContact CZ3-CE1 3.7Å; W28-Y39 HydrophobicContact CZ3-CE1 3.7Å; W28-Y39 AromaticContact CZ3-CG 3.7Å; W28-Y39 HydrophobicContact CZ3-CG 3.7Å; Q35-Y39 PolarHBondContact O-N 2.8Å; Q36-Y39 PolarHBondContact O-N 3.48Å; Y39-V42 PolarHBondContact O-N 2.95Å; Y39-I43 HydrophobicContact CD1-CG1 4.08Å; Y39-I43 HydrophobicContact CD2-CG1 4.15Å; Y39-I43 HydrophobicContact CE1-CG1 3.84Å; Y39-I43 HydrophobicContact CE2-CD1 4.15Å; Y39-I43 HydrophobicContact CE2-CG1 3.86Å; Y39-I43 HydrophobicContact CG-CG1 4.27Å; Y39-I43 WeakPolarHBondContact O-CB 3.36Å; Y39-I43 VanDerWaalsContact O-CG1 3.25Å; Y39-I43 WeakPolarHBondContact O-CG1 3.35Å; Y39-I43 PolarHBondContact O-N 3.38Å; Y39-L66 HydrophobicContact CE1-CD1 4.43Å
40	R	74.9	Confident	73.2	Confident	58 Å²	58	68 Å²	68	22%	0.219	37%	0.365	C	S	.	.	H	α-helix	trans	-62.5	-45.6	178.5	-66.8	-175.8	-176.9	156.1	0.5	112.6	W28 Q36 H37 L38 L44 L66	W28-R40 HydrophobicContact CH2-CG 4.21Å; Q36-R40 VanDerWaalsContact O-CG 3.3Å; Q36-R40 WeakPolarHBondContact O-CG 3.48Å; Q36-R40 PolarHBondContact O-N 3.18Å; Q36-R40 VanDerWaalsContact O-N 3.13Å; H37-R40 PolarHBondContact O-N 3.26Å; L38-R40 VanDerWaalsContact C-N 3.28Å; L38-R40 PolarHBondContact O-N 3.31Å; R40-L44 WeakPolarHBondContact O-CB 3.4Å; R40-L44 VanDerWaalsContact O-CG 3.23Å; R40-L44 WeakPolarHBondContact O-CG 3.35Å; R40-L44 PolarHBondContact O-N 3.14Å; R40-L66 HydrophobicContact CG-CD2 3.69Å
41	E	76.4	Confident	73.7	Confident	98 Å²	98	65 Å²	65	46%	0.458	35%	0.349	S	S	.	.	H	α-helix	trans	-64.9	-45.1	179	-71.6	-152.4	123.8	0	0	111.2	H37 L38 L44 E45	H37-E41 IonicContact CE1-OE1 3.68Å; H37-E41 IonicContact CE1-OE2 3Å; H37-E41 PolarHBondContact O-N 3.4Å; L38-E41 PolarHBondContact O-N 3.4Å; E41-L44 PolarHBondContact O-N 2.98Å; E41-E45 VanDerWaalsContact O-CB 3.26Å; E41-E45 WeakPolarHBondContact O-CB 3.21Å; E41-E45 PolarHBondContact O-N 3.41Å
42	V	77.8	Confident	73.9	Confident	61 Å²	61	67.3 Å²	67.3	37%	0.37	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-44.3	-178.2	173.4	0	0	0	0	111.8	L38 Y39 E45 N46	L38-V42 HydrophobicContact CD1-CG2 4.07Å; L38-V42 HydrophobicContact CG-CG2 4.33Å; L38-V42 VanDerWaalsContact O-CG2 3.3Å; L38-V42 WeakPolarHBondContact O-CG2 3.27Å; L38-V42 PolarHBondContact O-N 3.43Å; Y39-V42 PolarHBondContact O-N 2.95Å; V42-E45 PolarHBondContact O-N 3.14Å; V42-N46 WeakPolarHBondContact O-CB 2.99Å; V42-N46 VanDerWaalsContact O-CG 3.23Å; V42-N46 PolarHBondContact O-N 3.04Å; V42-N46 PolarHBondContact O-OD1 3.28Å
43	I	77.1	Confident	74.2	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-69.3	-37.7	-178.6	-65.7	-65.6	0	0	0	112	F16 Y39 Y47 I63 L66	F16-I43 HydrophobicContact CE2-CG2 4.42Å; F16-I43 HydrophobicContact CZ-CG2 3.86Å; Y39-I43 HydrophobicContact CD1-CG1 4.08Å; Y39-I43 HydrophobicContact CD2-CG1 4.15Å; Y39-I43 HydrophobicContact CE1-CG1 3.84Å; Y39-I43 HydrophobicContact CE2-CD1 4.15Å; Y39-I43 HydrophobicContact CE2-CG1 3.86Å; Y39-I43 HydrophobicContact CG-CG1 4.27Å; Y39-I43 WeakPolarHBondContact O-CB 3.36Å; Y39-I43 VanDerWaalsContact O-CG1 3.25Å; Y39-I43 WeakPolarHBondContact O-CG1 3.35Å; Y39-I43 PolarHBondContact O-N 3.38Å; I43-Y47 PolarHBondContact O-N 2.8Å; I43-Y47 VanDerWaalsContact O-N 3.11Å; I43-I63 HydrophobicContact CG2-CD1 3.71Å; I43-L66 HydrophobicContact CB-CD1 4.02Å; I43-L66 HydrophobicContact CG2-CD1 3.73Å
44	L	78.1	Confident	74.3	Confident	47 Å²	47	65.2 Å²	65.2	25%	0.246	36%	0.362	C	S	.	.	H	α-helix	trans	-68.7	-38.5	175.1	-69.4	177.7	0	0	0	111.9	R40 E41 Y47 S48 I63 L66 E67	R40-L44 WeakPolarHBondContact O-CB 3.4Å; R40-L44 VanDerWaalsContact O-CG 3.23Å; R40-L44 WeakPolarHBondContact O-CG 3.35Å; R40-L44 PolarHBondContact O-N 3.14Å; E41-L44 PolarHBondContact O-N 2.98Å; L44-Y47 PolarHBondContact O-N 2.81Å; L44-S48 PolarHBondContact O-N 3.15Å; L44-I63 HydrophobicContact CD2-CD1 4.08Å; L44-I63 HydrophobicContact CD2-CG2 3.79Å; L44-L66 HydrophobicContact CD1-CB 4.31Å; L44-L66 HydrophobicContact CD2-CB 3.89Å; L44-L66 HydrophobicContact CG-CB 4.13Å; L44-E67 HydrophobicContact CD1-CG 4.42Å; L44-E67 HydrophobicContact CD2-CG 3.71Å
45	E	81.2	Confident	74.6	Confident	119 Å²	119	64 Å²	64	56%	0.556	34%	0.343	S	S	*	.	H	α-helix	trans	-65.3	-44.7	175.5	-175.3	166.6	-159.1	0	0	111.4	E41 V42 Y47 S48 N49	E41-E45 VanDerWaalsContact O-CB 3.26Å; E41-E45 WeakPolarHBondContact O-CB 3.21Å; E41-E45 PolarHBondContact O-N 3.41Å; V42-E45 PolarHBondContact O-N 3.14Å; E45-Y47 VanDerWaalsContact C-N 3.33Å; E45-Y47 PolarHBondContact O-N 2.95Å; E45-S48 WeakPolarHBondContact O-CB 3.37Å; E45-S48 PolarHBondContact O-N 2.93Å; E45-S48 VanDerWaalsContact O-N 3.17Å; E45-N49 WeakPolarHBondContact O-CB 3.38Å; E45-N49 VanDerWaalsContact O-CG 3.25Å; E45-N49 PolarHBondContact O-N 3.4Å; E45-N49 PolarHBondContact O-ND2 3.01Å
46	N	77.7	Confident	74.8	Confident	52 Å²	52	67 Å²	67	28%	0.278	36%	0.361	S	S	.	.	H	α-helix	trans	-59.9	-41.3	175.6	-73.3	-1	0	0	0	112.1	V19 V42 N49 L50	V19-N46 HydrophobicContact CG2-CB 4.44Å; V19-N46 PolarHBondContact O-ND2 2.93Å; V42-N46 WeakPolarHBondContact O-CB 2.99Å; V42-N46 VanDerWaalsContact O-CG 3.23Å; V42-N46 PolarHBondContact O-N 3.04Å; V42-N46 PolarHBondContact O-OD1 3.28Å; N46-N49 PolarHBondContact O-N 3.47Å; N46-L50 PolarHBondContact O-N 3.19Å
47	Y	78.3	Confident	74.4	Confident	17 Å²	17	66.9 Å²	66.9	7%	0.067	37%	0.369	C	S	.	.	H	α-helix	trans	-65.6	-41.2	174.6	-179	-107.1	0	0	0	112.8	F16 I43 L44 E45 N49 L50 L51 Y55 K59 P60 I63	F16-Y47 AromaticContact CD2-CD2 3.83Å; F16-Y47 HydrophobicContact CD2-CD2 3.83Å; F16-Y47 HydrophobicContact CE2-CD2 4.12Å; F16-Y47 HydrophobicContact CE2-CG 4.43Å; I43-Y47 PolarHBondContact O-N 2.8Å; I43-Y47 VanDerWaalsContact O-N 3.11Å; L44-Y47 PolarHBondContact O-N 2.81Å; E45-Y47 VanDerWaalsContact C-N 3.33Å; E45-Y47 PolarHBondContact O-N 2.95Å; Y47-N49 VanDerWaalsContact C-N 3.28Å; Y47-N49 PolarHBondContact O-N 3.4Å; Y47-L50 WeakPolarHBondContact O-CB 3.41Å; Y47-L50 PolarHBondContact O-N 3.34Å; Y47-L51 HydrophobicContact CD1-CD1 4.1Å; Y47-L51 HydrophobicContact CE1-CD1 3.51Å; Y47-L51 HydrophobicContact CE1-CG 4.05Å; Y47-L51 HydrophobicContact CE2-CG 4.47Å; Y47-L51 PolarHBondContact O-N 2.9Å; Y47-Y55 HydrophobicContact CE2-CD1 4.29Å; Y47-Y55 HydrophobicContact CE2-CE1 4.17Å; Y47-K59 HydrophobicContact CE1-CD 4.38Å; Y47-K59 HydrophobicContact CE1-CG 4.1Å; Y47-K59 WeakPolarHBondContact OH-CA 3.45Å; Y47-K59 WeakPolarHBondContact OH-CB 3.28Å; Y47-K59 WeakPolarHBondContact OH-CG 3.27Å; Y47-P60 VanDerWaalsContact CE2-CD 3.46Å; Y47-P60 HydrophobicContact CE2-CG 4.34Å; Y47-I63 HydrophobicContact CD1-CB 4.43Å; Y47-I63 HydrophobicContact CD1-CD1 4.49Å; Y47-I63 HydrophobicContact CD1-CG1 4.16Å; Y47-I63 HydrophobicContact CD1-CG2 3.61Å; Y47-I63 HydrophobicContact CD2-CG1 3.97Å; Y47-I63 HydrophobicContact CE1-CG2 3.95Å; Y47-I63 HydrophobicContact CG-CD1 3.96Å; Y47-I63 HydrophobicContact CG-CG1 3.75Å; Y47-I63 HydrophobicContact CG-CG2 4.09Å
48	S	77.3	Confident	74	Confident	64 Å²	64	67 Å²	67	45%	0.448	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-38.6	175.2	-172.9	0	0	0	0	111.8	L44 E45 L51 S52	L44-S48 PolarHBondContact O-N 3.15Å; E45-S48 WeakPolarHBondContact O-CB 3.37Å; E45-S48 PolarHBondContact O-N 2.93Å; E45-S48 VanDerWaalsContact O-N 3.17Å; S48-L51 PolarHBondContact O-N 3.18Å; S48-S52 PolarHBondContact O-N 3.22Å; S48-S52 VanDerWaalsContact O-N 3.1Å; S48-S52 PolarHBondContact O-OG 3.19Å
49	N	77.7	Confident	74	Confident	83 Å²	83	65.7 Å²	65.7	44%	0.444	37%	0.371	S	S	.	.	H	α-helix	trans	-68.2	-39.5	176.1	-68.9	-23.5	0	0	0	111.2	E45 N46 Y47 L51 S52 V53	E45-N49 WeakPolarHBondContact O-CB 3.38Å; E45-N49 VanDerWaalsContact O-CG 3.25Å; E45-N49 PolarHBondContact O-N 3.4Å; E45-N49 PolarHBondContact O-ND2 3.01Å; N46-N49 PolarHBondContact O-N 3.47Å; Y47-N49 VanDerWaalsContact C-N 3.28Å; Y47-N49 PolarHBondContact O-N 3.4Å; N49-L51 PolarHBondContact O-N 3.32Å; N49-S52 WeakPolarHBondContact O-CB 3.49Å; N49-S52 PolarHBondContact O-N 2.79Å; N49-S52 VanDerWaalsContact O-N 3.11Å; N49-V53 PolarHBondContact O-N 3.2Å
50	L	73.3	Confident	73.8	Confident	6 Å²	6	65.6 Å²	65.6	3%	0.031	37%	0.374	C	S	.	.	H	α-helix	trans	-59.7	-44.5	173.1	-83.6	177.7	0	0	0	113.3	L14 F16 V19 N46 Y47 S52 V53 G54 Y55	L14-L50 HydrophobicContact CB-CD2 3.78Å; F16-L50 HydrophobicContact CB-CD1 4.17Å; F16-L50 HydrophobicContact CD2-CD1 3.89Å; V19-L50 HydrophobicContact CG1-CD2 4.44Å; V19-L50 HydrophobicContact CG2-CD1 3.19Å; V19-L50 HydrophobicContact CG2-CD2 4.13Å; V19-L50 HydrophobicContact CG2-CG 3.69Å; N46-L50 PolarHBondContact O-N 3.19Å; Y47-L50 WeakPolarHBondContact O-CB 3.41Å; Y47-L50 PolarHBondContact O-N 3.34Å; L50-S52 PolarHBondContact O-N 2.89Å; L50-V53 HydrophobicContact CD2-CG2 4.34Å; L50-V53 VanDerWaalsContact O-CG2 3.26Å; L50-V53 WeakPolarHBondContact O-CG2 3.49Å; L50-V53 PolarHBondContact O-N 3.36Å; L50-G54 PolarHBondContact O-N 3.41Å; L50-Y55 HydrophobicContact CB-CG 4.47Å; L50-Y55 WeakPolarHBondContact O-CB 3.28Å; L50-Y55 PolarHBondContact O-N 3.38Å
51	L	73.7	Confident	73.6	Confident	84 Å²	84	67.9 Å²	67.9	44%	0.44	39%	0.391	S	S	.	.	H	α-helix	trans	-60.9	-37.6	174.2	-71	176.7	0	0	0	111.4	Y47 S48 N49 V53 G54 Y55	Y47-L51 HydrophobicContact CD1-CD1 4.1Å; Y47-L51 HydrophobicContact CE1-CD1 3.51Å; Y47-L51 HydrophobicContact CE1-CG 4.05Å; Y47-L51 HydrophobicContact CE2-CG 4.47Å; Y47-L51 PolarHBondContact O-N 2.9Å; S48-L51 PolarHBondContact O-N 3.18Å; N49-L51 PolarHBondContact O-N 3.32Å; L51-V53 VanDerWaalsContact C-N 3.31Å; L51-V53 PolarHBondContact O-N 2.84Å; L51-G54 PolarHBondContact O-N 3.48Å; L51-G54 VanDerWaalsContact O-N 3.13Å; L51-Y55 HydrophobicContact CD2-CD1 4.27Å
52	S	73.6	Confident	73.4	Confident	95 Å²	95	64.3 Å²	64.3	66%	0.664	37%	0.374	S	S	*	.	H	α-helix	trans	-68.1	-29	179.3	-56.4	0	0	0	0	112.9	S48 N49 L50 G54	S48-S52 PolarHBondContact O-N 3.22Å; S48-S52 VanDerWaalsContact O-N 3.1Å; S48-S52 PolarHBondContact O-OG 3.19Å; N49-S52 WeakPolarHBondContact O-CB 3.49Å; N49-S52 PolarHBondContact O-N 2.79Å; N49-S52 VanDerWaalsContact O-N 3.11Å; L50-S52 PolarHBondContact O-N 2.89Å; S52-G54 VanDerWaalsContact C-N 3.31Å
53	V	71.9	Confident	73.3	Confident	107 Å²	107	61.4 Å²	61.4	65%	0.648	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	10.7	173.7	-58.9	0	0	0	0	113.4	N49 L50 L51	N49-V53 PolarHBondContact O-N 3.2Å; L50-V53 HydrophobicContact CD2-CG2 4.34Å; L50-V53 VanDerWaalsContact O-CG2 3.26Å; L50-V53 WeakPolarHBondContact O-CG2 3.49Å; L50-V53 PolarHBondContact O-N 3.36Å; L51-V53 VanDerWaalsContact C-N 3.31Å; L51-V53 PolarHBondContact O-N 2.84Å
54	G	66.1	Low	73.2	Confident	38 Å²	38	66.7 Å²	66.7	39%	0.392	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	26.7	170.5	0	0	0	0	0	115.3	L50 L51 S52 L56	L50-G54 PolarHBondContact O-N 3.41Å; L51-G54 PolarHBondContact O-N 3.48Å; L51-G54 VanDerWaalsContact O-N 3.13Å; S52-G54 VanDerWaalsContact C-N 3.31Å; G54-L56 PolarHBondContact O-N 2.96Å
55	Y	70.3	Confident	72.7	Confident	46 Å²	46	66.5 Å²	66.5	18%	0.18	38%	0.377	C	S	.	.			trans	-60.8	120.6	171.3	179.2	-104.1	0	0	0	111.4	Y47 L50 L51 G57	Y47-Y55 HydrophobicContact CE2-CD1 4.29Å; Y47-Y55 HydrophobicContact CE2-CE1 4.17Å; L50-Y55 HydrophobicContact CB-CG 4.47Å; L50-Y55 WeakPolarHBondContact O-CB 3.28Å; L50-Y55 PolarHBondContact O-N 3.38Å; L51-Y55 HydrophobicContact CD2-CD1 4.27Å; Y55-G57 VanDerWaalsContact CE1-CA 3.48Å; Y55-G57 VanDerWaalsContact CE1-O 3.29Å; Y55-G57 WeakPolarHBondContact CE1-O 3.27Å; Y55-G57 VanDerWaalsContact CZ-CA 3.45Å
56	L	65.3	Low	72.1	Confident	152 Å²	152	61.1 Å²	61.1	80%	0.796	35%	0.352	S	S	*	.			trans	-103.6	6.5	-177.9	-67.6	172.5	0	0	0	113.8	G54	G54-L56 PolarHBondContact O-N 2.96Å
57	G	64.6	Low	71.9	Confident	31 Å²	31	63.7 Å²	63.7	32%	0.32	36%	0.362	S	S	.	.	S	Bend	trans	-77.4	159.2	179.9	0	0	0	0	0	113.2	Y55	Y55-G57 VanDerWaalsContact CE1-CA 3.48Å; Y55-G57 VanDerWaalsContact CE1-O 3.29Å; Y55-G57 WeakPolarHBondContact CE1-O 3.27Å; Y55-G57 VanDerWaalsContact CZ-CA 3.45Å
58	S	65.8	Low	71.3	Confident	106 Å²	106	67 Å²	67	74%	0.741	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-61.9	142.3	174.6	53.7	0	0	0	0	111	P60	S58-P60 WeakPolarHBondContact O-CD 3.5Å
59	K	73.9	Confident	70.5	Confident	83 Å²	83	66.2 Å²	66.2	36%	0.361	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-55.9	120.7	179	-174.5	170.5	-166.7	168.4	0	110.5	Y47 I63 E67	Y47-K59 HydrophobicContact CE1-CD 4.38Å; Y47-K59 HydrophobicContact CE1-CG 4.1Å; Y47-K59 WeakPolarHBondContact OH-CA 3.45Å; Y47-K59 WeakPolarHBondContact OH-CB 3.28Å; Y47-K59 WeakPolarHBondContact OH-CG 3.27Å; K59-I63 HydrophobicContact CD-CG2 4.43Å; K59-I63 HydrophobicContact CG-CB 4.35Å; K59-I63 HydrophobicContact CG-CG2 4.29Å; K59-E67 WeakPolarHBondContact CE-OE1 3.35Å; K59-E67 WeakPolarHBondContact CE-OE2 3.46Å; K59-E67 IonicContact NZ-OE1 3.88Å; K59-E67 PolarHBondContact NZ-OE1 2.76Å; K59-E67 IonicContact NZ-OE2 3.96Å; K59-E67 PolarHBondContact NZ-OE2 3.45Å
60	P	74.9	Confident	69.7	Low	26 Å²	26	67.9 Å²	67.9	17%	0.169	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-64.4	140.5	-180	-22	32.9	0	0	0	112	F16 Y47 S58 L62 I63 F64	F16-P60 HydrophobicContact CB-CG 3.96Å; F16-P60 HydrophobicContact CD1-CB 3.84Å; F16-P60 HydrophobicContact CD1-CG 3.46Å; F16-P60 VanDerWaalsContact CD1-CG 3.46Å; F16-P60 HydrophobicContact CD2-CG 4.32Å; F16-P60 HydrophobicContact CE1-CB 4Å; F16-P60 HydrophobicContact CE1-CG 4Å; F16-P60 HydrophobicContact CG-CB 4.49Å; F16-P60 HydrophobicContact CG-CG 3.63Å; Y47-P60 VanDerWaalsContact CE2-CD 3.46Å; Y47-P60 HydrophobicContact CE2-CG 4.34Å; S58-P60 WeakPolarHBondContact O-CD 3.5Å; P60-L62 PolarHBondContact O-N 3.08Å; P60-L62 VanDerWaalsContact O-N 3.13Å; P60-I63 HydrophobicContact CB-CG1 4.35Å; P60-I63 HydrophobicContact CG-CG1 4.41Å; P60-I63 WeakPolarHBondContact O-CB 3.39Å; P60-I63 PolarHBondContact O-N 3.45Å; P60-F64 PolarHBondContact O-N 2.99Å
61	D	69.9	Low	69.1	Low	107 Å²	107	72 Å²	72	57%	0.572	40%	0.403	S	S	*	.	H	α-helix	trans	-56.7	-31.5	179.9	-73.9	-25.9	0	0	0	113	I63 F64 K65	D61-I63 PolarHBondContact O-N 3.4Å; D61-F64 PolarHBondContact O-N 3.47Å; D61-K65 WeakPolarHBondContact O-CG 3.29Å; D61-K65 PolarHBondContact O-N 3.32Å; D61-K65 VanDerWaalsContact O-N 3.07Å
62	L	73.2	Confident	68	Low	23 Å²	23	68.5 Å²	68.5	12%	0.12	39%	0.385	C	S	.	.	H	α-helix	trans	-56.8	-47.9	174.1	-175	63.6	0	0	0	111.3	F16 P60 F64 K65 L66 P72	F16-L62 HydrophobicContact CE1-CD2 4.2Å; F16-L62 HydrophobicContact CZ-CD2 4.49Å; P60-L62 PolarHBondContact O-N 3.08Å; P60-L62 VanDerWaalsContact O-N 3.13Å; L62-F64 VanDerWaalsContact C-N 3.34Å; L62-F64 PolarHBondContact O-N 3.02Å; L62-K65 PolarHBondContact O-N 2.8Å; L62-L66 HydrophobicContact CG-CD1 4.39Å; L62-L66 WeakPolarHBondContact O-CG 3.49Å; L62-L66 PolarHBondContact O-N 3.37Å; L62-P72 HydrophobicContact CD1-CB 3.28Å; L62-P72 VanDerWaalsContact CD1-O 3.28Å; L62-P72 WeakPolarHBondContact CD1-O 3.31Å
63	I	75.6	Confident	67.4	Low	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-63.8	-41.7	178.8	-61.8	-60.4	0	0	0	110.9	F16 I43 L44 Y47 K59 P60 D61 K65 L66 E67	F16-I63 HydrophobicContact CE1-CD1 4.48Å; F16-I63 HydrophobicContact CE1-CG1 4.36Å; F16-I63 HydrophobicContact CE2-CD1 3.67Å; F16-I63 HydrophobicContact CE2-CG1 3.97Å; F16-I63 HydrophobicContact CZ-CD1 3.48Å; F16-I63 VanDerWaalsContact CZ-CD1 3.48Å; F16-I63 HydrophobicContact CZ-CG1 3.75Å; I43-I63 HydrophobicContact CG2-CD1 3.71Å; L44-I63 HydrophobicContact CD2-CD1 4.08Å; L44-I63 HydrophobicContact CD2-CG2 3.79Å; Y47-I63 HydrophobicContact CD1-CB 4.43Å; Y47-I63 HydrophobicContact CD1-CD1 4.49Å; Y47-I63 HydrophobicContact CD1-CG1 4.16Å; Y47-I63 HydrophobicContact CD1-CG2 3.61Å; Y47-I63 HydrophobicContact CD2-CG1 3.97Å; Y47-I63 HydrophobicContact CE1-CG2 3.95Å; Y47-I63 HydrophobicContact CG-CD1 3.96Å; Y47-I63 HydrophobicContact CG-CG1 3.75Å; Y47-I63 HydrophobicContact CG-CG2 4.09Å; K59-I63 HydrophobicContact CD-CG2 4.43Å; K59-I63 HydrophobicContact CG-CB 4.35Å; K59-I63 HydrophobicContact CG-CG2 4.29Å; P60-I63 HydrophobicContact CB-CG1 4.35Å; P60-I63 HydrophobicContact CG-CG1 4.41Å; P60-I63 WeakPolarHBondContact O-CB 3.39Å; P60-I63 PolarHBondContact O-N 3.45Å; D61-I63 PolarHBondContact O-N 3.4Å; I63-K65 VanDerWaalsContact C-N 3.28Å; I63-K65 PolarHBondContact O-N 3.16Å; I63-L66 PolarHBondContact O-N 3.41Å; I63-E67 HydrophobicContact CG2-CG 4.44Å; I63-E67 WeakPolarHBondContact O-CG 3.48Å; I63-E67 PolarHBondContact O-N 3.09Å
64	F	75.3	Confident	65.7	Low	115 Å²	115	68.5 Å²	68.5	50%	0.504	37%	0.365	S	S	.	.	H	α-helix	trans	-60.7	-37.4	178.1	-176.8	-107.3	0	0	0	112.7	P60 D61 L62 Q68	P60-F64 PolarHBondContact O-N 2.99Å; D61-F64 PolarHBondContact O-N 3.47Å; L62-F64 VanDerWaalsContact C-N 3.34Å; L62-F64 PolarHBondContact O-N 3.02Å; F64-Q68 VanDerWaalsContact CD1-NE2 3.3Å; F64-Q68 VanDerWaalsContact CE2-NE2 3.28Å; F64-Q68 PolarHBondContact O-NE2 2.82Å
65	K	67.7	Low	64	Low	43 Å²	43	73.3 Å²	73.3	19%	0.187	38%	0.381	C	S	.	.	H	α-helix	trans	-71.1	-43.6	176	-71.8	175.3	-178.2	175.5	0	112.5	D61 L62 I63 E67 Q68 G69 K70 W73 I74	D61-K65 WeakPolarHBondContact O-CG 3.29Å; D61-K65 PolarHBondContact O-N 3.32Å; D61-K65 VanDerWaalsContact O-N 3.07Å; L62-K65 PolarHBondContact O-N 2.8Å; I63-K65 VanDerWaalsContact C-N 3.28Å; I63-K65 PolarHBondContact O-N 3.16Å; K65-E67 PolarHBondContact O-N 3.41Å; K65-Q68 PolarHBondContact O-N 3.05Å; K65-G69 PolarHBondContact O-N 3.32Å; K65-K70 HydrophobicContact CB-CB 4.35Å; K65-K70 PolarHBondContact O-N 2.99Å; K65-W73 PolarHBondContact NZ-O 3.27Å; K65-I74 VanDerWaalsContact NZ-CA 3.29Å
66	L	68	Low	62.1	Low	6 Å²	6	78 Å²	78	3%	0.031	41%	0.409	C	S	.	.	H	α-helix	trans	-64.9	-38.8	-179	-67.7	-175.2	0	0	0	112.5	Y39 R40 I43 L44 L62 I63 Q68 G69 P72	Y39-L66 HydrophobicContact CE1-CD1 4.43Å; R40-L66 HydrophobicContact CG-CD2 3.69Å; I43-L66 HydrophobicContact CB-CD1 4.02Å; I43-L66 HydrophobicContact CG2-CD1 3.73Å; L44-L66 HydrophobicContact CD1-CB 4.31Å; L44-L66 HydrophobicContact CD2-CB 3.89Å; L44-L66 HydrophobicContact CG-CB 4.13Å; L62-L66 HydrophobicContact CG-CD1 4.39Å; L62-L66 WeakPolarHBondContact O-CG 3.49Å; L62-L66 PolarHBondContact O-N 3.37Å; I63-L66 PolarHBondContact O-N 3.41Å; L66-Q68 PolarHBondContact O-N 3.2Å; L66-G69 PolarHBondContact O-N 3.13Å; L66-P72 HydrophobicContact CD2-CB 3.86Å; L66-P72 HydrophobicContact CD2-CG 3.71Å
67	E	74.3	Confident	60.2	Low	106 Å²	106	75.7 Å²	75.7	50%	0.495	41%	0.412	S	S	.	.	H	α-helix	trans	-63.1	-30	174.8	-75	179	170	0	0	113.4	L44 K59 I63 K65 G69	L44-E67 HydrophobicContact CD1-CG 4.42Å; L44-E67 HydrophobicContact CD2-CG 3.71Å; K59-E67 WeakPolarHBondContact CE-OE1 3.35Å; K59-E67 WeakPolarHBondContact CE-OE2 3.46Å; K59-E67 IonicContact NZ-OE1 3.88Å; K59-E67 PolarHBondContact NZ-OE1 2.76Å; K59-E67 IonicContact NZ-OE2 3.96Å; K59-E67 PolarHBondContact NZ-OE2 3.45Å; I63-E67 HydrophobicContact CG2-CG 4.44Å; I63-E67 WeakPolarHBondContact O-CG 3.48Å; I63-E67 PolarHBondContact O-N 3.09Å; K65-E67 PolarHBondContact O-N 3.41Å; E67-G69 VanDerWaalsContact C-N 3.26Å
68	Q	65.1	Low	58.4	Low	86 Å²	86	83.8 Å²	83.8	40%	0.402	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	0.5	176.2	-70.4	172.8	46.7	0	0	113.1	F64 K65 L66 K70	F64-Q68 VanDerWaalsContact CD1-NE2 3.3Å; F64-Q68 VanDerWaalsContact CE2-NE2 3.28Å; F64-Q68 PolarHBondContact O-NE2 2.82Å; K65-Q68 PolarHBondContact O-N 3.05Å; L66-Q68 PolarHBondContact O-N 3.2Å; Q68-K70 HydrophobicContact CB-CD 4.15Å; Q68-K70 HydrophobicContact CB-CG 4.1Å; Q68-K70 PolarHBondContact O-N 3.47Å
69	G	61.3	Low	56.5	Low	47 Å²	47	86.5 Å²	86.5	49%	0.485	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	16.3	-174.5	0	0	0	0	0	113.8	K65 L66 E67	K65-G69 PolarHBondContact O-N 3.32Å; L66-G69 PolarHBondContact O-N 3.13Å; E67-G69 VanDerWaalsContact C-N 3.26Å
70	K	59.7	Low	54	Low	118 Å²	118	87 Å²	87	51%	0.513	46%	0.456	S	S	.	.			trans	-84.2	154.3	176.8	-67.7	176.1	177.2	166.3	0	110.3	K65 Q68	K65-K70 HydrophobicContact CB-CB 4.35Å; K65-K70 PolarHBondContact O-N 2.99Å; Q68-K70 HydrophobicContact CB-CD 4.15Å; Q68-K70 HydrophobicContact CB-CG 4.1Å; Q68-K70 PolarHBondContact O-N 3.47Å
71	E	60.5	Low	51.6	Low	93 Å²	93	91.3 Å²	91.3	44%	0.435	48%	0.482	S	S	.	.			trans	-71.7	148.3	178.8	-60.3	-179.4	124.8	0	0	111.5	W73	E71-W73 HydrophobicContact CB-CD2 4.45Å; E71-W73 HydrophobicContact CB-CE3 3.74Å; E71-W73 HydrophobicContact CB-CH2 3.58Å; E71-W73 HydrophobicContact CB-CZ2 4.25Å; E71-W73 HydrophobicContact CB-CZ3 3.27Å; E71-W73 VanDerWaalsContact CD-CH2 3.4Å; E71-W73 HydrophobicContact CG-CH2 4.1Å; E71-W73 HydrophobicContact CG-CZ3 4.02Å; E71-W73 PolarHBondContact O-N 3.03Å; E71-W73 WeakPolarHBondContact OE2-CH2 3.38Å
72	P	51.8	Low	49.5	Very low	11 Å²	11	94.5 Å²	94.5	7%	0.071	49%	0.494	C	S	.	.			trans	-82.6	-11.7	-152.3	-6.5	23.7	0	0	0	114.9	W28 L62 L66	W28-P72 HydrophobicContact CD2-CG 4.02Å; W28-P72 HydrophobicContact CE3-CG 3.97Å; W28-P72 HydrophobicContact CH2-CG 3.76Å; W28-P72 HydrophobicContact CZ2-CG 3.8Å; W28-P72 HydrophobicContact CZ3-CG 3.86Å; L62-P72 HydrophobicContact CD1-CB 3.28Å; L62-P72 VanDerWaalsContact CD1-O 3.28Å; L62-P72 WeakPolarHBondContact CD1-O 3.31Å; L66-P72 HydrophobicContact CD2-CB 3.86Å; L66-P72 HydrophobicContact CD2-CG 3.71Å
73	W	59.3	Low	47.2	Very low	99 Å²	99	101.2 Å²	101.2	38%	0.375	53%	0.528	S	S	.	.			trans	-76.6	150.3	-171.1	63	89.7	0	0	0	113.9	W28 K65 E71	W28-W73 AromaticContact CD1-CZ3 3.83Å; K65-W73 PolarHBondContact NZ-O 3.27Å; E71-W73 HydrophobicContact CB-CD2 4.45Å; E71-W73 HydrophobicContact CB-CE3 3.74Å; E71-W73 HydrophobicContact CB-CH2 3.58Å; E71-W73 HydrophobicContact CB-CZ2 4.25Å; E71-W73 HydrophobicContact CB-CZ3 3.27Å; E71-W73 VanDerWaalsContact CD-CH2 3.4Å; E71-W73 HydrophobicContact CG-CH2 4.1Å; E71-W73 HydrophobicContact CG-CZ3 4.02Å; E71-W73 PolarHBondContact O-N 3.03Å; E71-W73 WeakPolarHBondContact OE2-CH2 3.38Å
74	I	37.6	Very low	44.8	Very low	102 Å²	102	107 Å²	107	52%	0.523	57%	0.567	S	S	.	*			trans	-96	118.7	-177.2	-57.1	172.8	0	0	0	109.7	K65	K65-I74 VanDerWaalsContact NZ-CA 3.29Å
75	I	30.1	Very low	43	Very low	139 Å²	139	106.4 Å²	106.4	71%	0.713	58%	0.575	S	S	*	*			trans	-109.2	120.9	156.5	-58.6	175.8	0	0	0	106	A77	I75-A77 PolarHBondContact O-N 3.23Å
76	N	29.4	Very low	41.2	Very low	145 Å²	145	109.4 Å²	109.4	78%	0.775	59%	0.59	S	S	*	*			trans	-64.1	121.6	172.9	-73.4	-38.4	0	0	0	109.7
77	A	26.1	Very low	39.5	Very low	103 Å²	103	115.6 Å²	115.6	85%	0.851	62%	0.623	S	S	*	*			trans	164	141.1	136.7	0	0	0	0	0	116	I75	I75-A77 PolarHBondContact O-N 3.23Å
78	K	26.8	Very low	37.4	Very low	202 Å²	202	120.1 Å²	120.1	88%	0.878	64%	0.636	S	S	*	*			trans	-16.2	137.3	162.9	-70.9	166.2	174.4	174.3	0	121.8
79	I	25.5	Very low	35.8	Very low	163 Å²	163	121 Å²	121	84%	0.836	64%	0.638	S	S	*	*			trans	10.7	124.2	141.1	-50.3	168.3	0	0	0	118.6
80	S	22	Very low	34.3	Very low	92 Å²	92	124 Å²	124	64%	0.643	64%	0.639	S	S	*	*				162.9	133.9	107.4	-160.8	0	0	0	0	114.4
81	T	24.8	Very low	33	Very low	117 Å²	117	128 Å²	128	72%	0.718	65%	0.651	S	S	*	*			trans	55.2	121.5	146.4	45.2	0	0	0	0	123.6
82	Q	25.8	Very low	31.6	Very low	175 Å²	175	131.1 Å²	131.1	82%	0.818	66%	0.66	S	S	*	*			trans	87.5	133	131.1	-97.3	-175.7	15.5	0	0	122.3
83	I	24.7	Very low	30.5	Very low	163 Å²	163	139 Å²	139	84%	0.836	69%	0.688	S	S	*	*			trans	109.2	138.6	154.9	-58.4	152.7	0	0	0	117.1
84	C	25.8	Very low	29.2	Very low	121 Å²	121	142.2 Å²	142.2	82%	0.818	71%	0.705	S	S	*	*			trans	-75.4	175.9	-160.8	-113.6	0	0	0	0	116
85	P	37	Very low	28.8	Very low	104 Å²	104	142 Å²	142	68%	0.675	71%	0.712	S	S	*	*			trans	-98	147.9	-155.5	37.6	-35.3	0	0	0	115.1
86	E	29	Very low	28.9	Very low	106 Å²	106	142.8 Å²	142.8	50%	0.495	71%	0.713	S	S	.	*			trans	-142.7	24.7	172.1	-101.4	-58.6	-173.6	0	0	117.7	K89	E86-K89 IonicContact OE1-NZ 3.06Å; E86-K89 PolarHBondContact OE1-NZ 3.07Å; E86-K89 WeakPolarHBondContact OE2-CD 2.88Å; E86-K89 IonicContact OE2-NZ 2.69Å
87	D	32.4	Very low	28.9	Very low	136 Å²	136	142.9 Å²	142.9	73%	0.727	71%	0.714	S	S	*	*	S	Bend	trans	-100	-8.3	-174.3	-70.8	-23.1	0	0	0	116.9
88	W	31.7	Very low	28.9	Very low	201 Å²	201	147 Å²	147	76%	0.761	72%	0.715	S	S	*	*	H	α-helix	trans	-82.7	-20.5	-179.3	82.9	-66.7	0	0	0	113.9	E90	W88-E90 VanDerWaalsContact C-N 3.31Å
89	K	30.4	Very low	28.9	Very low	104 Å²	104	144.9 Å²	144.9	45%	0.452	71%	0.714	S	S	.	*	H	α-helix	trans	-74.5	-22.9	177.2	-72.1	-175.3	-167.4	154.6	0	112.6	E86 R93	E86-K89 IonicContact OE1-NZ 3.06Å; E86-K89 PolarHBondContact OE1-NZ 3.07Å; E86-K89 WeakPolarHBondContact OE2-CD 2.88Å; E86-K89 IonicContact OE2-NZ 2.69Å; K89-R93 PolarHBondContact O-N 3.06Å
90	E	30.1	Very low	28.9	Very low	109 Å²	109	143 Å²	143	51%	0.509	71%	0.709	S	S	.	*	H	α-helix	trans	-82.1	-31.2	-177.2	-143.5	165.7	-147.5	0	0	112.4	W88 Y92 K94	W88-E90 VanDerWaalsContact C-N 3.31Å; E90-Y92 VanDerWaalsContact C-N 3.34Å; E90-K94 PolarHBondContact O-N 3.29Å
91	W	32.8	Very low	29.1	Very low	202 Å²	202	146.8 Å²	146.8	77%	0.765	72%	0.717	S	S	*	*	H	α-helix	trans	-65.8	-35.3	168.6	-171.9	81.9	0	0	0	112.4
92	Y	31.3	Very low	29.1	Very low	159 Å²	159	151 Å²	151	62%	0.624	72%	0.72	S	S	*	*	H	α-helix	trans	-74.6	-32.7	179.7	-159.7	-99.1	0	0	0	113.2	E90	E90-Y92 VanDerWaalsContact C-N 3.34Å
93	R	28.8	Very low	29.1	Very low	176 Å²	176	148.4 Å²	148.4	66%	0.664	72%	0.721	S	S	*	*	H	α-helix	trans	-69.9	-37	174.4	-99.2	-172.5	-75.6	177.3	-0.6	112.7	K89 S95 Q96	K89-R93 PolarHBondContact O-N 3.06Å; R93-S95 VanDerWaalsContact C-N 3.25Å; R93-S95 PolarHBondContact O-N 2.9Å; R93-Q96 PolarHBondContact O-N 3.21Å
94	K	31.1	Very low	29	Very low	168 Å²	168	149.2 Å²	149.2	73%	0.73	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-11.5	179.5	-77.1	-178.2	176.4	175.4	0	115.1	E90	E90-K94 PolarHBondContact O-N 3.29Å
95	S	30.1	Very low	29	Very low	96 Å²	96	151.4 Å²	151.4	67%	0.671	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-0.8	176.9	-177.2	0	0	0	0	114	R93	R93-S95 VanDerWaalsContact C-N 3.25Å; R93-S95 PolarHBondContact O-N 2.9Å
96	Q	30.7	Very low	28.5	Very low	157 Å²	157	158 Å²	158	73%	0.734	73%	0.729	S	S	*	*	S	Bend	trans	-100.7	-7.4	178.5	-80.3	-159.8	-36.8	0	0	115.1	R93	R93-Q96 PolarHBondContact O-N 3.21Å
97	D	29.9	Very low	28.5	Very low	147 Å²	147	160.2 Å²	160.2	79%	0.786	75%	0.745	S	S	*	*			trans	-108.4	81.6	175.2	-79.1	-39	0	0	0	111.3
98	E	26.3	Very low	28.8	Very low	189 Å²	189	160 Å²	160	88%	0.883	75%	0.748	S	S	*	*			trans	-133.7	102.4	147.7	-83.8	-165.1	165.3	0	0	108.7
99	N	27	Very low	28.9	Very low	157 Å²	157	159.5 Å²	159.5	84%	0.84	75%	0.752	S	S	*	*			trans	-71.5	117.7	177.7	-142	-13.9	0	0	0	108.7
100	V	26.1	Very low	29.1	Very low	123 Å²	123	158.4 Å²	158.4	75%	0.745	77%	0.77	S	S	*	*			trans	-114.8	107.5	165.5	178.5	0	0	0	0	108.2	R102	V100-R102 PolarHBondContact O-N 3.35Å
101	Q	25.4	Very low	29	Very low	173 Å²	173	162.6 Å²	162.6	81%	0.808	79%	0.787	S	S	*	*			trans	-43.3	122.8	171.2	-114.2	101.6	-32	0	0	111.3
102	R	25.6	Very low	28.7	Very low	206 Å²	206	161.2 Å²	161.2	78%	0.777	79%	0.793	S	S	*	*			trans	-104.9	110.3	164	-72.4	-178	-177.9	134.8	3.7	108.5	V100 Y104	V100-R102 PolarHBondContact O-N 3.35Å; R102-Y104 HydrophobicContact CB-CE2 4.28Å
103	S	24.5	Very low	28.3	Very low	119 Å²	119	159 Å²	159	83%	0.832	80%	0.801	S	S	*	*			trans	-79.6	133.8	166.4	58.1	0	0	0	0	109.7
104	Y	23.5	Very low	27.9	Very low	180 Å²	180	159.7 Å²	159.7	71%	0.706	81%	0.814	S	S	*	*			trans	-106.1	120.5	177	-73.6	-90.1	0	0	0	108.9	R102	R102-Y104 HydrophobicContact CB-CE2 4.28Å
105	N	25.8	Very low	27.5	Very low	167 Å²	167	157.7 Å²	157.7	89%	0.893	82%	0.816	S	S	*	*			trans	-110.4	129.7	163.5	-82.6	-33.2	0	0	0	109.5
106	R	25.5	Very low	27.2	Very low	242 Å²	242	164 Å²	164	91%	0.913	83%	0.825	S	S	*	*			trans	-111	121.5	-171.5	-170.2	-177.8	-165.1	176.4	3.7	108.9
107	N	30.2	Very low	26.8	Very low	153 Å²	153	162.4 Å²	162.4	82%	0.818	83%	0.826	S	S	*	*			trans	-123.2	156.2	166	-88.6	-7.1	0	0	0	111.6	F109	N107-F109 VanDerWaalsContact C-N 3.26Å; N107-F109 PolarHBondContact O-N 3.41Å
108	V	38.1	Very low	26.4	Very low	131 Å²	131	163.3 Å²	163.3	79%	0.794	83%	0.826	S	S	*	*	S	Bend	trans	-67.4	6.9	-145.8	176	0	0	0	0	117.4
109	F	33.4	Very low	26.3	Very low	191 Å²	191	160.6 Å²	160.6	84%	0.838	82%	0.821	S	S	*	*	S	Bend	trans	-129.3	40.5	-178.2	-74.7	-80.8	0	0	0	115.6	N107 K111	N107-F109 VanDerWaalsContact C-N 3.26Å; N107-F109 PolarHBondContact O-N 3.41Å; F109-K111 PolarHBondContact O-N 3.36Å
110	G	36.2	Very low	26	Very low	81 Å²	81	158.1 Å²	158.1	84%	0.835	82%	0.817	S	S	*	*			trans	52.6	34.3	146.1	0	0	0	0	0	119.2
111	K	27.8	Very low	26	Very low	198 Å²	198	158.6 Å²	158.6	86%	0.861	82%	0.822	S	S	*	*			trans	-132.9	123.5	170.4	-79.5	178.8	179	172.8	0	111	F109	F109-K111 PolarHBondContact O-N 3.36Å
112	L	24.9	Very low	25.9	Very low	172 Å²	172	161.9 Å²	161.9	90%	0.901	83%	0.827	S	S	*	*			trans	-91.3	116.5	171.2	-77	161.4	0	0	0	109.3
113	S	23	Very low	25.9	Very low	112 Å²	112	160 Å²	160	78%	0.783	83%	0.827	S	S	*	*			trans	-113.9	142.1	169.8	55.2	0	0	0	0	109.9
114	M	22.1	Very low	25.9	Very low	191 Å²	191	164.1 Å²	164.1	94%	0.941	82%	0.824	S	S	*	*			trans	-117.8	110	176	-171.1	162.4	65	0	0	108.9
115	T	21.7	Very low	25.9	Very low	127 Å²	127	162.3 Å²	162.3	78%	0.779	83%	0.826	S	S	*	*			trans	-96.9	137	171.2	45.3	0	0	0	0	109.5
116	R	23	Very low	25.8	Very low	227 Å²	227	160.8 Å²	160.8	86%	0.857	81%	0.813	S	S	*	*			trans	-111.7	105.5	174.5	-162	177.3	-175.4	173.7	1.3	108.4
117	T	23	Very low	25.7	Very low	124 Å²	124	156.9 Å²	156.9	76%	0.761	80%	0.803	S	S	*	*			trans	-84.1	127.1	172	39.8	0	0	0	0	109.5
118	H	22.3	Very low	25.4	Very low	167 Å²	167	156.2 Å²	156.2	77%	0.773	80%	0.795	S	S	*	*			trans	-92.9	121.7	165.4	-90	-84.4	0	0	0	108.1
119	V	23	Very low	24.8	Very low	131 Å²	131	156.2 Å²	156.2	79%	0.794	79%	0.791	S	S	*	*			trans	-109.6	119.4	168.1	179	0	0	0	0	107.3
120	S	21.3	Very low	24.4	Very low	106 Å²	106	153.3 Å²	153.3	74%	0.741	79%	0.788	S	S	*	*			trans	-101.4	139	168.6	-64.5	0	0	0	0	109.5
121	P	26.3	Very low	23.7	Very low	133 Å²	133	155.6 Å²	155.6	86%	0.864	79%	0.79	S	S	*	*			trans	-80.3	141.7	166.2	-13.1	29.9	0	0	0	112.2
122	R	23.4	Very low	23.5	Very low	242 Å²	242	149.3 Å²	149.3	91%	0.913	78%	0.781	S	S	*	*			trans	-107.8	151	-177.3	-134.4	-174.1	-174.6	-166.5	2	110.1
123	Q	25.1	Very low	23.4	Very low	165 Å²	165	146.5 Å²	146.5	77%	0.771	77%	0.771	S	S	*	*			trans	176.3	137.5	141.9	-99.1	-177.8	37.3	0	0	108.2
124	R	24.8	Very low	23.4	Very low	206 Å²	206	149.3 Å²	149.3	78%	0.777	77%	0.772	S	S	*	*			cis	-152.4	136.9	8.6	-92.2	173.1	-167.5	-166.1	-1.5	109
125	L	22.6	Very low	23.4	Very low	142 Å²	142	145.5 Å²	145.5	74%	0.743	76%	0.759	S	S	*	*				55.9	126.5	111.9	-103.9	72.4	0	0	0	116.5
126	H	23.8	Very low	23.4	Very low	135 Å²	135	144.8 Å²	144.8	63%	0.625	75%	0.754	S	S	*	*				-164.4	143.8	54.7	-113.9	-39.3	0	0	0	115.4
127	K	23.9	Very low	23.5	Very low	161 Å²	161	142.6 Å²	142.6	70%	0.7	75%	0.754	S	S	*	*			trans	51.7	145	134.9	-75.7	172.7	174.3	179.3	0	120.9
128	H	24.6	Very low	23.4	Very low	139 Å²	139	143.7 Å²	143.7	64%	0.644	76%	0.755	S	S	*	*			cis	-164.9	149.2	13.8	-125.4	-72.4	0	0	0	110.6
129	N	24.2	Very low	23.3	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	75%	0.754	S	S	*	*			trans	32.9	150.2	144.9	-61.3	1.8	0	0	0	122.5
130	T	25	Very low	23.3	Very low	129 Å²	129	140.2 Å²	140.2	79%	0.791	76%	0.755	S	S	*	*			cis	-155.5	136.5	36.9	35.6	0	0	0	0	108.7
131	C	21.1	Very low	23.2	Very low	130 Å²	130	140.4 Å²	140.4	88%	0.878	76%	0.757	S	S	*	*				62.5	124.9	74	-156.5	0	0	0	0	118.3
132	G	23.4	Very low	23	Very low	65 Å²	65	138.8 Å²	138.8	67%	0.67	75%	0.749	S	S	*	*			trans	141.4	78.2	156.3	0	0	0	0	0	114.8
133	T	24.1	Very low	22.9	Very low	113 Å²	113	138 Å²	138	69%	0.693	75%	0.746	S	S	*	*				78.5	121.9	84.3	51.1	0	0	0	0	119
134	H	22.9	Very low	22.8	Very low	172 Å²	172	137 Å²	137	80%	0.796	74%	0.744	S	S	*	*			trans	68	150	142	-69.6	-70.7	0	0	0	118.3
135	V	21.6	Very low	22.7	Very low	110 Å²	110	136.1 Å²	136.1	67%	0.667	75%	0.746	S	S	*	*			cis	-169	137.6	-1	128.9	0	0	0	0	108.4
136	V	22.8	Very low	22.7	Very low	113 Å²	113	136 Å²	136	69%	0.685	75%	0.751	S	S	*	*			trans	34.4	123	139.9	-154.4	0	0	0	0	120.3
137	Q	23.5	Very low	22.8	Very low	181 Å²	181	140.6 Å²	140.6	85%	0.846	76%	0.763	S	S	*	*				171.8	119.8	106.7	-88.1	-172.7	-3.7	0	0	114.8
138	N	20.9	Very low	22.8	Very low	147 Å²	147	142.2 Å²	142.2	79%	0.786	77%	0.77	S	S	*	*			trans	19.5	128.1	140.3	-74.8	-7.5	0	0	0	123.8
139	S	21.6	Very low	22.9	Very low	106 Å²	106	143 Å²	143	74%	0.741	78%	0.779	S	S	*	*			trans	63.7	119.8	131.1	60.8	0	0	0	0	121.3
140	S	21.6	Very low	23.1	Very low	118 Å²	118	141.6 Å²	141.6	83%	0.825	78%	0.777	S	S	*	*				175.9	126.9	111.4	-73.3	0	0	0	0	113.7
141	S	20.9	Very low	23.2	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	78%	0.777	S	S	*	*			trans	34.1	124.1	143.7	-104.1	0	0	0	0	124.3
142	S	21	Very low	23.7	Very low	99 Å²	99	147.3 Å²	147.3	69%	0.692	78%	0.777	S	S	*	*				93.3	123.1	118.8	-70.3	0	0	0	0	122.7
143	R	22	Very low	23.9	Very low	225 Å²	225	153.4 Å²	153.4	85%	0.849	79%	0.785	S	S	*	*			trans	95.3	106	143.5	-70.2	178.3	-158.2	-172.6	7	121.7
144	I	22.5	Very low	24.4	Very low	145 Å²	145	157.2 Å²	157.2	74%	0.744	80%	0.795	S	S	*	*				65.2	110.3	120.5	-59.8	171.4	0	0	0	119.9
145	F	23.7	Very low	24.8	Very low	187 Å²	187	153.5 Å²	153.5	82%	0.82	79%	0.788	S	S	*	*			trans	44	112.2	142.9	-82.3	-96.2	0	0	0	121.1
146	V	22.4	Very low	25.1	Very low	139 Å²	139	157.4 Å²	157.4	84%	0.842	79%	0.792	S	S	*	*				-138.2	127.1	129.7	178.2	0	0	0	0	109.7
147	R	26.1	Very low	25.4	Very low	232 Å²	232	161.1 Å²	161.1	88%	0.875	80%	0.799	S	S	*	*			trans	-70.3	118.4	174.2	-174.5	-175.4	-169.5	-176.1	2.6	110
148	K	23.4	Very low	25.6	Very low	195 Å²	195	160 Å²	160	85%	0.848	79%	0.794	S	S	*	*			trans	-144.1	102.6	150.3	-77.5	-168.9	178.6	177.2	0	108.5
149	N	27.3	Very low	26.1	Very low	154 Å²	154	155.7 Å²	155.7	82%	0.824	78%	0.775	S	S	*	*			trans	-75.4	133.7	149.8	-119.7	-11.5	0	0	0	105.4
150	P	26.3	Very low	26.5	Very low	103 Å²	103	161 Å²	161	67%	0.669	78%	0.78	S	S	*	*				-140.1	145.2	102.3	25.3	-5.6	0	0	0	114
151	D	28.4	Very low	27	Very low	148 Å²	148	164.4 Å²	164.4	79%	0.791	78%	0.781	S	S	*	*			trans	56.1	92.7	150.6	-60.9	-47.1	0	0	0	119.9
152	R	31.2	Very low	27.5	Very low	231 Å²	231	166 Å²	166	87%	0.872	77%	0.774	S	S	*	*			trans	-168.6	81.9	133.8	-109.9	-178.5	-171.4	-166.8	3.8	110.1
153	F	28.5	Very low	27.9	Very low	193 Å²	193	170.2 Å²	170.2	85%	0.846	78%	0.78	S	S	*	*			trans	-155.5	45.5	150.3	-91.1	-66.8	0	0	0	110.6	S155	F153-S155 PolarHBondContact O-N 3.12Å; F153-S155 VanDerWaalsContact O-N 3.13Å
154	H	33.8	Very low	28.4	Very low	193 Å²	193	168.8 Å²	168.8	89%	0.894	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	70.6	157.7	-140.2	-30.9	0	0	0	108
155	S	30.7	Very low	28.9	Very low	93 Å²	93	168.8 Å²	168.8	65%	0.65	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157	4.7	164.4	97.1	0	0	0	0	115.8	F153	F153-S155 PolarHBondContact O-N 3.12Å; F153-S155 VanDerWaalsContact O-N 3.13Å
156	Y	28.9	Very low	29.1	Very low	193 Å²	193	171.5 Å²	171.5	76%	0.757	78%	0.784	S	S	*	*	S	Bend	trans	-116.6	28.4	178.5	-141.6	-94.4	0	0	0	113.9
157	K	29.3	Very low	29.3	Very low	191 Å²	191	173.4 Å²	173.4	83%	0.83	78%	0.783	S	S	*	*	S	Bend	trans	-117.5	-0.5	174.3	-112.7	-179	179.1	-178.8	0	115
158	E	28.1	Very low	29.9	Very low	157 Å²	157	168.4 Å²	168.4	73%	0.734	78%	0.784	S	S	*	*	S	Bend	trans	-106.2	-6.1	173.6	-78.5	-178.8	149.8	0	0	114.2	Y160 F162	E158-Y160 PolarHBondContact O-N 3.32Å; E158-F162 PolarHBondContact O-N 3.15Å
159	S	31.1	Very low	30.2	Very low	57 Å²	57	164 Å²	164	40%	0.399	78%	0.777	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.1	-1.8	-177	57.6	0	0	0	0	115
160	Y	30	Very low	30.8	Very low	217 Å²	217	164.8 Å²	164.8	85%	0.851	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	-7.5	175.9	-146.5	-94.3	0	0	0	114.4	E158	E158-Y160 PolarHBondContact O-N 3.32Å
161	F	32.5	Very low	31.4	Very low	189 Å²	189	165.8 Å²	165.8	83%	0.829	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	-5.1	173.5	-105.6	-87.7	0	0	0	114.8
162	F	29.8	Very low	32.2	Very low	144 Å²	144	167 Å²	167	63%	0.632	78%	0.775	S	S	*	*	S	Bend	trans	-119.3	48.6	173.4	-105.8	-78.6	0	0	0	114.3	E158 Q165	E158-F162 PolarHBondContact O-N 3.15Å; F162-Q165 HydrophobicContact CE1-CB 4.28Å
163	K	29.5	Very low	33.1	Very low	188 Å²	188	160.2 Å²	160.2	82%	0.817	76%	0.756	S	S	*	*	S	Bend	trans	-120.6	21.7	160.5	-91.7	-175.6	-179.3	174.2	0	113.6
164	H	31.9	Very low	34.5	Very low	196 Å²	196	152 Å²	152	91%	0.907	72%	0.722	S	S	*	*	S	Bend	trans	-121.7	31.8	167.1	-97.1	-68.9	0	0	0	113.4
165	Q	34.2	Very low	35.6	Very low	145 Å²	145	147.4 Å²	147.4	68%	0.678	70%	0.703	S	S	*	*			trans	-141.4	89.2	159.5	-132	163.2	7.3	0	0	108.9	F162	F162-Q165 HydrophobicContact CE1-CB 4.28Å
166	R	27.6	Very low	37.2	Very low	244 Å²	244	143 Å²	143	92%	0.921	67%	0.673	S	S	*	*			trans	-116.3	126.3	155.8	-87.2	-168.9	154.3	-167.5	-8	106.8	S168	R166-S168 PolarHBondContact O-N 3.07Å
167	H	26.4	Very low	38.9	Very low	179 Å²	179	141.5 Å²	141.5	83%	0.829	68%	0.677	S	S	*	*			trans	-45.9	133.2	176.5	-82	-104.3	0	0	0	111.4	S169	H167-S169 PolarHBondContact O-N 3.12Å
168	S	38.7	Very low	40.2	Very low	126 Å²	126	137.9 Å²	137.9	88%	0.881	66%	0.664	S	S	*	*			trans	-49.4	116.5	161.5	167.4	0	0	0	0	110.4	R166	R166-S168 PolarHBondContact O-N 3.07Å
169	S	29.1	Very low	41.7	Very low	102 Å²	102	132.9 Å²	132.9	71%	0.713	65%	0.645	S	S	*	*			trans	-143.8	91.7	159.9	42.2	0	0	0	0	108.7	H167 E171	H167-S169 PolarHBondContact O-N 3.12Å; S169-E171 PolarHBondContact O-N 3.27Å
170	L	40.8	Very low	43.2	Very low	171 Å²	171	132.8 Å²	132.8	90%	0.895	65%	0.653	S	S	*	*			trans	35.6	64.4	161.3	-78.6	144.9	0	0	0	117.2
171	E	38.4	Very low	44.6	Very low	124 Å²	124	128.3 Å²	128.3	58%	0.579	64%	0.638	S	S	*	*			trans	-87.8	105.2	158	-84.5	-170.4	148.2	0	0	108.5	S169 N173 R184	S169-E171 PolarHBondContact O-N 3.27Å; E171-N173 PolarHBondContact O-N 3.21Å; E171-R184 IonicContact OE1-CZ 3.28Å; E171-R184 IonicContact OE1-NE 3.58Å; E171-R184 PolarHBondContact OE1-NE 3.46Å; E171-R184 IonicContact OE1-NH2 3.93Å; E171-R184 PolarHBondContact OE1-NH2 3.49Å
172	K	46.4	Very low	45.7	Very low	173 Å²	173	122.2 Å²	122.2	75%	0.752	62%	0.623	S	S	*	*			trans	-59	95.4	170.5	-83.1	-178	177	178.7	0	109.3
173	N	50	Low	47.5	Very low	90 Å²	90	117.1 Å²	117.1	48%	0.481	60%	0.601	S	S	.	*			trans	-74.6	128.5	174.1	-75.4	-40.2	0	0	0	110.5	E171 A182	E171-N173 PolarHBondContact O-N 3.21Å; N173-A182 HydrophobicContact CB-CB 4.27Å
174	C	57.9	Low	48.9	Very low	21 Å²	21	116.5 Å²	116.5	14%	0.142	59%	0.593	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.9	112.9	176.7	-59.9	0	0	0	0	109	F183 K186 L189	C174-F183 PolarHBondContact N-O 3.19Å; C174-F183 PolarHBondContact O-N 3.46Å; C174-K186 WeakPolarHBondContact SG-CG 3.42Å; C174-K186 PolarHBondContact SG-N 3.3Å; C174-K186 VanDerWaalsContact SG-N 3.38Å; C174-L189 HydrophobicContact CB-CB 4.05Å; C174-L189 HydrophobicContact CB-CD2 3.73Å
175	I	56	Low	50	Low	95 Å²	95	109.3 Å²	109.3	49%	0.487	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.6	136.9	-174.7	-57.6	169.7	0	0	0	109.9	N177 K181 A182	I175-N177 PolarHBondContact O-N 3.11Å; I175-K181 WeakPolarHBondContact CA-O 3.27Å; I175-A182 HydrophobicContact CG1-CB 4.27Å
176	C	65.5	Low	51	Low	2 Å²	2	110.2 Å²	110.2	1%	0.014	57%	0.566	C	S	.	*			trans	-79.4	115.3	170.1	178	0	0	0	0	109.9	E178 C179 G180 K181 F183 L189 H196	C176-E178 PolarHBondContact O-N 3.44Å; C176-C179 PolarHBondContact O-N 3.3Å; C176-G180 VanDerWaalsContact O-CA 3.25Å; C176-G180 WeakPolarHBondContact O-CA 3.24Å; C176-G180 PolarHBondContact O-N 3Å; C176-K181 PolarHBondContact N-O 3.45Å; C176-F183 HydrophobicContact CB-CE2 4.16Å; C176-L189 HydrophobicContact CB-CD1 3.55Å; C176-H196 PolarHBondContact SG-NE2 2.84Å; C176-H196 VanDerWaalsContact SG-NE2 3.4Å
177	N	62.8	Low	52.6	Low	160 Å²	160	102.5 Å²	102.5	86%	0.856	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-21	-178	-64.1	-12.6	0	0	0	113.6	I175	I175-N177 PolarHBondContact O-N 3.11Å
178	E	56.5	Low	54.1	Low	116 Å²	116	98.4 Å²	98.4	54%	0.542	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-24	-178.9	-66.1	-178.8	-171.9	0	0	114.1	C176 F193 H196	C176-E178 PolarHBondContact O-N 3.44Å; E178-F193 HydrophobicContact CG-CE2 4.43Å; E178-F193 WeakPolarHBondContact OE1-CE2 3.36Å; E178-H196 WeakPolarHBondContact OE2-CB 3.35Å; E178-H196 IonicContact OE2-CD2 3.46Å; E178-H196 PolarHBondContact OE2-CD2 3.46Å; E178-H196 IonicContact OE2-CG 3.98Å; E178-H196 IonicContact OE2-ND1 3.37Å; E178-H196 IonicContact OE2-NE2 3.88Å
179	C	61.6	Low	55.4	Low	51 Å²	51	94.1 Å²	94.1	35%	0.345	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	6.5	-177.7	75.6	0	0	0	0	114.9	C176 K181 H192	C176-C179 PolarHBondContact O-N 3.3Å; C179-K181 PolarHBondContact O-N 2.85Å; C179-K181 VanDerWaalsContact O-N 3.14Å; C179-H192 PolarHBondContact SG-NE2 3.37Å
180	G	60.9	Low	57.1	Low	55 Å²	55	93 Å²	93	57%	0.567	49%	0.486	S	S	*	.			trans	68.3	6.2	176.4	0	0	0	0	0	115.6	C176 A182	C176-G180 VanDerWaalsContact O-CA 3.25Å; C176-G180 WeakPolarHBondContact O-CA 3.24Å; C176-G180 PolarHBondContact O-N 3Å; G180-A182 PolarHBondContact O-N 3.17Å
181	K	59.6	Low	58.1	Low	123 Å²	123	87.1 Å²	87.1	54%	0.535	46%	0.458	S	S	.	.			trans	-75.5	127.4	-177	-71.2	179.5	-175.5	171.6	0	111.5	I175 C176 C179 F183	I175-K181 WeakPolarHBondContact CA-O 3.27Å; C176-K181 PolarHBondContact N-O 3.45Å; C179-K181 PolarHBondContact O-N 2.85Å; C179-K181 VanDerWaalsContact O-N 3.14Å; K181-F183 HydrophobicContact CB-CE2 3.67Å; K181-F183 HydrophobicContact CB-CZ 3.85Å; K181-F183 WeakPolarHBondContact O-CD2 3.4Å; K181-F183 VanDerWaalsContact O-CE2 3.25Å; K181-F183 WeakPolarHBondContact O-CE2 3.45Å
182	A	57.1	Low	59.4	Low	61 Å²	61	82.1 Å²	82.1	50%	0.504	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	135.4	175.5	0	0	0	0	0	111.5	N173 I175 G180	N173-A182 HydrophobicContact CB-CB 4.27Å; I175-A182 HydrophobicContact CG1-CB 4.27Å; G180-A182 PolarHBondContact O-N 3.17Å
183	F	67.7	Low	60	Low	38 Å²	38	78.1 Å²	78.1	17%	0.167	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	147.7	178.2	-62.7	-86.3	0	0	0	110.6	C174 C176 K181 C185 Q188 L189 H192	C174-F183 PolarHBondContact N-O 3.19Å; C174-F183 PolarHBondContact O-N 3.46Å; C176-F183 HydrophobicContact CB-CE2 4.16Å; K181-F183 HydrophobicContact CB-CE2 3.67Å; K181-F183 HydrophobicContact CB-CZ 3.85Å; K181-F183 WeakPolarHBondContact O-CD2 3.4Å; K181-F183 VanDerWaalsContact O-CE2 3.25Å; K181-F183 WeakPolarHBondContact O-CE2 3.45Å; F183-C185 PolarHBondContact O-N 2.85Å; F183-Q188 HydrophobicContact CB-CB 4.07Å; F183-Q188 HydrophobicContact CD1-CB 4.02Å; F183-Q188 HydrophobicContact CG-CB 4.35Å; F183-L189 HydrophobicContact CB-CB 4.26Å; F183-L189 HydrophobicContact CD2-CB 4.03Å; F183-L189 HydrophobicContact CD2-CD1 3.65Å; F183-L189 HydrophobicContact CD2-CG 4.44Å; F183-L189 HydrophobicContact CE2-CD1 3.89Å; F183-L189 HydrophobicContact CG-CB 4.29Å; F183-H192 HydrophobicContact CE1-CB 3.8Å; F183-H192 AromaticContact CE1-CG 3.94Å; F183-H192 HydrophobicContact CE2-CB 3.86Å; F183-H192 AromaticContact CE2-CD2 3.34Å; F183-H192 WeakPolarHBondContact CE2-CD2 3.41Å; F183-H192 AromaticContact CE2-CG 3.53Å; F183-H192 AromaticContact CE2-NE2 3.96Å; F183-H192 HydrophobicContact CZ-CB 3.42Å; F183-H192 VanDerWaalsContact CZ-CB 3.42Å; F183-H192 AromaticContact CZ-CD2 3.4Å; F183-H192 WeakPolarHBondContact CZ-CD2 3.43Å; F183-H192 AromaticContact CZ-CE1 3.93Å; F183-H192 AromaticContact CZ-CG 3.09Å; F183-H192 AromaticContact CZ-ND1 3.47Å; F183-H192 WeakPolarHBondContact CZ-ND1 3.35Å; F183-H192 AromaticContact CZ-NE2 3.89Å
184	R	57	Low	61.1	Low	174 Å²	174	76.2 Å²	76.2	66%	0.657	40%	0.403	S	S	*	.	S	Bend	trans	-68.1	-23.4	-177.1	-169.1	175.5	-176.2	-160.2	-3.4	113.2	E171	E171-R184 IonicContact OE1-CZ 3.28Å; E171-R184 IonicContact OE1-NE 3.58Å; E171-R184 PolarHBondContact OE1-NE 3.46Å; E171-R184 IonicContact OE1-NH2 3.93Å; E171-R184 PolarHBondContact OE1-NH2 3.49Å
185	C	56.2	Low	61.2	Low	45 Å²	45	80.7 Å²	80.7	30%	0.304	42%	0.424	S	S	.	.	S	Bend	trans	-153.5	157.9	178.3	60.3	0	0	0	0	112.7	F183 S187 Q188 L189	F183-C185 PolarHBondContact O-N 2.85Å; C185-S187 VanDerWaalsContact C-N 3.27Å; C185-S187 PolarHBondContact O-N 2.66Å; C185-S187 PolarHBondContact SG-OG 2.98Å; C185-Q188 PolarHBondContact O-N 3.3Å; C185-Q188 VanDerWaalsContact O-N 3.11Å; C185-Q188 VanDerWaalsContact SG-CD 3.57Å; C185-Q188 VanDerWaalsContact SG-CG 3.54Å; C185-L189 PolarHBondContact O-N 3.13Å
186	K	54.9	Low	61.3	Low	164 Å²	164	79.7 Å²	79.7	71%	0.713	42%	0.417	S	S	*	.	H	α-helix	trans	-56.8	-36.2	-178.4	-67.7	-175.9	179.3	178.5	0	112.7	C174 Q188 L189 V190	C174-K186 WeakPolarHBondContact SG-CG 3.42Å; C174-K186 PolarHBondContact SG-N 3.3Å; C174-K186 VanDerWaalsContact SG-N 3.38Å; K186-Q188 VanDerWaalsContact C-N 3.33Å; K186-Q188 PolarHBondContact O-N 3.47Å; K186-L189 PolarHBondContact O-N 3.25Å; K186-V190 WeakPolarHBondContact O-CG2 3.35Å; K186-V190 PolarHBondContact O-N 3.28Å
187	S	62.3	Low	61.1	Low	82 Å²	82	82.8 Å²	82.8	57%	0.573	44%	0.436	S	S	*	.	H	α-helix	trans	-65.7	-32.8	179	60.3	0	0	0	0	113.5	C185 V191	C185-S187 VanDerWaalsContact C-N 3.27Å; C185-S187 PolarHBondContact O-N 2.66Å; C185-S187 PolarHBondContact SG-OG 2.98Å; S187-V191 WeakPolarHBondContact O-CG2 3.32Å; S187-V191 PolarHBondContact O-N 2.9Å
188	Q	55.9	Low	61	Low	94 Å²	94	77.6 Å²	77.6	44%	0.439	42%	0.421	S	S	.	.	H	α-helix	trans	-73.1	-38.2	173.4	-71.2	173.4	5.4	0	0	111.6	F183 C185 K186 V191 H192	F183-Q188 HydrophobicContact CB-CB 4.07Å; F183-Q188 HydrophobicContact CD1-CB 4.02Å; F183-Q188 HydrophobicContact CG-CB 4.35Å; C185-Q188 PolarHBondContact O-N 3.3Å; C185-Q188 VanDerWaalsContact O-N 3.11Å; C185-Q188 VanDerWaalsContact SG-CD 3.57Å; C185-Q188 VanDerWaalsContact SG-CG 3.54Å; K186-Q188 VanDerWaalsContact C-N 3.33Å; K186-Q188 PolarHBondContact O-N 3.47Å; Q188-V191 PolarHBondContact O-N 3.28Å; Q188-H192 WeakPolarHBondContact O-CB 3.39Å; Q188-H192 PolarHBondContact O-N 2.81Å
189	L	66.2	Low	61.2	Low	36 Å²	36	77.5 Å²	77.5	19%	0.188	42%	0.42	C	S	.	.	H	α-helix	trans	-63.2	-41.9	173.7	176.5	60.8	0	0	0	111.5	C174 C176 F183 C185 K186 V191 H192 F193	C174-L189 HydrophobicContact CB-CB 4.05Å; C174-L189 HydrophobicContact CB-CD2 3.73Å; C176-L189 HydrophobicContact CB-CD1 3.55Å; F183-L189 HydrophobicContact CB-CB 4.26Å; F183-L189 HydrophobicContact CD2-CB 4.03Å; F183-L189 HydrophobicContact CD2-CD1 3.65Å; F183-L189 HydrophobicContact CD2-CG 4.44Å; F183-L189 HydrophobicContact CE2-CD1 3.89Å; F183-L189 HydrophobicContact CG-CB 4.29Å; C185-L189 PolarHBondContact O-N 3.13Å; K186-L189 PolarHBondContact O-N 3.25Å; L189-V191 PolarHBondContact O-N 3.22Å; L189-H192 CarbonylContact O-C 3.21Å; L189-H192 WeakPolarHBondContact O-CB 3.47Å; L189-H192 PolarHBondContact O-N 3.3Å; L189-H192 VanDerWaalsContact O-N 3.15Å; L189-F193 WeakPolarHBondContact O-CB 3.21Å; L189-F193 PolarHBondContact O-N 3.38Å
190	V	65.5	Low	61.7	Low	78 Å²	78	81.9 Å²	81.9	47%	0.473	43%	0.429	S	S	.	.	H	α-helix	trans	-62.9	-43	176.7	170.3	0	0	0	0	111.8	K186 H192 F193 R194	K186-V190 WeakPolarHBondContact O-CG2 3.35Å; K186-V190 PolarHBondContact O-N 3.28Å; V190-H192 VanDerWaalsContact C-N 3.27Å; V190-H192 PolarHBondContact O-N 3.32Å; V190-F193 PolarHBondContact O-N 3.44Å; V190-R194 PolarHBondContact O-N 2.92Å
191	V	62	Low	62.3	Low	48 Å²	48	82.6 Å²	82.6	29%	0.291	42%	0.424	S	S	.	.	H	α-helix	trans	-65.1	-34.3	174.7	170.4	0	0	0	0	111.6	S187 Q188 L189 A213	S187-V191 WeakPolarHBondContact O-CG2 3.32Å; S187-V191 PolarHBondContact O-N 2.9Å; Q188-V191 PolarHBondContact O-N 3.28Å; L189-V191 PolarHBondContact O-N 3.22Å; V191-A213 HydrophobicContact CG1-CB 3.77Å; V191-A213 HydrophobicContact CG2-CB 4.47Å
192	H	64.7	Low	62.9	Low	18 Å²	18	80.4 Å²	80.4	8%	0.083	41%	0.413	C	S	.	.	H	α-helix	trans	-70.6	-40.2	175.6	172.3	70.1	0	0	0	112.5	C179 F183 Q188 L189 V190 R194 I195 H196	C179-H192 PolarHBondContact SG-NE2 3.37Å; F183-H192 HydrophobicContact CE1-CB 3.8Å; F183-H192 AromaticContact CE1-CG 3.94Å; F183-H192 HydrophobicContact CE2-CB 3.86Å; F183-H192 AromaticContact CE2-CD2 3.34Å; F183-H192 WeakPolarHBondContact CE2-CD2 3.41Å; F183-H192 AromaticContact CE2-CG 3.53Å; F183-H192 AromaticContact CE2-NE2 3.96Å; F183-H192 HydrophobicContact CZ-CB 3.42Å; F183-H192 VanDerWaalsContact CZ-CB 3.42Å; F183-H192 AromaticContact CZ-CD2 3.4Å; F183-H192 WeakPolarHBondContact CZ-CD2 3.43Å; F183-H192 AromaticContact CZ-CE1 3.93Å; F183-H192 AromaticContact CZ-CG 3.09Å; F183-H192 AromaticContact CZ-ND1 3.47Å; F183-H192 WeakPolarHBondContact CZ-ND1 3.35Å; F183-H192 AromaticContact CZ-NE2 3.89Å; Q188-H192 WeakPolarHBondContact O-CB 3.39Å; Q188-H192 PolarHBondContact O-N 2.81Å; L189-H192 CarbonylContact O-C 3.21Å; L189-H192 WeakPolarHBondContact O-CB 3.47Å; L189-H192 PolarHBondContact O-N 3.3Å; L189-H192 VanDerWaalsContact O-N 3.15Å; V190-H192 VanDerWaalsContact C-N 3.27Å; V190-H192 PolarHBondContact O-N 3.32Å; H192-R194 PolarHBondContact O-N 3Å; H192-I195 WeakPolarHBondContact O-CB 3.28Å; H192-I195 WeakPolarHBondContact O-CG1 3.44Å; H192-I195 PolarHBondContact O-N 2.97Å; H192-H196 AromaticContact NE2-NE2 3.4Å; H192-H196 PolarHBondContact NE2-NE2 3.04Å
193	F	60.6	Low	63.5	Low	89 Å²	89	85.2 Å²	85.2	39%	0.39	42%	0.423	S	S	.	.	H	α-helix	trans	-59.7	-29.8	179.2	-163.7	-104.6	0	0	0	112.4	E178 L189 V190 I195 H196 T197	E178-F193 HydrophobicContact CG-CE2 4.43Å; E178-F193 WeakPolarHBondContact OE1-CE2 3.36Å; L189-F193 WeakPolarHBondContact O-CB 3.21Å; L189-F193 PolarHBondContact O-N 3.38Å; V190-F193 PolarHBondContact O-N 3.44Å; F193-I195 PolarHBondContact O-N 3.4Å; F193-I195 VanDerWaalsContact O-N 3.09Å; F193-H196 PolarHBondContact O-N 3.08Å; F193-T197 HydrophobicContact CD1-CG2 3.73Å; F193-T197 HydrophobicContact CE1-CG2 3.45Å; F193-T197 VanDerWaalsContact CE1-CG2 3.45Å; F193-T197 HydrophobicContact CZ-CG2 4.23Å; F193-T197 PolarHBondContact O-N 3.37Å; F193-T197 VanDerWaalsContact O-N 3.14Å
194	R	71.8	Confident	63.7	Low	51 Å²	51	84 Å²	84	19%	0.192	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-14.3	172.1	-66.4	174.6	-175.1	162.1	3.2	114.8	V190 H192 T197 G198 E199 S212	V190-R194 PolarHBondContact O-N 2.92Å; H192-R194 PolarHBondContact O-N 3Å; R194-T197 WeakPolarHBondContact CA-OG1 3.47Å; R194-G198 WeakPolarHBondContact O-CA 3.44Å; R194-G198 PolarHBondContact O-N 3.35Å; R194-G198 VanDerWaalsContact O-N 3.14Å; R194-E199 HydrophobicContact CB-CB 4.44Å; R194-E199 HydrophobicContact CG-CB 4.24Å; R194-E199 PolarHBondContact O-N 3.35Å; R194-S212 VanDerWaalsContact CD-O 3.31Å; R194-S212 WeakPolarHBondContact CD-O 3.48Å; R194-S212 PolarHBondContact NH1-O 3.1Å
195	I	60.1	Low	64.3	Low	114 Å²	114	81.9 Å²	81.9	59%	0.585	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-35.9	172.3	-60.4	175.3	0	0	0	110.2	H192 F193	H192-I195 WeakPolarHBondContact O-CB 3.28Å; H192-I195 WeakPolarHBondContact O-CG1 3.44Å; H192-I195 PolarHBondContact O-N 2.97Å; F193-I195 PolarHBondContact O-N 3.4Å; F193-I195 VanDerWaalsContact O-N 3.09Å
196	H	59.3	Low	64.6	Low	74 Å²	74	86.4 Å²	86.4	34%	0.343	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-40.4	-179.7	-55.5	-50.7	0	0	0	111.7	C176 E178 H192 F193 G198	C176-H196 PolarHBondContact SG-NE2 2.84Å; C176-H196 VanDerWaalsContact SG-NE2 3.4Å; E178-H196 WeakPolarHBondContact OE2-CB 3.35Å; E178-H196 IonicContact OE2-CD2 3.46Å; E178-H196 PolarHBondContact OE2-CD2 3.46Å; E178-H196 IonicContact OE2-CG 3.98Å; E178-H196 IonicContact OE2-ND1 3.37Å; E178-H196 IonicContact OE2-NE2 3.88Å; H192-H196 AromaticContact NE2-NE2 3.4Å; H192-H196 PolarHBondContact NE2-NE2 3.04Å; F193-H196 PolarHBondContact O-N 3.08Å; H196-G198 VanDerWaalsContact C-N 3.3Å; H196-G198 PolarHBondContact O-N 3.47Å
197	T	61.2	Low	65.2	Low	67 Å²	67	80.4 Å²	80.4	41%	0.411	42%	0.418	S	S	.	.	S	Bend	trans	-78.7	-12.2	177	65.6	0	0	0	0	113.8	F193 R194 E199	F193-T197 HydrophobicContact CD1-CG2 3.73Å; F193-T197 HydrophobicContact CE1-CG2 3.45Å; F193-T197 VanDerWaalsContact CE1-CG2 3.45Å; F193-T197 HydrophobicContact CZ-CG2 4.23Å; F193-T197 PolarHBondContact O-N 3.37Å; F193-T197 VanDerWaalsContact O-N 3.14Å; R194-T197 WeakPolarHBondContact CA-OG1 3.47Å; T197-E199 PolarHBondContact O-N 3.2Å
198	G	59.4	Low	65.3	Low	52 Å²	52	86.3 Å²	86.3	54%	0.536	44%	0.437	S	S	.	.			trans	71.8	5.2	-178.6	0	0	0	0	0	114.8	R194 H196 R200	R194-G198 WeakPolarHBondContact O-CA 3.44Å; R194-G198 PolarHBondContact O-N 3.35Å; R194-G198 VanDerWaalsContact O-N 3.14Å; H196-G198 VanDerWaalsContact C-N 3.3Å; H196-G198 PolarHBondContact O-N 3.47Å; G198-R200 PolarHBondContact O-N 3.42Å
199	E	62.1	Low	65.3	Low	113 Å²	113	89.5 Å²	89.5	53%	0.528	45%	0.445	S	S	.	.			trans	-66.5	127.6	-179	-72.7	-175	171.5	0	0	112.5	R194 T197 P201	R194-E199 HydrophobicContact CB-CB 4.44Å; R194-E199 HydrophobicContact CG-CB 4.24Å; R194-E199 PolarHBondContact O-N 3.35Å; T197-E199 PolarHBondContact O-N 3.2Å; E199-P201 WeakPolarHBondContact O-CD 3.42Å
200	R	71	Confident	65.4	Low	143 Å²	143	88.6 Å²	88.6	54%	0.54	44%	0.442	S	S	.	.			trans	-128.4	74.8	178.8	-61.8	173.5	84.3	155.9	3.7	110	G198 Y202 A210 F211	G198-R200 PolarHBondContact O-N 3.42Å; R200-Y202 PolarHBondContact O-N 3.13Å; R200-A210 HydrophobicContact CB-CB 3.44Å; R200-A210 VanDerWaalsContact CB-CB 3.44Å; R200-A210 PolarHBondContact NE-O 3.1Å; R200-A210 PolarHBondContact NH2-O 3.42Å; R200-A210 WeakPolarHBondContact O-CB 3.39Å; R200-F211 CarbonylContact C-O 3.54Å; R200-F211 WeakPolarHBondContact CA-O 3.41Å
201	P	73.3	Confident	65.8	Low	71 Å²	71	86.3 Å²	86.3	46%	0.461	43%	0.426	S	S	.	.			trans	-64.6	-25.2	-171.6	-23.1	35.2	0	0	0	113.8	E199 K203	E199-P201 WeakPolarHBondContact O-CD 3.42Å; P201-K203 PolarHBondContact O-N 3.06Å
202	Y	72.3	Confident	65.8	Low	77 Å²	77	85.2 Å²	85.2	30%	0.302	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	92.3	-172.8	-55.5	-76	0	0	0	110.8	R200 A210 F211 K214	R200-Y202 PolarHBondContact O-N 3.13Å; Y202-A210 CarbonylContact O-C 3.33Å; Y202-A210 WeakPolarHBondContact O-CA 3.47Å; Y202-F211 WeakPolarHBondContact CB-O 3.36Å; Y202-F211 WeakPolarHBondContact CD2-O 3.48Å; Y202-F211 PolarHBondContact N-O 2.83Å; Y202-F211 PolarHBondContact O-N 2.73Å; Y202-K214 HydrophobicContact CD1-CB 3.98Å; Y202-K214 HydrophobicContact CD1-CG 4.29Å; Y202-K214 VanDerWaalsContact CD2-N 3.34Å; Y202-K214 HydrophobicContact CE1-CB 3.76Å; Y202-K214 HydrophobicContact CE1-CD 4.46Å; Y202-K214 HydrophobicContact CE1-CG 4.24Å; Y202-K214 HydrophobicContact CE2-CB 4.34Å; Y202-K214 HydrophobicContact CG-CB 4.37Å
203	K	70.5	Confident	66.1	Low	162 Å²	162	84.7 Å²	84.7	70%	0.704	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	139.9	178.5	-62.4	-178.9	-178.5	178	0	111.6	P201 A210	P201-K203 PolarHBondContact O-N 3.06Å; K203-A210 HydrophobicContact CG-CB 3.91Å
204	C	70.8	Confident	66.4	Low	11 Å²	11	86.8 Å²	86.8	7%	0.074	43%	0.428	C	S	.	.			trans	-78	136.5	171	-175.2	0	0	0	0	109.8	C207 R209 L217 H224	C204-C207 CarbonylContact C-O 3.5Å; C204-C207 WeakPolarHBondContact CB-O 3.34Å; C204-R209 VanDerWaalsContact CB-O 3.28Å; C204-R209 WeakPolarHBondContact CB-O 3.21Å; C204-R209 PolarHBondContact N-O 3.27Å; C204-L217 HydrophobicContact CB-CD1 3.78Å; C204-H224 VanDerWaalsContact SG-CD2 3.59Å; C204-H224 PolarHBondContact SG-NE2 3.08Å; C204-H224 VanDerWaalsContact SG-NE2 3.44Å
205	T	70.9	Confident	66.1	Low	131 Å²	131	88 Å²	88	80%	0.804	45%	0.445	S	S	*	.	S	Bend	trans	-80.8	-19.9	179.4	51.4	0	0	0	0	113
206	K	62	Low	66.4	Low	140 Å²	140	86.3 Å²	86.3	61%	0.609	44%	0.437	S	S	*	.	S	Bend	trans	-98.5	-10.9	-179.1	-65.5	-174.8	176.2	-174	0	113.8	H224	K206-H224 HydrophobicContact CB-CB 4.48Å; K206-H224 HydrophobicContact CD-CB 3.68Å
207	C	67.3	Low	67	Low	38 Å²	38	83.5 Å²	83.5	26%	0.257	42%	0.424	S	S	.	.	S	Bend	trans	-156	160.5	173.8	72.1	0	0	0	0	110.5	C204 R209 H220 H224	C204-C207 CarbonylContact C-O 3.5Å; C204-C207 WeakPolarHBondContact CB-O 3.34Å; C207-R209 PolarHBondContact O-N 2.94Å; C207-H220 PolarHBondContact SG-NE2 3.07Å; C207-H224 PolarHBondContact SG-NE2 3.47Å
208	E	65	Low	67.3	Low	205 Å²	205	83.8 Å²	83.8	96%	0.958	42%	0.423	S	S	*	.	S	Bend	trans	-70.8	12.2	-175.7	-60.4	176.1	172.1	0	0	114.9
209	R	56	Low	67.5	Low	161 Å²	161	82 Å²	82	61%	0.608	40%	0.404	S	S	*	.			trans	-81.8	131.4	179.9	-72.5	-175.4	166.1	-174.2	-2.4	111.9	C204 C207 F211	C204-R209 VanDerWaalsContact CB-O 3.28Å; C204-R209 WeakPolarHBondContact CB-O 3.21Å; C204-R209 PolarHBondContact N-O 3.27Å; C207-R209 PolarHBondContact O-N 2.94Å; R209-F211 HydrophobicContact CB-CE2 3.92Å; R209-F211 HydrophobicContact CB-CZ 4Å
210	A	67.7	Low	67.8	Low	17 Å²	17	77.4 Å²	77.4	14%	0.14	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	157	174.8	0	0	0	0	0	111.9	R200 Y202 K203	R200-A210 HydrophobicContact CB-CB 3.44Å; R200-A210 VanDerWaalsContact CB-CB 3.44Å; R200-A210 PolarHBondContact NE-O 3.1Å; R200-A210 PolarHBondContact NH2-O 3.42Å; R200-A210 WeakPolarHBondContact O-CB 3.39Å; Y202-A210 CarbonylContact O-C 3.33Å; Y202-A210 WeakPolarHBondContact O-CA 3.47Å; K203-A210 HydrophobicContact CG-CB 3.91Å
211	F	73.1	Confident	67.7	Low	31 Å²	31	73.9 Å²	73.9	14%	0.136	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.9	-176.7	-59.6	-89.9	0	0	0	111.2	R200 Y202 R209 A213 N216 L217 H220	R200-F211 CarbonylContact C-O 3.54Å; R200-F211 WeakPolarHBondContact CA-O 3.41Å; Y202-F211 WeakPolarHBondContact CB-O 3.36Å; Y202-F211 WeakPolarHBondContact CD2-O 3.48Å; Y202-F211 PolarHBondContact N-O 2.83Å; Y202-F211 PolarHBondContact O-N 2.73Å; R209-F211 HydrophobicContact CB-CE2 3.92Å; R209-F211 HydrophobicContact CB-CZ 4Å; F211-A213 VanDerWaalsContact C-N 3.3Å; F211-N216 HydrophobicContact CB-CB 4.12Å; F211-N216 HydrophobicContact CD1-CB 3.98Å; F211-N216 HydrophobicContact CG-CB 4.31Å; F211-L217 HydrophobicContact CB-CB 4.29Å; F211-L217 HydrophobicContact CD2-CB 3.93Å; F211-L217 HydrophobicContact CD2-CD1 3.72Å; F211-L217 HydrophobicContact CD2-CG 4.44Å; F211-L217 HydrophobicContact CE2-CD1 3.96Å; F211-L217 HydrophobicContact CG-CB 4.3Å; F211-H220 HydrophobicContact CE1-CB 3.85Å; F211-H220 HydrophobicContact CE2-CB 3.69Å; F211-H220 AromaticContact CE2-CD2 3.31Å; F211-H220 WeakPolarHBondContact CE2-CD2 3.47Å; F211-H220 AromaticContact CE2-CG 3.51Å; F211-H220 HydrophobicContact CZ-CB 3.31Å; F211-H220 AromaticContact CZ-CD2 3.43Å; F211-H220 VanDerWaalsContact CZ-CD2 3.43Å; F211-H220 WeakPolarHBondContact CZ-CD2 3.38Å; F211-H220 AromaticContact CZ-CG 3.14Å; F211-H220 AromaticContact CZ-ND1 3.71Å
212	S	63	Low	67.6	Low	24 Å²	24	73.6 Å²	73.6	17%	0.168	36%	0.361	C	S	.	.	S	Bend	trans	-77.1	-15.3	177.6	54.2	0	0	0	0	113.5	R194	R194-S212 VanDerWaalsContact CD-O 3.31Å; R194-S212 WeakPolarHBondContact CD-O 3.48Å; R194-S212 PolarHBondContact NH1-O 3.1Å
213	A	71.1	Confident	67	Low	7 Å²	7	74.9 Å²	74.9	6%	0.058	38%	0.377	C	S	.	.	S	Bend	trans	-137.6	144.9	178.6	0	0	0	0	0	112.2	V191 F211 S215 N216 L217	V191-A213 HydrophobicContact CG1-CB 3.77Å; V191-A213 HydrophobicContact CG2-CB 4.47Å; F211-A213 VanDerWaalsContact C-N 3.3Å; A213-S215 VanDerWaalsContact C-N 3.33Å; A213-S215 PolarHBondContact O-N 2.95Å; A213-N216 HydrophobicContact CB-CB 4.39Å; A213-N216 WeakPolarHBondContact O-CB 3.47Å; A213-N216 PolarHBondContact O-N 3.12Å; A213-N216 VanDerWaalsContact O-N 3.16Å; A213-L217 PolarHBondContact O-N 3.36Å
214	K	66	Low	66.6	Low	133 Å²	133	70.3 Å²	70.3	58%	0.578	36%	0.358	S	S	*	.	H	α-helix	trans	-62.1	-37.9	177.1	-168.3	175.4	-177.4	177.8	0	112.4	Y202 N216 L217 N218	Y202-K214 HydrophobicContact CD1-CB 3.98Å; Y202-K214 HydrophobicContact CD1-CG 4.29Å; Y202-K214 VanDerWaalsContact CD2-N 3.34Å; Y202-K214 HydrophobicContact CE1-CB 3.76Å; Y202-K214 HydrophobicContact CE1-CD 4.46Å; Y202-K214 HydrophobicContact CE1-CG 4.24Å; Y202-K214 HydrophobicContact CE2-CB 4.34Å; Y202-K214 HydrophobicContact CG-CB 4.37Å; K214-N216 VanDerWaalsContact C-N 3.28Å; K214-N216 PolarHBondContact O-N 3.41Å; K214-L217 PolarHBondContact O-N 3.18Å; K214-N218 VanDerWaalsContact O-CG 3.31Å; K214-N218 PolarHBondContact O-N 2.85Å; K214-N218 PolarHBondContact O-OD1 2.79Å
215	S	65.3	Low	66.3	Low	77 Å²	77	73 Å²	73	54%	0.538	37%	0.374	S	S	.	.	H	α-helix	trans	-59.1	-38.2	174.6	51.9	0	0	0	0	112.6	A213 N218 A219	A213-S215 VanDerWaalsContact C-N 3.33Å; A213-S215 PolarHBondContact O-N 2.95Å; S215-N218 PolarHBondContact O-N 3.43Å; S215-A219 VanDerWaalsContact O-CB 3.3Å; S215-A219 WeakPolarHBondContact O-CB 3.37Å; S215-A219 PolarHBondContact O-N 3.38Å
216	N	66.7	Low	65.7	Low	78 Å²	78	69.2 Å²	69.2	42%	0.417	36%	0.361	S	S	.	.	H	α-helix	trans	-72.4	-36.5	177.7	-66.9	-20.6	0	0	0	112.1	F211 A213 K214 H220	F211-N216 HydrophobicContact CB-CB 4.12Å; F211-N216 HydrophobicContact CD1-CB 3.98Å; F211-N216 HydrophobicContact CG-CB 4.31Å; A213-N216 HydrophobicContact CB-CB 4.39Å; A213-N216 WeakPolarHBondContact O-CB 3.47Å; A213-N216 PolarHBondContact O-N 3.12Å; A213-N216 VanDerWaalsContact O-N 3.16Å; K214-N216 VanDerWaalsContact C-N 3.28Å; K214-N216 PolarHBondContact O-N 3.41Å; N216-H220 WeakPolarHBondContact O-CB 2.94Å; N216-H220 PolarHBondContact O-N 3.25Å
217	L	71.4	Confident	65.7	Low	16 Å²	16	68 Å²	68	8%	0.084	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-46.4	171.4	174.5	63.1	0	0	0	111.1	C204 F211 A213 K214 A219 H220 Q221	C204-L217 HydrophobicContact CB-CD1 3.78Å; F211-L217 HydrophobicContact CB-CB 4.29Å; F211-L217 HydrophobicContact CD2-CB 3.93Å; F211-L217 HydrophobicContact CD2-CD1 3.72Å; F211-L217 HydrophobicContact CD2-CG 4.44Å; F211-L217 HydrophobicContact CE2-CD1 3.96Å; F211-L217 HydrophobicContact CG-CB 4.3Å; A213-L217 PolarHBondContact O-N 3.36Å; K214-L217 PolarHBondContact O-N 3.18Å; L217-A219 VanDerWaalsContact C-N 3.31Å; L217-A219 PolarHBondContact O-N 3.46Å; L217-H220 CarbonylContact O-C 3.55Å; L217-H220 WeakPolarHBondContact O-CA 3.49Å; L217-H220 WeakPolarHBondContact O-CB 3.45Å; L217-H220 PolarHBondContact O-N 2.76Å; L217-Q221 HydrophobicContact CD1-CG 4.24Å; L217-Q221 HydrophobicContact CG-CG 4.43Å; L217-Q221 WeakPolarHBondContact O-CG 3.34Å; L217-Q221 PolarHBondContact O-N 2.92Å
218	N	69.1	Low	65.6	Low	72 Å²	72	71.4 Å²	71.4	39%	0.385	37%	0.368	S	S	.	.	H	α-helix	trans	-61.5	-40.9	177.8	-68.7	-2.7	0	0	0	111.6	K214 S215 H220 Q221	K214-N218 VanDerWaalsContact O-CG 3.31Å; K214-N218 PolarHBondContact O-N 2.85Å; K214-N218 PolarHBondContact O-OD1 2.79Å; S215-N218 PolarHBondContact O-N 3.43Å; N218-H220 VanDerWaalsContact C-N 3.33Å; N218-Q221 PolarHBondContact O-N 3.39Å
219	A	63.3	Low	66	Low	16 Å²	16	65.1 Å²	65.1	13%	0.132	35%	0.345	C	S	.	.	H	α-helix	trans	-61	-40.6	171.9	0	0	0	0	0	112.6	S215 L217 R222 F241	S215-A219 VanDerWaalsContact O-CB 3.3Å; S215-A219 WeakPolarHBondContact O-CB 3.37Å; S215-A219 PolarHBondContact O-N 3.38Å; L217-A219 VanDerWaalsContact C-N 3.31Å; L217-A219 PolarHBondContact O-N 3.46Å; A219-R222 WeakPolarHBondContact O-CB 3.4Å; A219-F241 HydrophobicContact CB-CE1 3.5Å; A219-F241 HydrophobicContact CB-CZ 3.76Å
220	H	67.8	Low	66.6	Low	16 Å²	16	60.6 Å²	60.6	7%	0.074	33%	0.329	C	S	.	.	H	α-helix	trans	-70.8	-35.5	176.9	171.7	64.6	0	0	0	113	C207 F211 N216 L217 N218 R222 V223 H224	C207-H220 PolarHBondContact SG-NE2 3.07Å; F211-H220 HydrophobicContact CE1-CB 3.85Å; F211-H220 HydrophobicContact CE2-CB 3.69Å; F211-H220 AromaticContact CE2-CD2 3.31Å; F211-H220 WeakPolarHBondContact CE2-CD2 3.47Å; F211-H220 AromaticContact CE2-CG 3.51Å; F211-H220 HydrophobicContact CZ-CB 3.31Å; F211-H220 AromaticContact CZ-CD2 3.43Å; F211-H220 VanDerWaalsContact CZ-CD2 3.43Å; F211-H220 WeakPolarHBondContact CZ-CD2 3.38Å; F211-H220 AromaticContact CZ-CG 3.14Å; F211-H220 AromaticContact CZ-ND1 3.71Å; N216-H220 WeakPolarHBondContact O-CB 2.94Å; N216-H220 PolarHBondContact O-N 3.25Å; L217-H220 CarbonylContact O-C 3.55Å; L217-H220 WeakPolarHBondContact O-CA 3.49Å; L217-H220 WeakPolarHBondContact O-CB 3.45Å; L217-H220 PolarHBondContact O-N 2.76Å; N218-H220 VanDerWaalsContact C-N 3.33Å; H220-R222 PolarHBondContact O-N 3.4Å; H220-V223 WeakPolarHBondContact O-CB 3.43Å; H220-V223 WeakPolarHBondContact O-CG2 3.35Å; H220-V223 PolarHBondContact O-N 3.42Å; H220-H224 AromaticContact CE1-NE2 3.64Å; H220-H224 AromaticContact NE2-CD2 3.85Å; H220-H224 AromaticContact NE2-NE2 3.14Å; H220-H224 PolarHBondContact NE2-NE2 3.15Å; H220-H224 VanDerWaalsContact NE2-NE2 3.14Å
221	Q	68.4	Low	66.1	Low	69 Å²	69	64.8 Å²	64.8	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-59.7	-27.3	177.8	-77.6	173.1	-27.1	0	0	112.6	L217 N218 V223 H224 T225	L217-Q221 HydrophobicContact CD1-CG 4.24Å; L217-Q221 HydrophobicContact CG-CG 4.43Å; L217-Q221 WeakPolarHBondContact O-CG 3.34Å; L217-Q221 PolarHBondContact O-N 2.92Å; N218-Q221 PolarHBondContact O-N 3.39Å; Q221-V223 PolarHBondContact O-N 2.89Å; Q221-V223 VanDerWaalsContact O-N 3.17Å; Q221-H224 PolarHBondContact O-N 3.1Å; Q221-T225 PolarHBondContact O-N 3.44Å; Q221-T225 VanDerWaalsContact O-N 3.07Å; Q221-T225 PolarHBondContact O-OG1 2.92Å
222	R	71	Confident	65.6	Low	64 Å²	64	63.3 Å²	63.3	24%	0.242	34%	0.342	C	S	.	.	H	α-helix	trans	-60.3	-21.4	171.8	-61.2	178.1	-171.9	176.7	-0.1	113.8	A219 H220 H224 T225 G226 S240	A219-R222 WeakPolarHBondContact O-CB 3.4Å; H220-R222 PolarHBondContact O-N 3.4Å; R222-H224 VanDerWaalsContact C-N 3.33Å; R222-T225 WeakPolarHBondContact CA-OG1 3.41Å; R222-G226 WeakPolarHBondContact O-CA 3.32Å; R222-G226 PolarHBondContact O-N 3.33Å; R222-S240 PolarHBondContact NH1-O 3.35Å
223	V	61	Low	65.6	Low	105 Å²	105	67 Å²	67	64%	0.636	37%	0.368	S	S	*	.	H	α-helix	trans	-70.1	-33	173.2	-178.4	0	0	0	0	111.1	H220 Q221	H220-V223 WeakPolarHBondContact O-CB 3.43Å; H220-V223 WeakPolarHBondContact O-CG2 3.35Å; H220-V223 PolarHBondContact O-N 3.42Å; Q221-V223 PolarHBondContact O-N 2.89Å; Q221-V223 VanDerWaalsContact O-N 3.17Å
224	H	62.3	Low	65	Low	66 Å²	66	72.8 Å²	72.8	31%	0.306	39%	0.394	S	S	.	.	H	α-helix	trans	-89.1	-29.8	-179.2	-60.9	-62.8	0	0	0	113.1	C204 K206 C207 H220 Q221 R222	C204-H224 VanDerWaalsContact SG-CD2 3.59Å; C204-H224 PolarHBondContact SG-NE2 3.08Å; C204-H224 VanDerWaalsContact SG-NE2 3.44Å; K206-H224 HydrophobicContact CB-CB 4.48Å; K206-H224 HydrophobicContact CD-CB 3.68Å; C207-H224 PolarHBondContact SG-NE2 3.47Å; H220-H224 AromaticContact CE1-NE2 3.64Å; H220-H224 AromaticContact NE2-CD2 3.85Å; H220-H224 AromaticContact NE2-NE2 3.14Å; H220-H224 PolarHBondContact NE2-NE2 3.15Å; H220-H224 VanDerWaalsContact NE2-NE2 3.14Å; Q221-H224 PolarHBondContact O-N 3.1Å; R222-H224 VanDerWaalsContact C-N 3.33Å
225	T	63.4	Low	64.4	Low	67 Å²	67	69 Å²	69	41%	0.411	38%	0.383	S	S	.	.	H	α-helix	trans	-88.5	-15.4	177.3	59	0	0	0	0	112.8	Q221 R222 E227	Q221-T225 PolarHBondContact O-N 3.44Å; Q221-T225 VanDerWaalsContact O-N 3.07Å; Q221-T225 PolarHBondContact O-OG1 2.92Å; R222-T225 WeakPolarHBondContact CA-OG1 3.41Å; T225-E227 PolarHBondContact O-N 3.16Å
226	G	59.5	Low	63.7	Low	51 Å²	51	67.7 Å²	67.7	53%	0.526	38%	0.382	S	S	.	.			trans	70.7	3.4	-176.5	0	0	0	0	0	113.8	R222 K228	R222-G226 WeakPolarHBondContact O-CA 3.32Å; R222-G226 PolarHBondContact O-N 3.33Å; G226-K228 PolarHBondContact O-N 3.34Å
227	E	60.4	Low	62.9	Low	116 Å²	116	69.9 Å²	69.9	54%	0.542	39%	0.387	S	S	.	.			trans	-62.1	119.7	179.1	-71.8	176.6	-179	0	0	110.4	T225 P229	T225-E227 PolarHBondContact O-N 3.16Å; E227-P229 WeakPolarHBondContact O-CD 3.46Å
228	K	67.1	Low	62.1	Low	108 Å²	108	72.1 Å²	72.1	47%	0.47	40%	0.402	S	S	.	.			trans	-121.7	80.5	175.1	-68.3	175.5	176.3	-175.6	0	108.6	G226 Y230 V238 F239	G226-K228 PolarHBondContact O-N 3.34Å; K228-Y230 PolarHBondContact O-N 3.2Å; K228-Y230 VanDerWaalsContact O-N 3.1Å; K228-V238 HydrophobicContact CB-CB 3.63Å; K228-V238 HydrophobicContact CB-CG2 3.98Å; K228-V238 HydrophobicContact CD-CB 4.1Å; K228-V238 HydrophobicContact CD-CG2 3.63Å; K228-V238 WeakPolarHBondContact CD-O 3.42Å; K228-V238 HydrophobicContact CG-CG2 4.49Å; K228-F239 CarbonylContact C-O 3.5Å; K228-F239 WeakPolarHBondContact CA-O 3.41Å
229	P	72	Confident	61.8	Low	74 Å²	74	70.4 Å²	70.4	48%	0.481	39%	0.391	S	S	.	.			trans	-68.4	-13.6	-167.2	-21	34.3	0	0	0	114.4	E227	E227-P229 WeakPolarHBondContact O-CD 3.46Å
230	Y	70	Confident	61.6	Low	66 Å²	66	70.9 Å²	70.9	26%	0.259	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	98.8	-171.7	-55.2	-74.5	0	0	0	109.9	K228 V238 F239 S240 R242	K228-Y230 PolarHBondContact O-N 3.2Å; K228-Y230 VanDerWaalsContact O-N 3.1Å; Y230-V238 CarbonylContact O-C 3.49Å; Y230-V238 WeakPolarHBondContact O-CA 3.43Å; Y230-F239 WeakPolarHBondContact CD2-O 3.33Å; Y230-F239 PolarHBondContact N-O 3.2Å; Y230-F239 VanDerWaalsContact N-O 3.15Å; Y230-F239 PolarHBondContact O-N 2.77Å; Y230-S240 WeakPolarHBondContact CE2-O 3.48Å; Y230-R242 HydrophobicContact CD1-CB 3.9Å; Y230-R242 HydrophobicContact CD1-CG 4.29Å; Y230-R242 VanDerWaalsContact CD2-N 3.32Å; Y230-R242 HydrophobicContact CE1-CB 3.66Å; Y230-R242 HydrophobicContact CE1-CG 4.24Å; Y230-R242 HydrophobicContact CE2-CB 4.35Å; Y230-R242 VanDerWaalsContact CE2-N 3.31Å; Y230-R242 HydrophobicContact CG-CB 4.34Å
231	L	55.4	Low	61.5	Low	104 Å²	104	73.8 Å²	73.8	55%	0.545	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	132.8	178.6	179.7	68.8	0	0	0	111.1	S233 G236 V238 L245	L231-S233 PolarHBondContact O-N 3.28Å; L231-G236 WeakPolarHBondContact CD1-O 3.44Å; L231-V238 HydrophobicContact CB-CG1 4.22Å; L231-V238 HydrophobicContact CD1-CG1 3.49Å; L231-V238 VanDerWaalsContact CD1-CG1 3.49Å; L231-V238 HydrophobicContact CG-CG1 4.48Å; L231-L245 WeakPolarHBondContact O-CD2 3.43Å
232	C	63.5	Low	61.1	Low	0 Å²	0	78.1 Å²	78.1	0%	0	42%	0.419	C	S	.	.			trans	-79.5	115.1	164.1	179.4	0	0	0	0	109.4	E234 C235 G236 K237 F239 L245 H252	C232-E234 PolarHBondContact O-N 3.09Å; C232-C235 VanDerWaalsContact SG-SG 3.63Å; C232-G236 VanDerWaalsContact O-CA 3.25Å; C232-G236 WeakPolarHBondContact O-CA 3.28Å; C232-G236 PolarHBondContact O-N 2.82Å; C232-K237 HydrophobicContact CB-CB 4.48Å; C232-K237 VanDerWaalsContact CB-O 3.26Å; C232-K237 WeakPolarHBondContact CB-O 3.41Å; C232-K237 PolarHBondContact N-O 2.81Å; C232-F239 HydrophobicContact CB-CE2 4.16Å; C232-L245 HydrophobicContact CB-CD1 3.61Å; C232-H252 PolarHBondContact SG-NE2 3.12Å
233	S	63.7	Low	60.8	Low	103 Å²	103	78.8 Å²	78.8	72%	0.72	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.3	178.7	38.1	0	0	0	0	113.8	L231	L231-S233 PolarHBondContact O-N 3.28Å
234	E	57.6	Low	60.8	Low	128 Å²	128	78 Å²	78	60%	0.598	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-29.1	-173.7	-65.9	179	162.1	0	0	114.2	C232 H252	C232-E234 PolarHBondContact O-N 3.09Å; E234-H252 WeakPolarHBondContact OE2-CB 3.46Å; E234-H252 IonicContact OE2-CD2 2.94Å; E234-H252 PolarHBondContact OE2-CD2 2.82Å; E234-H252 IonicContact OE2-CG 3.07Å
235	C	54.4	Low	61	Low	54 Å²	54	75.5 Å²	75.5	37%	0.365	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.6	7.2	-179.4	75.8	0	0	0	0	114.6	C232 K237 H248 H252	C232-C235 VanDerWaalsContact SG-SG 3.63Å; C235-K237 PolarHBondContact O-N 3.43Å; C235-H248 PolarHBondContact SG-NE2 3.07Å; C235-H252 PolarHBondContact SG-CE1 2.89Å; C235-H252 PolarHBondContact SG-NE2 3.02Å
236	G	49.4	Very low	61.2	Low	49 Å²	49	75.9 Å²	75.9	51%	0.505	41%	0.411	S	S	.	.			trans	68.5	2.6	177.9	0	0	0	0	0	115.1	L231 C232 V238	L231-G236 WeakPolarHBondContact CD1-O 3.44Å; C232-G236 VanDerWaalsContact O-CA 3.25Å; C232-G236 WeakPolarHBondContact O-CA 3.28Å; C232-G236 PolarHBondContact O-N 2.82Å; G236-V238 PolarHBondContact O-N 3.2Å
237	K	50.2	Low	61.2	Low	123 Å²	123	75.1 Å²	75.1	54%	0.535	40%	0.396	S	S	.	.			trans	-69.7	131.1	178.8	-74.8	178.7	-176.1	169	0	110.8	C232 C235 F239	C232-K237 HydrophobicContact CB-CB 4.48Å; C232-K237 VanDerWaalsContact CB-O 3.26Å; C232-K237 WeakPolarHBondContact CB-O 3.41Å; C232-K237 PolarHBondContact N-O 2.81Å; C235-K237 PolarHBondContact O-N 3.43Å; K237-F239 HydrophobicContact CB-CE2 3.76Å; K237-F239 HydrophobicContact CB-CZ 3.85Å; K237-F239 WeakPolarHBondContact O-CD2 3.25Å; K237-F239 VanDerWaalsContact O-CE2 3.26Å; K237-F239 WeakPolarHBondContact O-CE2 3.39Å
238	V	53.8	Low	61.4	Low	64 Å²	64	70.7 Å²	70.7	39%	0.388	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	139.1	-179.7	-79.3	0	0	0	0	111.5	K228 Y230 L231 G236	K228-V238 HydrophobicContact CB-CB 3.63Å; K228-V238 HydrophobicContact CB-CG2 3.98Å; K228-V238 HydrophobicContact CD-CB 4.1Å; K228-V238 HydrophobicContact CD-CG2 3.63Å; K228-V238 WeakPolarHBondContact CD-O 3.42Å; K228-V238 HydrophobicContact CG-CG2 4.49Å; Y230-V238 CarbonylContact O-C 3.49Å; Y230-V238 WeakPolarHBondContact O-CA 3.43Å; L231-V238 HydrophobicContact CB-CG1 4.22Å; L231-V238 HydrophobicContact CD1-CG1 3.49Å; L231-V238 VanDerWaalsContact CD1-CG1 3.49Å; L231-V238 HydrophobicContact CG-CG1 4.48Å; G236-V238 PolarHBondContact O-N 3.2Å
239	F	64.6	Low	61.2	Low	36 Å²	36	68.8 Å²	68.8	16%	0.158	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.4	-176.1	-60.1	-87.4	0	0	0	111.5	K228 Y230 C232 K237 F241 Q244 L245 H248	K228-F239 CarbonylContact C-O 3.5Å; K228-F239 WeakPolarHBondContact CA-O 3.41Å; Y230-F239 WeakPolarHBondContact CD2-O 3.33Å; Y230-F239 PolarHBondContact N-O 3.2Å; Y230-F239 VanDerWaalsContact N-O 3.15Å; Y230-F239 PolarHBondContact O-N 2.77Å; C232-F239 HydrophobicContact CB-CE2 4.16Å; K237-F239 HydrophobicContact CB-CE2 3.76Å; K237-F239 HydrophobicContact CB-CZ 3.85Å; K237-F239 WeakPolarHBondContact O-CD2 3.25Å; K237-F239 VanDerWaalsContact O-CE2 3.26Å; K237-F239 WeakPolarHBondContact O-CE2 3.39Å; F239-F241 VanDerWaalsContact C-N 3.34Å; F239-Q244 HydrophobicContact CB-CB 4.16Å; F239-Q244 HydrophobicContact CD1-CB 3.83Å; F239-Q244 HydrophobicContact CG-CB 4.26Å; F239-L245 HydrophobicContact CB-CB 4.27Å; F239-L245 HydrophobicContact CD2-CB 3.92Å; F239-L245 HydrophobicContact CD2-CD1 3.73Å; F239-L245 HydrophobicContact CD2-CG 4.43Å; F239-L245 HydrophobicContact CE2-CD1 3.97Å; F239-L245 HydrophobicContact CG-CB 4.24Å; F239-H248 HydrophobicContact CE1-CB 3.81Å; F239-H248 AromaticContact CE1-CG 3.93Å; F239-H248 HydrophobicContact CE2-CB 3.79Å; F239-H248 AromaticContact CE2-CD2 3.22Å; F239-H248 WeakPolarHBondContact CE2-CD2 3.46Å; F239-H248 AromaticContact CE2-CG 3.51Å; F239-H248 AromaticContact CE2-NE2 3.96Å; F239-H248 HydrophobicContact CZ-CB 3.36Å; F239-H248 AromaticContact CZ-CD2 3.24Å; F239-H248 WeakPolarHBondContact CZ-CD2 3.39Å; F239-H248 AromaticContact CZ-CG 3.06Å; F239-H248 AromaticContact CZ-ND1 3.63Å; F239-H248 AromaticContact CZ-NE2 3.83Å
240	S	58.3	Low	61	Low	26 Å²	26	67.3 Å²	67.3	18%	0.182	36%	0.355	C	S	.	.	S	Bend	trans	-80.5	-18.3	178.5	-54.7	0	0	0	0	112.7	R222 Y230	R222-S240 PolarHBondContact NH1-O 3.35Å; Y230-S240 WeakPolarHBondContact CE2-O 3.48Å
241	F	65	Low	60.5	Low	77 Å²	77	68.5 Å²	68.5	34%	0.338	37%	0.369	S	S	.	.	S	Bend	trans	-133.8	142.7	-178.7	-60.9	-81.6	0	0	0	112.1	A219 F239 S243 Q244 L245	A219-F241 HydrophobicContact CB-CE1 3.5Å; A219-F241 HydrophobicContact CB-CZ 3.76Å; F239-F241 VanDerWaalsContact C-N 3.34Å; F241-S243 VanDerWaalsContact C-N 3.31Å; F241-S243 PolarHBondContact O-N 3.14Å; F241-Q244 HydrophobicContact CB-CB 4.42Å; F241-Q244 HydrophobicContact CB-CG 4.05Å; F241-Q244 WeakPolarHBondContact O-CB 3.28Å; F241-Q244 PolarHBondContact O-N 3.43Å; F241-Q244 VanDerWaalsContact O-N 3.16Å; F241-L245 PolarHBondContact O-N 2.93Å
242	R	61.2	Low	60.6	Low	159 Å²	159	67 Å²	67	60%	0.6	36%	0.359	S	S	*	.	H	α-helix	trans	-61.1	-38.9	176.6	-170.9	176.6	171.4	84.9	0.7	112.3	Y230 Q244 L245 I246	Y230-R242 HydrophobicContact CD1-CB 3.9Å; Y230-R242 HydrophobicContact CD1-CG 4.29Å; Y230-R242 VanDerWaalsContact CD2-N 3.32Å; Y230-R242 HydrophobicContact CE1-CB 3.66Å; Y230-R242 HydrophobicContact CE1-CG 4.24Å; Y230-R242 HydrophobicContact CE2-CB 4.35Å; Y230-R242 VanDerWaalsContact CE2-N 3.31Å; Y230-R242 HydrophobicContact CG-CB 4.34Å; R242-Q244 VanDerWaalsContact C-N 3.25Å; R242-Q244 PolarHBondContact O-N 3.1Å; R242-L245 PolarHBondContact O-N 3.48Å; R242-I246 HydrophobicContact CG-CD1 4.04Å; R242-I246 HydrophobicContact CG-CG1 4.45Å; R242-I246 WeakPolarHBondContact O-CG1 3.32Å; R242-I246 PolarHBondContact O-N 3.05Å
243	S	63.9	Low	60.5	Low	79 Å²	79	71 Å²	71	55%	0.552	38%	0.383	S	S	*	.	H	α-helix	trans	-60.7	-34	176.5	52.4	0	0	0	0	112.9	F241 V247	F241-S243 VanDerWaalsContact C-N 3.31Å; F241-S243 PolarHBondContact O-N 3.14Å; S243-V247 VanDerWaalsContact O-CG2 3.27Å; S243-V247 WeakPolarHBondContact O-CG2 3.39Å; S243-V247 PolarHBondContact O-N 3.36Å
244	Q	61.4	Low	60.2	Low	87 Å²	87	68.6 Å²	68.6	41%	0.407	38%	0.375	S	S	.	.	H	α-helix	trans	-73.5	-36.6	176	-66.4	174	-15	0	0	112	F239 F241 R242 H248	F239-Q244 HydrophobicContact CB-CB 4.16Å; F239-Q244 HydrophobicContact CD1-CB 3.83Å; F239-Q244 HydrophobicContact CG-CB 4.26Å; F241-Q244 HydrophobicContact CB-CB 4.42Å; F241-Q244 HydrophobicContact CB-CG 4.05Å; F241-Q244 WeakPolarHBondContact O-CB 3.28Å; F241-Q244 PolarHBondContact O-N 3.43Å; F241-Q244 VanDerWaalsContact O-N 3.16Å; R242-Q244 VanDerWaalsContact C-N 3.25Å; R242-Q244 PolarHBondContact O-N 3.1Å; Q244-H248 WeakPolarHBondContact O-CB 3.38Å; Q244-H248 PolarHBondContact O-N 3.31Å
245	L	67	Low	60.2	Low	14 Å²	14	68.8 Å²	68.8	7%	0.073	38%	0.376	C	S	.	.	H	α-helix	trans	-64.9	-45.1	173.7	172.9	62.1	0	0	0	111.3	L231 C232 F239 F241 R242 H248 Q249	L231-L245 WeakPolarHBondContact O-CD2 3.43Å; C232-L245 HydrophobicContact CB-CD1 3.61Å; F239-L245 HydrophobicContact CB-CB 4.27Å; F239-L245 HydrophobicContact CD2-CB 3.92Å; F239-L245 HydrophobicContact CD2-CD1 3.73Å; F239-L245 HydrophobicContact CD2-CG 4.43Å; F239-L245 HydrophobicContact CE2-CD1 3.97Å; F239-L245 HydrophobicContact CG-CB 4.24Å; F241-L245 PolarHBondContact O-N 2.93Å; R242-L245 PolarHBondContact O-N 3.48Å; L245-H248 CarbonylContact O-C 3.56Å; L245-H248 WeakPolarHBondContact O-CA 3.29Å; L245-H248 WeakPolarHBondContact O-CB 3.48Å; L245-H248 PolarHBondContact O-N 3.06Å; L245-H248 VanDerWaalsContact O-N 3.08Å; L245-Q249 HydrophobicContact CD1-CG 4.1Å; L245-Q249 HydrophobicContact CG-CG 4.45Å; L245-Q249 WeakPolarHBondContact O-CG 3.49Å; L245-Q249 PolarHBondContact O-N 3.39Å
246	I	67.1	Low	60.7	Low	75 Å²	75	71.3 Å²	71.3	39%	0.385	38%	0.38	S	S	.	.	H	α-helix	trans	-59.1	-50.9	178.8	-68	167.3	0	0	0	110.4	R242 H248 Q249 E250	R242-I246 HydrophobicContact CG-CD1 4.04Å; R242-I246 HydrophobicContact CG-CG1 4.45Å; R242-I246 WeakPolarHBondContact O-CG1 3.32Å; R242-I246 PolarHBondContact O-N 3.05Å; I246-H248 PolarHBondContact O-N 3.45Å; I246-Q249 WeakPolarHBondContact O-CB 3.28Å; I246-Q249 PolarHBondContact O-N 2.81Å; I246-Q249 VanDerWaalsContact O-N 3.1Å; I246-E250 PolarHBondContact O-N 3.29Å
247	V	60.1	Low	61.5	Low	36 Å²	36	73 Å²	73	22%	0.218	38%	0.382	C	S	.	.	H	α-helix	trans	-61.5	-31.9	175.6	171.3	0	0	0	0	112.1	S243 E250 W269	S243-V247 VanDerWaalsContact O-CG2 3.27Å; S243-V247 WeakPolarHBondContact O-CG2 3.39Å; S243-V247 PolarHBondContact O-N 3.36Å; V247-E250 WeakPolarHBondContact O-CB 3.35Å; V247-W269 HydrophobicContact CG1-CZ2 4.27Å; V247-W269 VanDerWaalsContact CG1-NE1 3.34Å
248	H	63.4	Low	62.3	Low	22 Å²	22	70.4 Å²	70.4	10%	0.102	37%	0.371	C	S	.	.	H	α-helix	trans	-73.4	-34.5	176.6	173.5	64	0	0	0	112.5	C235 F239 Q244 L245 I246 E250 V251 H252	C235-H248 PolarHBondContact SG-NE2 3.07Å; F239-H248 HydrophobicContact CE1-CB 3.81Å; F239-H248 AromaticContact CE1-CG 3.93Å; F239-H248 HydrophobicContact CE2-CB 3.79Å; F239-H248 AromaticContact CE2-CD2 3.22Å; F239-H248 WeakPolarHBondContact CE2-CD2 3.46Å; F239-H248 AromaticContact CE2-CG 3.51Å; F239-H248 AromaticContact CE2-NE2 3.96Å; F239-H248 HydrophobicContact CZ-CB 3.36Å; F239-H248 AromaticContact CZ-CD2 3.24Å; F239-H248 WeakPolarHBondContact CZ-CD2 3.39Å; F239-H248 AromaticContact CZ-CG 3.06Å; F239-H248 AromaticContact CZ-ND1 3.63Å; F239-H248 AromaticContact CZ-NE2 3.83Å; Q244-H248 WeakPolarHBondContact O-CB 3.38Å; Q244-H248 PolarHBondContact O-N 3.31Å; L245-H248 CarbonylContact O-C 3.56Å; L245-H248 WeakPolarHBondContact O-CA 3.29Å; L245-H248 WeakPolarHBondContact O-CB 3.48Å; L245-H248 PolarHBondContact O-N 3.06Å; L245-H248 VanDerWaalsContact O-N 3.08Å; I246-H248 PolarHBondContact O-N 3.45Å; H248-E250 PolarHBondContact O-N 3.36Å; H248-V251 WeakPolarHBondContact O-CB 3.43Å; H248-V251 WeakPolarHBondContact O-CG2 3.28Å; H248-V251 PolarHBondContact O-N 3.03Å; H248-H252 AromaticContact CD2-NE2 3.81Å; H248-H252 AromaticContact CE1-CE1 3.96Å; H248-H252 AromaticContact CE1-NE2 3.57Å; H248-H252 AromaticContact NE2-CE1 3.83Å; H248-H252 AromaticContact NE2-NE2 3.08Å; H248-H252 PolarHBondContact NE2-NE2 3.41Å
249	Q	64.1	Low	62.6	Low	68 Å²	68	71.1 Å²	71.1	32%	0.318	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-30.9	174.5	-73.4	171.8	-44.3	0	0	111.4	L245 I246 V251 H252 T253	L245-Q249 HydrophobicContact CD1-CG 4.1Å; L245-Q249 HydrophobicContact CG-CG 4.45Å; L245-Q249 WeakPolarHBondContact O-CG 3.49Å; L245-Q249 PolarHBondContact O-N 3.39Å; I246-Q249 WeakPolarHBondContact O-CB 3.28Å; I246-Q249 PolarHBondContact O-N 2.81Å; I246-Q249 VanDerWaalsContact O-N 3.1Å; Q249-V251 PolarHBondContact O-N 3.31Å; Q249-V251 VanDerWaalsContact O-N 3.14Å; Q249-H252 PolarHBondContact O-N 3.14Å; Q249-T253 PolarHBondContact O-N 3.04Å; Q249-T253 VanDerWaalsContact O-N 3.15Å
250	E	67.4	Low	62.8	Low	44 Å²	44	69.5 Å²	69.5	21%	0.206	37%	0.371	C	S	.	.	H	α-helix	trans	-60.4	-20.6	171.2	-62.3	168.7	-176.2	0	0	113.3	I246 V247 H248 H252 T253 G254 E255	I246-E250 PolarHBondContact O-N 3.29Å; V247-E250 WeakPolarHBondContact O-CB 3.35Å; H248-E250 PolarHBondContact O-N 3.36Å; E250-H252 VanDerWaalsContact C-N 3.35Å; E250-T253 WeakPolarHBondContact CA-OG1 3.26Å; E250-T253 PolarHBondContact O-OG1 3.43Å; E250-G254 PolarHBondContact O-N 2.96Å; E250-G254 VanDerWaalsContact O-N 3.13Å; E250-E255 PolarHBondContact O-N 3.16Å
251	V	59.3	Low	63.2	Low	90 Å²	90	73.5 Å²	73.5	55%	0.545	40%	0.399	S	S	.	.	H	α-helix	trans	-72.7	-30.5	174.3	-177.2	0	0	0	0	111.6	H248 Q249	H248-V251 WeakPolarHBondContact O-CB 3.43Å; H248-V251 WeakPolarHBondContact O-CG2 3.28Å; H248-V251 PolarHBondContact O-N 3.03Å; Q249-V251 PolarHBondContact O-N 3.31Å; Q249-V251 VanDerWaalsContact O-N 3.14Å
252	H	56.9	Low	63.4	Low	74 Å²	74	75.9 Å²	75.9	34%	0.343	41%	0.412	S	S	.	.	H	α-helix	trans	-86.3	-36	179.7	-57.7	-53	0	0	0	112	C232 E234 C235 H248 Q249 E250 G254	C232-H252 PolarHBondContact SG-NE2 3.12Å; E234-H252 WeakPolarHBondContact OE2-CB 3.46Å; E234-H252 IonicContact OE2-CD2 2.94Å; E234-H252 PolarHBondContact OE2-CD2 2.82Å; E234-H252 IonicContact OE2-CG 3.07Å; C235-H252 PolarHBondContact SG-CE1 2.89Å; C235-H252 PolarHBondContact SG-NE2 3.02Å; H248-H252 AromaticContact CD2-NE2 3.81Å; H248-H252 AromaticContact CE1-CE1 3.96Å; H248-H252 AromaticContact CE1-NE2 3.57Å; H248-H252 AromaticContact NE2-CE1 3.83Å; H248-H252 AromaticContact NE2-NE2 3.08Å; H248-H252 PolarHBondContact NE2-NE2 3.41Å; Q249-H252 PolarHBondContact O-N 3.14Å; E250-H252 VanDerWaalsContact C-N 3.35Å; H252-G254 PolarHBondContact O-N 3.19Å
253	T	61.5	Low	63.6	Low	84 Å²	84	70.8 Å²	70.8	52%	0.515	40%	0.399	S	S	.	.	H	α-helix	trans	-74	-16.1	173.8	62.8	0	0	0	0	112.5	Q249 E250 E255	Q249-T253 PolarHBondContact O-N 3.04Å; Q249-T253 VanDerWaalsContact O-N 3.15Å; E250-T253 WeakPolarHBondContact CA-OG1 3.26Å; E250-T253 PolarHBondContact O-OG1 3.43Å; T253-E255 PolarHBondContact O-N 3.27Å
254	G	58.7	Low	63.5	Low	52 Å²	52	69.8 Å²	69.8	54%	0.536	40%	0.402	S	S	.	.			trans	73	2.2	-177.8	0	0	0	0	0	113.6	E250 H252 K256	E250-G254 PolarHBondContact O-N 2.96Å; E250-G254 VanDerWaalsContact O-N 3.13Å; H252-G254 PolarHBondContact O-N 3.19Å; G254-K256 PolarHBondContact O-N 3.05Å; G254-K256 VanDerWaalsContact O-N 3.13Å
255	E	57.5	Low	63.6	Low	132 Å²	132	71.5 Å²	71.5	62%	0.617	41%	0.408	S	S	*	.			trans	-70.4	109.1	177.9	-66.4	-171.3	161.1	0	0	109.3	E250 T253 P257	E250-E255 PolarHBondContact O-N 3.16Å; T253-E255 PolarHBondContact O-N 3.27Å; E255-P257 WeakPolarHBondContact O-CD 3.41Å
256	K	64.8	Low	63.3	Low	106 Å²	106	72 Å²	72	46%	0.461	41%	0.414	S	S	.	.			trans	-117.5	89.5	174	-76.2	164.8	161.4	-162.3	0	107.2	G254 F258 A266 Y267	G254-K256 PolarHBondContact O-N 3.05Å; G254-K256 VanDerWaalsContact O-N 3.13Å; K256-F258 PolarHBondContact O-N 3.29Å; K256-A266 HydrophobicContact CB-CB 3.28Å; K256-A266 HydrophobicContact CD-CB 3.77Å; K256-A266 VanDerWaalsContact CD-O 3.31Å; K256-A266 WeakPolarHBondContact CD-O 3.49Å; K256-A266 HydrophobicContact CG-CB 4.18Å; K256-A266 PolarHBondContact NZ-O 3.23Å; K256-Y267 CarbonylContact C-O 3.56Å
257	P	65.9	Low	63.3	Low	85 Å²	85	70.7 Å²	70.7	55%	0.552	41%	0.405	S	S	*	.			trans	-63.4	-19.1	-167.8	-22.3	32.7	0	0	0	113.9	E255	E255-P257 WeakPolarHBondContact O-CD 3.41Å
258	F	66.1	Low	63.4	Low	69 Å²	69	70 Å²	70	30%	0.303	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	91.8	-174	-55.7	-74.7	0	0	0	110.5	K256 A266 Y267 S268 W269 K270 L273	K256-F258 PolarHBondContact O-N 3.29Å; F258-A266 CarbonylContact O-C 3.41Å; F258-A266 WeakPolarHBondContact O-CA 3.48Å; F258-Y267 PolarHBondContact N-O 3.15Å; F258-Y267 PolarHBondContact O-N 2.84Å; F258-S268 WeakPolarHBondContact CD2-O 3.48Å; F258-S268 WeakPolarHBondContact CE2-O 3.41Å; F258-W269 VanDerWaalsContact CD2-C 3.48Å; F258-K270 HydrophobicContact CD1-CB 3.84Å; F258-K270 HydrophobicContact CD1-CG 4.28Å; F258-K270 HydrophobicContact CE1-CB 3.72Å; F258-K270 HydrophobicContact CE1-CD 4.49Å; F258-K270 HydrophobicContact CE1-CG 4.3Å; F258-K270 HydrophobicContact CE2-CB 4.49Å; F258-K270 HydrophobicContact CG-CB 4.28Å; F258-K270 HydrophobicContact CZ-CB 4.06Å; F258-L273 HydrophobicContact CB-CB 3.99Å; F258-L273 HydrophobicContact CB-CD2 3.82Å
259	C	60	Low	63.5	Low	78 Å²	78	75 Å²	75	53%	0.527	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	139.9	177.9	-64.3	0	0	0	0	112.1	A266	C259-A266 VanDerWaalsContact SG-CB 3.56Å
260	C	69.1	Low	63.5	Low	2 Å²	2	78.5 Å²	78.5	1%	0.014	43%	0.434	C	S	.	.			trans	-80.5	119.5	166.9	-176.9	0	0	0	0	109.6	E262 G264 K265 L273 H280	C260-E262 PolarHBondContact O-N 3.11Å; C260-G264 VanDerWaalsContact O-CA 3.28Å; C260-G264 WeakPolarHBondContact O-CA 3.42Å; C260-G264 PolarHBondContact O-N 3.21Å; C260-K265 WeakPolarHBondContact CB-O 3.12Å; C260-K265 PolarHBondContact N-O 3.16Å; C260-L273 HydrophobicContact CB-CD1 3.68Å; C260-H280 VanDerWaalsContact SG-CD2 3.54Å; C260-H280 PolarHBondContact SG-NE2 3.19Å
261	S	67.3	Low	63.7	Low	111 Å²	111	80 Å²	80	78%	0.776	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30	177.8	46.3	0	0	0	0	113.4
262	E	68.8	Low	64.2	Low	127 Å²	127	79.1 Å²	79.1	59%	0.593	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-26.9	-173.8	-66	175.3	174.4	0	0	114.2	C260 H280	C260-E262 PolarHBondContact O-N 3.11Å; E262-H280 WeakPolarHBondContact OE2-CB 3.48Å; E262-H280 IonicContact OE2-CD2 2.6Å; E262-H280 PolarHBondContact OE2-CD2 3.13Å; E262-H280 IonicContact OE2-CG 3.21Å; E262-H280 IonicContact OE2-NE2 2.68Å
263	C	66.1	Low	65.1	Low	51 Å²	51	76.5 Å²	76.5	35%	0.345	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.8	3.2	-175.8	77.5	0	0	0	0	114.4	K265 H276 H280	C263-K265 PolarHBondContact O-N 3.24Å; C263-K265 VanDerWaalsContact SG-CB 3.57Å; C263-K265 VanDerWaalsContact SG-CG 3.57Å; C263-H276 PolarHBondContact SG-NE2 3.47Å; C263-H280 PolarHBondContact SG-NE2 2.81Å
264	G	60.8	Low	65.8	Low	58 Å²	58	75.4 Å²	75.4	60%	0.598	42%	0.421	S	S	*	.			trans	67.6	1.6	179.8	0	0	0	0	0	115.1	C260 A266	C260-G264 VanDerWaalsContact O-CA 3.28Å; C260-G264 WeakPolarHBondContact O-CA 3.42Å; C260-G264 PolarHBondContact O-N 3.21Å; G264-A266 PolarHBondContact O-N 3.2Å
265	K	63.8	Low	66.6	Low	123 Å²	123	75.8 Å²	75.8	54%	0.535	41%	0.41	S	S	.	.			trans	-70.5	129.2	179.6	-72.4	179.2	-177.3	171.9	0	110.6	C260 C263 Y267	C260-K265 WeakPolarHBondContact CB-O 3.12Å; C260-K265 PolarHBondContact N-O 3.16Å; C263-K265 PolarHBondContact O-N 3.24Å; C263-K265 VanDerWaalsContact SG-CB 3.57Å; C263-K265 VanDerWaalsContact SG-CG 3.57Å; K265-Y267 HydrophobicContact CB-CE2 3.86Å; K265-Y267 WeakPolarHBondContact O-CE2 3.48Å
266	A	60.5	Low	67.4	Low	26 Å²	26	70.6 Å²	70.6	22%	0.215	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143.4	-177.4	0	0	0	0	0	111.8	K256 F258 C259 G264	K256-A266 HydrophobicContact CB-CB 3.28Å; K256-A266 HydrophobicContact CD-CB 3.77Å; K256-A266 VanDerWaalsContact CD-O 3.31Å; K256-A266 WeakPolarHBondContact CD-O 3.49Å; K256-A266 HydrophobicContact CG-CB 4.18Å; K256-A266 PolarHBondContact NZ-O 3.23Å; F258-A266 CarbonylContact O-C 3.41Å; F258-A266 WeakPolarHBondContact O-CA 3.48Å; C259-A266 VanDerWaalsContact SG-CB 3.56Å; G264-A266 PolarHBondContact O-N 3.2Å
267	Y	68.1	Low	67.9	Low	47 Å²	47	69 Å²	69	18%	0.184	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	149.1	-173.6	-62.2	-87.4	0	0	0	111.1	K256 F258 K265 Q272 L273 H276	K256-Y267 CarbonylContact C-O 3.56Å; F258-Y267 PolarHBondContact N-O 3.15Å; F258-Y267 PolarHBondContact O-N 2.84Å; K265-Y267 HydrophobicContact CB-CE2 3.86Å; K265-Y267 WeakPolarHBondContact O-CE2 3.48Å; Y267-Q272 HydrophobicContact CD1-CB 3.76Å; Y267-Q272 HydrophobicContact CG-CB 4.17Å; Y267-L273 HydrophobicContact CD2-CB 4.01Å; Y267-L273 HydrophobicContact CD2-CD1 3.86Å; Y267-L273 HydrophobicContact CE2-CD1 4.15Å; Y267-L273 HydrophobicContact CG-CB 4.35Å; Y267-H276 HydrophobicContact CE1-CB 4.04Å; Y267-H276 HydrophobicContact CE2-CB 3.77Å; Y267-H276 AromaticContact CE2-CD2 3.34Å; Y267-H276 WeakPolarHBondContact CE2-CD2 2.96Å; Y267-H276 AromaticContact CE2-CG 3.66Å; Y267-H276 VanDerWaalsContact CZ-CB 3.44Å; Y267-H276 AromaticContact CZ-CD2 3.54Å; Y267-H276 AromaticContact CZ-CG 3.39Å; Y267-H276 WeakPolarHBondContact OH-CB 3.42Å; Y267-H276 PolarHBondContact OH-CD2 3.17Å; Y267-H276 PolarHBondContact OH-ND1 3.16Å
268	S	61.9	Low	68.6	Low	21 Å²	21	68.6 Å²	68.6	15%	0.147	37%	0.367	C	S	.	.	S	Bend	trans	-76.2	-26	176.8	-50.3	0	0	0	0	111.9	F258	F258-S268 WeakPolarHBondContact CD2-O 3.48Å; F258-S268 WeakPolarHBondContact CE2-O 3.41Å
269	W	64.4	Low	68.9	Low	128 Å²	128	69 Å²	69	49%	0.485	38%	0.379	S	S	.	.	S	Bend	trans	-124.5	141.8	178.5	-60.9	-21.7	0	0	0	113.1	V247 F258 S271 Q272 L273	V247-W269 HydrophobicContact CG1-CZ2 4.27Å; V247-W269 VanDerWaalsContact CG1-NE1 3.34Å; F258-W269 VanDerWaalsContact CD2-C 3.48Å; W269-S271 PolarHBondContact O-N 2.79Å; W269-Q272 HydrophobicContact CB-CB 4.48Å; W269-Q272 HydrophobicContact CB-CG 4.08Å; W269-Q272 HydrophobicContact CE3-CG 4.23Å; W269-Q272 WeakPolarHBondContact O-CB 3.39Å; W269-Q272 PolarHBondContact O-N 3.03Å; W269-L273 PolarHBondContact O-N 2.76Å; W269-L273 VanDerWaalsContact O-N 3.14Å
270	K	65.2	Low	69.5	Low	140 Å²	140	68.7 Å²	68.7	61%	0.609	37%	0.37	S	S	*	.	H	α-helix	trans	-54.4	-38.6	171	-170.8	174.1	-179.7	175.7	0	112.7	F258 Q272 L273 V274	F258-K270 HydrophobicContact CD1-CB 3.84Å; F258-K270 HydrophobicContact CD1-CG 4.28Å; F258-K270 HydrophobicContact CE1-CB 3.72Å; F258-K270 HydrophobicContact CE1-CD 4.49Å; F258-K270 HydrophobicContact CE1-CG 4.3Å; F258-K270 HydrophobicContact CE2-CB 4.49Å; F258-K270 HydrophobicContact CG-CB 4.28Å; F258-K270 HydrophobicContact CZ-CB 4.06Å; K270-Q272 VanDerWaalsContact C-N 3.28Å; K270-Q272 PolarHBondContact O-N 3.26Å; K270-L273 PolarHBondContact O-N 3.01Å; K270-V274 HydrophobicContact CG-CG2 4.41Å; K270-V274 WeakPolarHBondContact O-CG2 3.48Å; K270-V274 PolarHBondContact O-N 3.04Å
271	S	70.8	Confident	69.7	Low	77 Å²	77	72.8 Å²	72.8	54%	0.538	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-32.8	177.5	57.6	0	0	0	0	113.2	W269 L275	W269-S271 PolarHBondContact O-N 2.79Å; S271-L275 WeakPolarHBondContact O-CB 3.45Å; S271-L275 PolarHBondContact O-N 2.79Å
272	Q	70.9	Confident	69.9	Low	71 Å²	71	69.7 Å²	69.7	33%	0.332	38%	0.38	S	S	.	.	H	α-helix	trans	-75.2	-38.7	175.9	-65	173.4	-3.1	0	0	111.3	Y267 W269 K270 L275 H276	Y267-Q272 HydrophobicContact CD1-CB 3.76Å; Y267-Q272 HydrophobicContact CG-CB 4.17Å; W269-Q272 HydrophobicContact CB-CB 4.48Å; W269-Q272 HydrophobicContact CB-CG 4.08Å; W269-Q272 HydrophobicContact CE3-CG 4.23Å; W269-Q272 WeakPolarHBondContact O-CB 3.39Å; W269-Q272 PolarHBondContact O-N 3.03Å; K270-Q272 VanDerWaalsContact C-N 3.28Å; K270-Q272 PolarHBondContact O-N 3.26Å; Q272-L275 PolarHBondContact O-N 3.32Å; Q272-H276 WeakPolarHBondContact O-CB 3.31Å; Q272-H276 PolarHBondContact O-N 3.08Å
273	L	74.6	Confident	70.2	Confident	18 Å²	18	67.4 Å²	67.4	9%	0.094	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-48.3	172.4	174.2	62.2	0	0	0	111.2	F258 C260 Y267 W269 K270 L275 H276 Q277	F258-L273 HydrophobicContact CB-CB 3.99Å; F258-L273 HydrophobicContact CB-CD2 3.82Å; C260-L273 HydrophobicContact CB-CD1 3.68Å; Y267-L273 HydrophobicContact CD2-CB 4.01Å; Y267-L273 HydrophobicContact CD2-CD1 3.86Å; Y267-L273 HydrophobicContact CE2-CD1 4.15Å; Y267-L273 HydrophobicContact CG-CB 4.35Å; W269-L273 PolarHBondContact O-N 2.76Å; W269-L273 VanDerWaalsContact O-N 3.14Å; K270-L273 PolarHBondContact O-N 3.01Å; L273-L275 VanDerWaalsContact C-N 3.28Å; L273-L275 PolarHBondContact O-N 3.15Å; L273-H276 CarbonylContact O-C 3.39Å; L273-H276 WeakPolarHBondContact O-CA 3.43Å; L273-H276 WeakPolarHBondContact O-CB 3.41Å; L273-H276 PolarHBondContact O-N 3.46Å; L273-Q277 HydrophobicContact CD1-CG 4.2Å; L273-Q277 HydrophobicContact CG-CG 4.47Å; L273-Q277 WeakPolarHBondContact O-CG 3.33Å; L273-Q277 PolarHBondContact O-N 3.43Å
274	V	75.7	Confident	70.9	Confident	62 Å²	62	70.1 Å²	70.1	38%	0.376	38%	0.381	S	S	.	.	H	α-helix	trans	-60	-40.6	177.5	170.4	0	0	0	0	111.2	K270 Q277	K270-V274 HydrophobicContact CG-CG2 4.41Å; K270-V274 WeakPolarHBondContact O-CG2 3.48Å; K270-V274 PolarHBondContact O-N 3.04Å; V274-Q277 PolarHBondContact O-N 3.49Å
275	L	75.8	Confident	71.8	Confident	60 Å²	60	70.8 Å²	70.8	31%	0.314	38%	0.375	S	S	.	.	H	α-helix	trans	-64.8	-40.8	174.2	175.4	60.1	0	0	0	112	S271 Q272 L273 R278 L297	S271-L275 WeakPolarHBondContact O-CB 3.45Å; S271-L275 PolarHBondContact O-N 2.79Å; Q272-L275 PolarHBondContact O-N 3.32Å; L273-L275 VanDerWaalsContact C-N 3.28Å; L273-L275 PolarHBondContact O-N 3.15Å; L275-R278 WeakPolarHBondContact O-CB 3.41Å; L275-R278 PolarHBondContact O-N 3.2Å; L275-L297 HydrophobicContact CD1-CD1 4.35Å; L275-L297 HydrophobicContact CD1-CD2 3.24Å; L275-L297 HydrophobicContact CD1-CG 3.69Å; L275-L297 HydrophobicContact CD2-CD1 4.16Å; L275-L297 HydrophobicContact CD2-CD2 3.71Å; L275-L297 HydrophobicContact CD2-CG 4.3Å; L275-L297 HydrophobicContact CG-CD2 4.1Å
276	H	74.9	Confident	72.8	Confident	22 Å²	22	68.4 Å²	68.4	10%	0.102	36%	0.363	C	S	.	.	H	α-helix	trans	-66.2	-40.4	177.1	170.4	53.3	0	0	0	112.2	C263 Y267 Q272 L273 R278 S279 H280	C263-H276 PolarHBondContact SG-NE2 3.47Å; Y267-H276 HydrophobicContact CE1-CB 4.04Å; Y267-H276 HydrophobicContact CE2-CB 3.77Å; Y267-H276 AromaticContact CE2-CD2 3.34Å; Y267-H276 WeakPolarHBondContact CE2-CD2 2.96Å; Y267-H276 AromaticContact CE2-CG 3.66Å; Y267-H276 VanDerWaalsContact CZ-CB 3.44Å; Y267-H276 AromaticContact CZ-CD2 3.54Å; Y267-H276 AromaticContact CZ-CG 3.39Å; Y267-H276 WeakPolarHBondContact OH-CB 3.42Å; Y267-H276 PolarHBondContact OH-CD2 3.17Å; Y267-H276 PolarHBondContact OH-ND1 3.16Å; Q272-H276 WeakPolarHBondContact O-CB 3.31Å; Q272-H276 PolarHBondContact O-N 3.08Å; L273-H276 CarbonylContact O-C 3.39Å; L273-H276 WeakPolarHBondContact O-CA 3.43Å; L273-H276 WeakPolarHBondContact O-CB 3.41Å; L273-H276 PolarHBondContact O-N 3.46Å; H276-R278 PolarHBondContact O-N 2.79Å; H276-R278 VanDerWaalsContact O-N 3.09Å; H276-S279 PolarHBondContact CE1-OG 3.04Å; H276-S279 PolarHBondContact ND1-OG 3.09Å; H276-S279 WeakPolarHBondContact O-CB 3.44Å; H276-S279 PolarHBondContact O-N 3.35Å; H276-S279 PolarHBondContact O-OG 3.37Å; H276-H280 AromaticContact CD2-NE2 4Å; H276-H280 AromaticContact CE1-CE1 3.73Å; H276-H280 AromaticContact CE1-NE2 3.48Å; H276-H280 PolarHBondContact CE1-NE2 3.41Å; H276-H280 AromaticContact NE2-CD2 3.98Å; H276-H280 AromaticContact NE2-CE1 3.77Å; H276-H280 AromaticContact NE2-NE2 3.12Å; H276-H280 PolarHBondContact NE2-NE2 3.33Å; H276-H280 VanDerWaalsContact NE2-NE2 3.12Å
277	Q	75.3	Confident	73.9	Confident	72 Å²	72	72.4 Å²	72.4	34%	0.336	38%	0.377	S	S	.	.	H	α-helix	trans	-56.9	-29	177.4	-75.6	171.8	-38.6	0	0	112.3	L273 V274 S279 H280 T281	L273-Q277 HydrophobicContact CD1-CG 4.2Å; L273-Q277 HydrophobicContact CG-CG 4.47Å; L273-Q277 WeakPolarHBondContact O-CG 3.33Å; L273-Q277 PolarHBondContact O-N 3.43Å; V274-Q277 PolarHBondContact O-N 3.49Å; Q277-S279 PolarHBondContact O-N 2.87Å; Q277-H280 PolarHBondContact O-N 3.06Å; Q277-T281 PolarHBondContact O-N 3Å; Q277-T281 VanDerWaalsContact O-N 3.13Å; Q277-T281 PolarHBondContact O-OG1 3.12Å
278	R	80	Confident	74.8	Confident	77 Å²	77	70.4 Å²	70.4	29%	0.291	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-21	172.1	-61.1	179.3	-175	177.9	-2.3	114.1	L275 H276 H280 G282 S296	L275-R278 WeakPolarHBondContact O-CB 3.41Å; L275-R278 PolarHBondContact O-N 3.2Å; H276-R278 PolarHBondContact O-N 2.79Å; H276-R278 VanDerWaalsContact O-N 3.09Å; R278-H280 VanDerWaalsContact C-N 3.31Å; R278-G282 PolarHBondContact O-N 3.48Å; R278-S296 PolarHBondContact NH1-O 3.06Å; R278-S296 VanDerWaalsContact NH1-O 3.09Å
279	S	73.6	Confident	75.8	Confident	79 Å²	79	76.8 Å²	76.8	55%	0.552	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-24.6	174.3	70.6	0	0	0	0	113	H276 Q277	H276-S279 PolarHBondContact CE1-OG 3.04Å; H276-S279 PolarHBondContact ND1-OG 3.09Å; H276-S279 WeakPolarHBondContact O-CB 3.44Å; H276-S279 PolarHBondContact O-N 3.35Å; H276-S279 PolarHBondContact O-OG 3.37Å; Q277-S279 PolarHBondContact O-N 2.87Å
280	H	71.6	Confident	76.7	Confident	71 Å²	71	76.5 Å²	76.5	33%	0.329	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-45.1	178.9	-57	-49.3	0	0	0	111.6	C260 E262 C263 H276 Q277 R278 G282	C260-H280 VanDerWaalsContact SG-CD2 3.54Å; C260-H280 PolarHBondContact SG-NE2 3.19Å; E262-H280 WeakPolarHBondContact OE2-CB 3.48Å; E262-H280 IonicContact OE2-CD2 2.6Å; E262-H280 PolarHBondContact OE2-CD2 3.13Å; E262-H280 IonicContact OE2-CG 3.21Å; E262-H280 IonicContact OE2-NE2 2.68Å; C263-H280 PolarHBondContact SG-NE2 2.81Å; H276-H280 AromaticContact CD2-NE2 4Å; H276-H280 AromaticContact CE1-CE1 3.73Å; H276-H280 AromaticContact CE1-NE2 3.48Å; H276-H280 PolarHBondContact CE1-NE2 3.41Å; H276-H280 AromaticContact NE2-CD2 3.98Å; H276-H280 AromaticContact NE2-CE1 3.77Å; H276-H280 AromaticContact NE2-NE2 3.12Å; H276-H280 PolarHBondContact NE2-NE2 3.33Å; H276-H280 VanDerWaalsContact NE2-NE2 3.12Å; Q277-H280 PolarHBondContact O-N 3.06Å; R278-H280 VanDerWaalsContact C-N 3.31Å; H280-G282 PolarHBondContact O-N 3.47Å
281	T	73.1	Confident	77.6	Confident	88 Å²	88	72.3 Å²	72.3	54%	0.54	39%	0.394	S	S	.	.	S	Bend	trans	-72.9	-11.6	177.6	61.9	0	0	0	0	113.1	Q277 V283	Q277-T281 PolarHBondContact O-N 3Å; Q277-T281 VanDerWaalsContact O-N 3.13Å; Q277-T281 PolarHBondContact O-OG1 3.12Å; T281-V283 PolarHBondContact O-N 3.47Å; T281-V283 WeakPolarHBondContact OG1-CG2 3.38Å
282	G	72.9	Confident	78.1	Confident	46 Å²	46	70.7 Å²	70.7	47%	0.474	39%	0.39	S	S	.	.			trans	67.4	3.9	-176.8	0	0	0	0	0	114.2	R278 H280 K284	R278-G282 PolarHBondContact O-N 3.48Å; H280-G282 PolarHBondContact O-N 3.47Å; G282-K284 WeakPolarHBondContact O-CG 3.23Å; G282-K284 PolarHBondContact O-N 3.23Å; G282-K284 VanDerWaalsContact O-N 3.16Å
283	V	73.8	Confident	78.5	Confident	79 Å²	79	73.1 Å²	73.1	48%	0.479	40%	0.399	S	S	.	.			trans	-64.2	116.6	-178	176.1	0	0	0	0	109.5	T281 P285	T281-V283 PolarHBondContact O-N 3.47Å; T281-V283 WeakPolarHBondContact OG1-CG2 3.38Å; V283-P285 HydrophobicContact CG1-CG 4.03Å; V283-P285 WeakPolarHBondContact O-CD 3.24Å
284	K	81.1	Confident	78.9	Confident	108 Å²	108	74.8 Å²	74.8	47%	0.47	41%	0.41	S	S	.	.			trans	-122.6	85.3	179.8	-72.1	170.6	178.6	-178.3	0	109.4	G282 Y286 T294 F295	G282-K284 WeakPolarHBondContact O-CG 3.23Å; G282-K284 PolarHBondContact O-N 3.23Å; G282-K284 VanDerWaalsContact O-N 3.16Å; K284-Y286 PolarHBondContact O-N 3.27Å; K284-T294 WeakPolarHBondContact CD-OG1 3.43Å; K284-F295 CarbonylContact C-O 3.56Å; K284-F295 VanDerWaalsContact C-O 3.26Å; K284-F295 WeakPolarHBondContact CA-O 2.86Å
285	P	80.7	Confident	79.2	Confident	72 Å²	72	73.9 Å²	73.9	47%	0.468	40%	0.401	S	S	.	.			trans	-65.6	-13.8	-169.7	-21.5	33.2	0	0	0	115.1	V283	V283-P285 HydrophobicContact CG1-CG 4.03Å; V283-P285 WeakPolarHBondContact O-CD 3.24Å
286	Y	83.3	Confident	79.4	Confident	73 Å²	73	73.2 Å²	73.2	29%	0.286	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	99.1	-175.4	-57	-81.3	0	0	0	109.4	K284 T294 F295 L297 K298 F301	K284-Y286 PolarHBondContact O-N 3.27Å; Y286-T294 CarbonylContact O-C 3.59Å; Y286-T294 WeakPolarHBondContact O-CA 3.14Å; Y286-F295 PolarHBondContact N-O 2.76Å; Y286-F295 PolarHBondContact O-N 2.99Å; Y286-L297 VanDerWaalsContact CD2-C 3.42Å; Y286-K298 HydrophobicContact CD1-CB 4.29Å; Y286-K298 HydrophobicContact CD1-CG 4.3Å; Y286-K298 HydrophobicContact CE1-CB 3.7Å; Y286-K298 HydrophobicContact CE1-CD 4.09Å; Y286-K298 HydrophobicContact CE1-CG 3.81Å; Y286-K298 HydrophobicContact CE2-CB 4.14Å; Y286-F301 HydrophobicContact CD1-CD1 4.22Å; Y286-F301 HydrophobicContact CG-CB 4.36Å; Y286-F301 HydrophobicContact CG-CD1 4.49Å; Y286-F301 HydrophobicContact CG-CG 4.41Å
287	E	84.1	Confident	79.5	Confident	110 Å²	110	75.1 Å²	75.1	51%	0.514	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	139.1	177	-175.2	169.6	174.8	0	0	111.5	T294 F301	E287-T294 HydrophobicContact CB-CG2 3.99Å; E287-T294 HydrophobicContact CG-CG2 3.87Å; E287-F301 VanDerWaalsContact O-CE2 3.23Å; E287-F301 WeakPolarHBondContact O-CE2 3.34Å
288	C	86.5	Confident	79.6	Confident	4 Å²	4	77.8 Å²	77.8	3%	0.027	42%	0.423	C	S	.	.			trans	-92.1	108.5	171.8	179.9	0	0	0	0	110.4	E290 C291 G292 K293 F301 H304 H308	C288-E290 PolarHBondContact O-N 3.25Å; C288-E290 VanDerWaalsContact O-N 3.08Å; C288-C291 PolarHBondContact O-N 3.49Å; C288-G292 WeakPolarHBondContact O-CA 3.48Å; C288-G292 PolarHBondContact O-N 2.99Å; C288-K293 WeakPolarHBondContact CB-O 3.37Å; C288-K293 PolarHBondContact N-O 3.35Å; C288-F301 HydrophobicContact CB-CE2 4.16Å; C288-H304 PolarHBondContact SG-NE2 3.29Å; C288-H304 VanDerWaalsContact SG-NE2 3.43Å; C288-H308 VanDerWaalsContact SG-CD2 3.5Å; C288-H308 PolarHBondContact SG-NE2 3.36Å
289	N	84.4	Confident	79.5	Confident	155 Å²	155	78 Å²	78	83%	0.829	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.6	-179.2	-59.7	-6.1	0	0	0	113.8
290	E	82.8	Confident	79.7	Confident	123 Å²	123	77 Å²	77	58%	0.575	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-23.2	-177.5	-62.3	-178	-126.6	0	0	114.2	C288 H308	C288-E290 PolarHBondContact O-N 3.25Å; C288-E290 VanDerWaalsContact O-N 3.08Å; E290-H308 IonicContact OE1-CD2 3.17Å; E290-H308 WeakPolarHBondContact OE2-CB 3.38Å; E290-H308 IonicContact OE2-CD2 3.33Å; E290-H308 IonicContact OE2-CG 3.83Å; E290-H308 VanDerWaalsContact OE2-CG 3.28Å
291	C	83.2	Confident	80.3	Confident	52 Å²	52	75.2 Å²	75.2	35%	0.351	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.1	10	-179.4	72.7	0	0	0	0	115.1	C288 K293 H304 H308	C288-C291 PolarHBondContact O-N 3.49Å; C291-K293 PolarHBondContact O-N 3.5Å; C291-H304 PolarHBondContact SG-CE1 3.1Å; C291-H304 PolarHBondContact SG-NE2 3.32Å; C291-H308 PolarHBondContact SG-NE2 3.39Å
292	G	81.6	Confident	80.8	Confident	43 Å²	43	73.8 Å²	73.8	44%	0.443	41%	0.408	S	S	.	.			trans	64.3	8	179.1	0	0	0	0	0	114.8	C288 T294	C288-G292 WeakPolarHBondContact O-CA 3.48Å; C288-G292 PolarHBondContact O-N 2.99Å; G292-T294 PolarHBondContact O-N 3.41Å
293	K	79.3	Confident	81.3	Confident	122 Å²	122	73.3 Å²	73.3	53%	0.53	40%	0.395	S	S	.	.			trans	-75.7	129.2	-178.6	-75.7	-177.5	-174.1	174.2	0	110.8	C288 C291 F295	C288-K293 WeakPolarHBondContact CB-O 3.37Å; C288-K293 PolarHBondContact N-O 3.35Å; C291-K293 PolarHBondContact O-N 3.5Å; K293-F295 HydrophobicContact CB-CE2 3.92Å; K293-F295 HydrophobicContact CB-CZ 4.19Å; K293-F295 WeakPolarHBondContact O-CE2 3.35Å
294	T	84.2	Confident	81.8	Confident	53 Å²	53	70.6 Å²	70.6	33%	0.325	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	144.2	-177.8	56.2	0	0	0	0	112.2	K284 Y286 E287 G292	K284-T294 WeakPolarHBondContact CD-OG1 3.43Å; Y286-T294 CarbonylContact O-C 3.59Å; Y286-T294 WeakPolarHBondContact O-CA 3.14Å; E287-T294 HydrophobicContact CB-CG2 3.99Å; E287-T294 HydrophobicContact CG-CG2 3.87Å; G292-T294 PolarHBondContact O-N 3.41Å
295	F	81.6	Confident	81.9	Confident	42 Å²	42	69.1 Å²	69.1	18%	0.184	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	144.6	-177.9	-57.2	-96.1	0	0	0	111.3	K284 Y286 K293 L297 P300 F301 H304	K284-F295 CarbonylContact C-O 3.56Å; K284-F295 VanDerWaalsContact C-O 3.26Å; K284-F295 WeakPolarHBondContact CA-O 2.86Å; Y286-F295 PolarHBondContact N-O 2.76Å; Y286-F295 PolarHBondContact O-N 2.99Å; K293-F295 HydrophobicContact CB-CE2 3.92Å; K293-F295 HydrophobicContact CB-CZ 4.19Å; K293-F295 WeakPolarHBondContact O-CE2 3.35Å; F295-L297 VanDerWaalsContact C-N 3.34Å; F295-P300 HydrophobicContact CD1-CB 3.97Å; F295-F301 HydrophobicContact CB-CB 3.99Å; F295-F301 HydrophobicContact CD2-CB 3.96Å; F295-F301 AromaticContact CD2-CD2 3.76Å; F295-F301 HydrophobicContact CD2-CD2 3.76Å; F295-F301 HydrophobicContact CD2-CG 4.37Å; F295-F301 HydrophobicContact CE2-CD2 4.22Å; F295-F301 HydrophobicContact CG-CB 4Å; F295-H304 HydrophobicContact CE1-CB 3.93Å; F295-H304 HydrophobicContact CE2-CB 3.88Å; F295-H304 AromaticContact CE2-CD2 3.24Å; F295-H304 WeakPolarHBondContact CE2-CD2 3.5Å; F295-H304 AromaticContact CE2-CG 3.62Å; F295-H304 HydrophobicContact CZ-CB 3.35Å; F295-H304 AromaticContact CZ-CD2 3.38Å; F295-H304 WeakPolarHBondContact CZ-CD2 3.35Å; F295-H304 AromaticContact CZ-CG 3.23Å; F295-H304 AromaticContact CZ-ND1 3.96Å
296	S	79.5	Confident	82.1	Confident	47 Å²	47	68.9 Å²	68.9	33%	0.329	36%	0.362	S	S	.	.	S	Bend	trans	-79.8	-18.1	176.9	55	0	0	0	0	113.5	R278	R278-S296 PolarHBondContact NH1-O 3.06Å; R278-S296 VanDerWaalsContact NH1-O 3.09Å
297	L	76.8	Confident	82.1	Confident	62 Å²	62	67.6 Å²	67.6	33%	0.325	36%	0.362	S	S	.	.	S	Bend	trans	-129.5	147	-175.8	-76.3	176	0	0	0	111.8	L275 Y286 F295 P300 F301	L275-L297 HydrophobicContact CD1-CD1 4.35Å; L275-L297 HydrophobicContact CD1-CD2 3.24Å; L275-L297 HydrophobicContact CD1-CG 3.69Å; L275-L297 HydrophobicContact CD2-CD1 4.16Å; L275-L297 HydrophobicContact CD2-CD2 3.71Å; L275-L297 HydrophobicContact CD2-CG 4.3Å; L275-L297 HydrophobicContact CG-CD2 4.1Å; Y286-L297 VanDerWaalsContact CD2-C 3.42Å; F295-L297 VanDerWaalsContact C-N 3.34Å; L297-P300 VanDerWaalsContact CB-CD 3.46Å; L297-P300 HydrophobicContact CB-CG 4.05Å; L297-P300 WeakPolarHBondContact O-CD 3.37Å; L297-F301 PolarHBondContact O-N 3.12Å
298	K	76.9	Confident	82	Confident	127 Å²	127	65.1 Å²	65.1	55%	0.552	35%	0.35	S	S	*	.	H	α-helix	trans	-67.3	-38	176.9	-164.9	170.1	-178.1	172.7	0	112.6	Y286 F301 I302	Y286-K298 HydrophobicContact CD1-CB 4.29Å; Y286-K298 HydrophobicContact CD1-CG 4.3Å; Y286-K298 HydrophobicContact CE1-CB 3.7Å; Y286-K298 HydrophobicContact CE1-CD 4.09Å; Y286-K298 HydrophobicContact CE1-CG 3.81Å; Y286-K298 HydrophobicContact CE2-CB 4.14Å; K298-F301 WeakPolarHBondContact O-CB 3.37Å; K298-F301 PolarHBondContact O-N 3.1Å; K298-I302 HydrophobicContact CG-CG1 4.17Å; K298-I302 WeakPolarHBondContact O-CG1 3.3Å; K298-I302 PolarHBondContact O-N 2.82Å
299	S	77.8	Confident	81.7	Confident	82 Å²	82	68.4 Å²	68.4	57%	0.573	37%	0.37	S	S	*	.	H	α-helix	trans	-66.5	-45.7	-174.3	48	0	0	0	0	114	F301 V303	S299-F301 VanDerWaalsContact C-N 3.32Å; S299-F301 PolarHBondContact O-N 3.15Å; S299-V303 WeakPolarHBondContact O-CG2 3.41Å; S299-V303 PolarHBondContact O-N 3.09Å
300	P	78.8	Confident	81.2	Confident	58 Å²	58	66.3 Å²	66.3	38%	0.377	36%	0.355	S	S	.	.	H	α-helix	trans	-65.1	-35.6	171.7	-21	35.4	0	0	0	112.6	F295 L297 V303 H304	F295-P300 HydrophobicContact CD1-CB 3.97Å; L297-P300 VanDerWaalsContact CB-CD 3.46Å; L297-P300 HydrophobicContact CB-CG 4.05Å; L297-P300 WeakPolarHBondContact O-CD 3.37Å; P300-V303 PolarHBondContact O-N 3.38Å; P300-H304 WeakPolarHBondContact O-CB 3.37Å; P300-H304 PolarHBondContact O-N 2.75Å
301	F	84.3	Confident	81.1	Confident	33 Å²	33	64.2 Å²	64.2	15%	0.145	35%	0.351	C	S	.	.	H	α-helix	trans	-59.3	-49.1	176	168.8	-108.4	0	0	0	112.2	Y286 E287 C288 F295 L297 K298 S299 V303 H304 Q305	Y286-F301 HydrophobicContact CD1-CD1 4.22Å; Y286-F301 HydrophobicContact CG-CB 4.36Å; Y286-F301 HydrophobicContact CG-CD1 4.49Å; Y286-F301 HydrophobicContact CG-CG 4.41Å; E287-F301 VanDerWaalsContact O-CE2 3.23Å; E287-F301 WeakPolarHBondContact O-CE2 3.34Å; C288-F301 HydrophobicContact CB-CE2 4.16Å; F295-F301 HydrophobicContact CB-CB 3.99Å; F295-F301 HydrophobicContact CD2-CB 3.96Å; F295-F301 AromaticContact CD2-CD2 3.76Å; F295-F301 HydrophobicContact CD2-CD2 3.76Å; F295-F301 HydrophobicContact CD2-CG 4.37Å; F295-F301 HydrophobicContact CE2-CD2 4.22Å; F295-F301 HydrophobicContact CG-CB 4Å; L297-F301 PolarHBondContact O-N 3.12Å; K298-F301 WeakPolarHBondContact O-CB 3.37Å; K298-F301 PolarHBondContact O-N 3.1Å; S299-F301 VanDerWaalsContact C-N 3.32Å; S299-F301 PolarHBondContact O-N 3.15Å; F301-V303 VanDerWaalsContact C-N 3.31Å; F301-V303 PolarHBondContact O-N 3.45Å; F301-H304 CarbonylContact O-C 3.56Å; F301-H304 WeakPolarHBondContact O-CA 3.38Å; F301-H304 WeakPolarHBondContact O-CB 3.46Å; F301-H304 PolarHBondContact O-N 2.77Å; F301-H304 VanDerWaalsContact O-N 3.08Å; F301-Q305 PolarHBondContact O-N 3.32Å
302	I	82.6	Confident	81.2	Confident	59 Å²	59	65.9 Å²	65.9	30%	0.303	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-38.8	177.7	-65.4	-64.2	0	0	0	111.6	K298 H304 Q305 R306	K298-I302 HydrophobicContact CG-CG1 4.17Å; K298-I302 WeakPolarHBondContact O-CG1 3.3Å; K298-I302 PolarHBondContact O-N 2.82Å; I302-H304 VanDerWaalsContact C-N 3.3Å; I302-Q305 PolarHBondContact O-N 3.48Å; I302-R306 WeakPolarHBondContact O-CG 3.34Å; I302-R306 PolarHBondContact O-N 3.09Å
303	V	83.4	Confident	81.3	Confident	36 Å²	36	67.1 Å²	67.1	22%	0.218	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-35.8	175.3	174.9	0	0	0	0	111.2	S299 P300 F301 R306 Y328	S299-V303 WeakPolarHBondContact O-CG2 3.41Å; S299-V303 PolarHBondContact O-N 3.09Å; P300-V303 PolarHBondContact O-N 3.38Å; F301-V303 VanDerWaalsContact C-N 3.31Å; F301-V303 PolarHBondContact O-N 3.45Å; V303-R306 WeakPolarHBondContact O-CB 3.31Å; V303-Y328 HydrophobicContact CG1-CE2 4.33Å
304	H	84.4	Confident	81.7	Confident	22 Å²	22	63.3 Å²	63.3	10%	0.102	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-43.5	174.2	169.8	60.8	0	0	0	112.1	C288 C291 F295 P300 F301 I302 R306 T307 H308	C288-H304 PolarHBondContact SG-NE2 3.29Å; C288-H304 VanDerWaalsContact SG-NE2 3.43Å; C291-H304 PolarHBondContact SG-CE1 3.1Å; C291-H304 PolarHBondContact SG-NE2 3.32Å; F295-H304 HydrophobicContact CE1-CB 3.93Å; F295-H304 HydrophobicContact CE2-CB 3.88Å; F295-H304 AromaticContact CE2-CD2 3.24Å; F295-H304 WeakPolarHBondContact CE2-CD2 3.5Å; F295-H304 AromaticContact CE2-CG 3.62Å; F295-H304 HydrophobicContact CZ-CB 3.35Å; F295-H304 AromaticContact CZ-CD2 3.38Å; F295-H304 WeakPolarHBondContact CZ-CD2 3.35Å; F295-H304 AromaticContact CZ-CG 3.23Å; F295-H304 AromaticContact CZ-ND1 3.96Å; P300-H304 WeakPolarHBondContact O-CB 3.37Å; P300-H304 PolarHBondContact O-N 2.75Å; F301-H304 CarbonylContact O-C 3.56Å; F301-H304 WeakPolarHBondContact O-CA 3.38Å; F301-H304 WeakPolarHBondContact O-CB 3.46Å; F301-H304 PolarHBondContact O-N 2.77Å; F301-H304 VanDerWaalsContact O-N 3.08Å; I302-H304 VanDerWaalsContact C-N 3.3Å; H304-R306 PolarHBondContact O-N 3.08Å; H304-R306 VanDerWaalsContact O-N 3.09Å; H304-T307 VanDerWaalsContact O-CB 3.3Å; H304-T307 WeakPolarHBondContact O-CB 3.42Å; H304-T307 WeakPolarHBondContact O-CG2 3.34Å; H304-T307 PolarHBondContact O-N 2.84Å; H304-T307 PolarHBondContact O-OG1 3.37Å; H304-H308 AromaticContact CE1-NE2 3.77Å; H304-H308 AromaticContact NE2-NE2 3.6Å
305	Q	82.9	Confident	81.7	Confident	76 Å²	76	68 Å²	68	36%	0.355	35%	0.352	S	S	.	.	H	α-helix	trans	-56.4	-31.5	178.2	-168	178.4	-1.8	0	0	112.2	F301 I302 T307 H308 T309	F301-Q305 PolarHBondContact O-N 3.32Å; I302-Q305 PolarHBondContact O-N 3.48Å; Q305-T307 PolarHBondContact O-N 3.5Å; Q305-T307 VanDerWaalsContact O-N 3.15Å; Q305-H308 PolarHBondContact O-N 3.3Å; Q305-H308 VanDerWaalsContact O-N 3.1Å; Q305-T309 PolarHBondContact O-N 3.48Å
306	R	85.6	Confident	82.1	Confident	67 Å²	67	66.1 Å²	66.1	25%	0.253	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-9.8	172.5	-64.2	171	-171.8	-176.5	-3.6	114.5	I302 V303 H304 H308 Q310 R324	I302-R306 WeakPolarHBondContact O-CG 3.34Å; I302-R306 PolarHBondContact O-N 3.09Å; V303-R306 WeakPolarHBondContact O-CB 3.31Å; H304-R306 PolarHBondContact O-N 3.08Å; H304-R306 VanDerWaalsContact O-N 3.09Å; R306-H308 VanDerWaalsContact C-N 3.3Å; R306-Q310 PolarHBondContact O-N 3.05Å; R306-R324 HydrophobicContact CB-CB 4.2Å; R306-R324 HydrophobicContact CB-CG 4.16Å; R306-R324 WeakPolarHBondContact CD-O 3.46Å; R306-R324 PolarHBondContact NH1-O 3.07Å; R306-R324 WeakPolarHBondContact O-CD 3.28Å; R306-R324 PolarHBondContact O-NE 3.37Å
307	T	82.9	Confident	82.4	Confident	46 Å²	46	71.3 Å²	71.3	28%	0.282	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-29.8	171.4	64.7	0	0	0	0	111.8	H304 Q305 Q310	H304-T307 VanDerWaalsContact O-CB 3.3Å; H304-T307 WeakPolarHBondContact O-CB 3.42Å; H304-T307 WeakPolarHBondContact O-CG2 3.34Å; H304-T307 PolarHBondContact O-N 2.84Å; H304-T307 PolarHBondContact O-OG1 3.37Å; Q305-T307 PolarHBondContact O-N 3.5Å; Q305-T307 VanDerWaalsContact O-N 3.15Å; T307-Q310 PolarHBondContact O-NE2 3.46Å
308	H	82.5	Confident	82.7	Confident	58 Å²	58	73.5 Å²	73.5	27%	0.269	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-44.8	-178.3	-53.4	-46.6	0	0	0	112.1	C288 E290 C291 H304 Q305 R306 Q310	C288-H308 VanDerWaalsContact SG-CD2 3.5Å; C288-H308 PolarHBondContact SG-NE2 3.36Å; E290-H308 IonicContact OE1-CD2 3.17Å; E290-H308 WeakPolarHBondContact OE2-CB 3.38Å; E290-H308 IonicContact OE2-CD2 3.33Å; E290-H308 IonicContact OE2-CG 3.83Å; E290-H308 VanDerWaalsContact OE2-CG 3.28Å; C291-H308 PolarHBondContact SG-NE2 3.39Å; H304-H308 AromaticContact CE1-NE2 3.77Å; H304-H308 AromaticContact NE2-NE2 3.6Å; Q305-H308 PolarHBondContact O-N 3.3Å; Q305-H308 VanDerWaalsContact O-N 3.1Å; R306-H308 VanDerWaalsContact C-N 3.3Å; H308-Q310 PolarHBondContact O-N 3.13Å; H308-Q310 VanDerWaalsContact O-N 3.12Å
309	T	79.8	Confident	83.2	Confident	74 Å²	74	69.9 Å²	69.9	45%	0.454	37%	0.37	S	S	.	.	S	Bend	trans	-71.1	-8.1	176.7	65.4	0	0	0	0	113.6	Q305 V311	Q305-T309 PolarHBondContact O-N 3.48Å; T309-V311 PolarHBondContact O-N 2.85Å
310	Q	75.1	Confident	83.4	Confident	110 Å²	110	68.6 Å²	68.6	51%	0.514	37%	0.371	S	S	.	.			trans	52.7	10.4	-173.3	-60.6	-60.8	-15.7	0	0	115.7	R306 T307 H308 K312	R306-Q310 PolarHBondContact O-N 3.05Å; T307-Q310 PolarHBondContact O-NE2 3.46Å; H308-Q310 PolarHBondContact O-N 3.13Å; H308-Q310 VanDerWaalsContact O-N 3.12Å; Q310-K312 PolarHBondContact O-N 3.42Å
311	V	80.1	Confident	83.7	Confident	79 Å²	79	72 Å²	72	48%	0.479	38%	0.379	S	S	.	.			trans	-66.8	120.7	177.8	-179.2	0	0	0	0	109.2	T309 P313	T309-V311 PolarHBondContact O-N 2.85Å; V311-P313 HydrophobicContact CG1-CG 4.04Å; V311-P313 WeakPolarHBondContact O-CD 3.38Å
312	K	84.9	Confident	83.9	Confident	87 Å²	87	71.9 Å²	71.9	38%	0.378	38%	0.384	S	S	.	.			trans	-121.2	84.1	179.4	-72.8	162.6	171.4	-176.7	0	109.5	Q310 H314 A322 F323 R324	Q310-K312 PolarHBondContact O-N 3.42Å; K312-H314 PolarHBondContact O-N 2.91Å; K312-H314 VanDerWaalsContact O-N 3.15Å; K312-A322 HydrophobicContact CB-CB 3.48Å; K312-A322 VanDerWaalsContact CB-CB 3.48Å; K312-A322 HydrophobicContact CD-CB 4.07Å; K312-A322 WeakPolarHBondContact CD-O 3.42Å; K312-A322 HydrophobicContact CG-CB 4.37Å; K312-F323 CarbonylContact C-O 3.56Å; K312-F323 WeakPolarHBondContact CA-O 3.35Å; K312-R324 HydrophobicContact CG-CG 3.95Å
313	P	84.7	Confident	84.1	Confident	69 Å²	69	71 Å²	71	45%	0.448	38%	0.378	S	S	.	.			trans	-67	-17.2	-172.1	-20.1	32.1	0	0	0	114.4	V311	V311-P313 HydrophobicContact CG1-CG 4.04Å; V311-P313 WeakPolarHBondContact O-CD 3.38Å
314	H	86.1	Confident	84.1	Confident	42 Å²	42	72.8 Å²	72.8	19%	0.194	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	96.1	-169.3	-57.8	-61.5	0	0	0	110.3	K312 A322 F323 K326 L329	K312-H314 PolarHBondContact O-N 2.91Å; K312-H314 VanDerWaalsContact O-N 3.15Å; H314-A322 CarbonylContact O-C 3.55Å; H314-A322 WeakPolarHBondContact O-CA 3.39Å; H314-F323 HydrophobicContact CB-CB 4.46Å; H314-F323 PolarHBondContact N-O 2.91Å; H314-F323 VanDerWaalsContact N-O 3.15Å; H314-F323 PolarHBondContact O-N 3.24Å; H314-K326 PolarHBondContact CD2-N 2.83Å; H314-K326 VanDerWaalsContact CD2-N 3.35Å; H314-K326 WeakPolarHBondContact CE1-CG 3.4Å; H314-L329 HydrophobicContact CB-CB 4.23Å; H314-L329 HydrophobicContact CB-CD2 3.93Å
315	K	85.1	Confident	84.1	Confident	151 Å²	151	73 Å²	73	66%	0.657	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	141	177.3	-63.1	-177.6	179.7	-179.8	0	110.7	A322	K315-A322 HydrophobicContact CG-CB 3.95Å
316	C	90	Very high	84	Confident	3 Å²	3	76.6 Å²	76.6	2%	0.02	40%	0.4	C	S	.	.			trans	-84.4	128	169.6	174.5	0	0	0	0	108.8	C319 G320 K321 F323 L329 H336	C316-C319 VanDerWaalsContact SG-SG 3.64Å; C316-G320 WeakPolarHBondContact O-CA 3.48Å; C316-G320 PolarHBondContact O-N 2.81Å; C316-K321 VanDerWaalsContact CB-O 3.29Å; C316-K321 WeakPolarHBondContact CB-O 3.34Å; C316-K321 PolarHBondContact N-O 3.17Å; C316-F323 HydrophobicContact CB-CE2 4.12Å; C316-L329 HydrophobicContact CB-CD1 3.6Å; C316-H336 PolarHBondContact SG-NE2 3.12Å
317	N	85.9	Confident	83.8	Confident	156 Å²	156	79.2 Å²	79.2	83%	0.834	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-31.3	-178.5	-64.6	-9.8	0	0	0	111.8
318	D	83.4	Confident	83.8	Confident	108 Å²	108	83.1 Å²	83.1	58%	0.578	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-28.1	-173.6	-46.4	-40.3	0	0	0	113.9	H336	D318-H336 IonicContact OD2-CD2 3.7Å; D318-H336 PolarHBondContact OD2-CD2 3.23Å; D318-H336 IonicContact OD2-CG 3.94Å
319	C	86.6	Confident	84	Confident	51 Å²	51	82 Å²	82	35%	0.345	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137	7.5	-175.9	73.1	0	0	0	0	114.6	C316 K321 H332 H336	C316-C319 VanDerWaalsContact SG-SG 3.64Å; C319-K321 PolarHBondContact O-N 3.03Å; C319-H332 PolarHBondContact SG-NE2 3.41Å; C319-H336 PolarHBondContact SG-NE2 3.42Å; C319-H336 VanDerWaalsContact SG-NE2 3.4Å
320	G	82.5	Confident	84.3	Confident	56 Å²	56	82.5 Å²	82.5	58%	0.577	42%	0.419	S	S	*	.			trans	68.6	-5.8	179.7	0	0	0	0	0	115.8	C316 A322	C316-G320 WeakPolarHBondContact O-CA 3.48Å; C316-G320 PolarHBondContact O-N 2.81Å; G320-A322 PolarHBondContact O-N 3.14Å
321	K	85.6	Confident	84.7	Confident	130 Å²	130	78.5 Å²	78.5	57%	0.565	40%	0.401	S	S	*	.			trans	-66	133.2	-177.9	-71.1	-179.5	-178	173.9	0	111.6	C316 C319 F323	C316-K321 VanDerWaalsContact CB-O 3.29Å; C316-K321 WeakPolarHBondContact CB-O 3.34Å; C316-K321 PolarHBondContact N-O 3.17Å; C319-K321 PolarHBondContact O-N 3.03Å; K321-F323 HydrophobicContact CB-CE2 3.89Å; K321-F323 HydrophobicContact CB-CZ 4.05Å; K321-F323 WeakPolarHBondContact O-CD2 3.46Å; K321-F323 VanDerWaalsContact O-CE2 3.29Å; K321-F323 WeakPolarHBondContact O-CE2 3.2Å
322	A	87.6	Confident	85	Confident	29 Å²	29	75.7 Å²	75.7	24%	0.24	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	142.6	-179	0	0	0	0	0	112.8	K312 H314 K315 G320	K312-A322 HydrophobicContact CB-CB 3.48Å; K312-A322 VanDerWaalsContact CB-CB 3.48Å; K312-A322 HydrophobicContact CD-CB 4.07Å; K312-A322 WeakPolarHBondContact CD-O 3.42Å; K312-A322 HydrophobicContact CG-CB 4.37Å; H314-A322 CarbonylContact O-C 3.55Å; H314-A322 WeakPolarHBondContact O-CA 3.39Å; K315-A322 HydrophobicContact CG-CB 3.95Å; G320-A322 PolarHBondContact O-N 3.14Å
323	F	86.3	Confident	85	Confident	41 Å²	41	73.3 Å²	73.3	18%	0.18	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	152.3	-174.9	-61.3	-88.1	0	0	0	112.2	K312 H314 C316 K321 L329 H332	K312-F323 CarbonylContact C-O 3.56Å; K312-F323 WeakPolarHBondContact CA-O 3.35Å; H314-F323 HydrophobicContact CB-CB 4.46Å; H314-F323 PolarHBondContact N-O 2.91Å; H314-F323 VanDerWaalsContact N-O 3.15Å; H314-F323 PolarHBondContact O-N 3.24Å; C316-F323 HydrophobicContact CB-CE2 4.12Å; K321-F323 HydrophobicContact CB-CE2 3.89Å; K321-F323 HydrophobicContact CB-CZ 4.05Å; K321-F323 WeakPolarHBondContact O-CD2 3.46Å; K321-F323 VanDerWaalsContact O-CE2 3.29Å; K321-F323 WeakPolarHBondContact O-CE2 3.2Å; F323-L329 HydrophobicContact CB-CB 4.23Å; F323-L329 HydrophobicContact CD2-CB 4.08Å; F323-L329 HydrophobicContact CD2-CD1 3.74Å; F323-L329 HydrophobicContact CE2-CD1 4.05Å; F323-L329 HydrophobicContact CG-CB 4.3Å; F323-H332 HydrophobicContact CE1-CB 3.79Å; F323-H332 AromaticContact CE1-CG 3.95Å; F323-H332 HydrophobicContact CE2-CB 3.89Å; F323-H332 AromaticContact CE2-CD2 3.28Å; F323-H332 WeakPolarHBondContact CE2-CD2 3.33Å; F323-H332 AromaticContact CE2-CG 3.59Å; F323-H332 AromaticContact CE2-NE2 3.95Å; F323-H332 HydrophobicContact CZ-CB 3.4Å; F323-H332 VanDerWaalsContact CZ-CB 3.4Å; F323-H332 AromaticContact CZ-CD2 3.29Å; F323-H332 WeakPolarHBondContact CZ-CD2 3.43Å; F323-H332 AromaticContact CZ-CG 3.11Å; F323-H332 AromaticContact CZ-ND1 3.64Å; F323-H332 AromaticContact CZ-NE2 3.84Å
324	R	83.6	Confident	85.1	Confident	73 Å²	73	71.9 Å²	71.9	28%	0.275	36%	0.361	S	S	.	.	S	Bend	trans	-79.8	-17.4	-177.4	-61.6	178.3	-176.8	101.2	-0.1	113.7	R306 K312	R306-R324 HydrophobicContact CB-CB 4.2Å; R306-R324 HydrophobicContact CB-CG 4.16Å; R306-R324 WeakPolarHBondContact CD-O 3.46Å; R306-R324 PolarHBondContact NH1-O 3.07Å; R306-R324 WeakPolarHBondContact O-CD 3.28Å; R306-R324 PolarHBondContact O-NE 3.37Å; K312-R324 HydrophobicContact CG-CG 3.95Å
325	S	84.1	Confident	84.9	Confident	27 Å²	27	76.1 Å²	76.1	19%	0.189	38%	0.383	C	S	.	.	S	Bend	trans	-147.1	149.1	179.8	174.2	0	0	0	0	110.9	F327 Y328 L329	S325-F327 PolarHBondContact O-N 3.14Å; S325-F327 PolarHBondContact OG-N 3.3Å; S325-Y328 PolarHBondContact O-N 3.24Å; S325-Y328 VanDerWaalsContact O-N 3.16Å; S325-L329 PolarHBondContact O-N 3.35Å
326	K	82.3	Confident	84.8	Confident	152 Å²	152	72.9 Å²	72.9	66%	0.661	37%	0.37	S	S	*	.	H	α-helix	trans	-55.3	-35.1	174.1	-66.5	-171.5	178.1	-175	0	112.6	H314 L329 L330	H314-K326 PolarHBondContact CD2-N 2.83Å; H314-K326 VanDerWaalsContact CD2-N 3.35Å; H314-K326 WeakPolarHBondContact CE1-CG 3.4Å; K326-L329 PolarHBondContact O-N 3.36Å; K326-L330 WeakPolarHBondContact O-CB 3.43Å; K326-L330 PolarHBondContact O-N 2.83Å
327	F	80.1	Confident	84.3	Confident	121 Å²	121	76.7 Å²	76.7	53%	0.531	39%	0.393	S	S	.	.	H	α-helix	trans	-62.1	-44.3	177.8	175.3	-98.1	0	0	0	112.2	S325 L329 L330 V331	S325-F327 PolarHBondContact O-N 3.14Å; S325-F327 PolarHBondContact OG-N 3.3Å; F327-L329 VanDerWaalsContact C-N 3.35Å; F327-L330 PolarHBondContact O-N 3.05Å; F327-V331 HydrophobicContact CE1-CG2 4.04Å; F327-V331 HydrophobicContact CE2-CG2 4.21Å; F327-V331 HydrophobicContact CZ-CG2 3.88Å; F327-V331 WeakPolarHBondContact O-CG2 3.32Å; F327-V331 PolarHBondContact O-N 3.28Å
328	Y	83.6	Confident	84.1	Confident	129 Å²	129	71.6 Å²	71.6	51%	0.506	38%	0.378	S	S	.	.	H	α-helix	trans	-69.2	-35.6	178.4	-68.1	-60	0	0	0	112	V303 S325 H332	V303-Y328 HydrophobicContact CG1-CE2 4.33Å; S325-Y328 PolarHBondContact O-N 3.24Å; S325-Y328 VanDerWaalsContact O-N 3.16Å; Y328-H332 VanDerWaalsContact O-CB 3.28Å; Y328-H332 WeakPolarHBondContact O-CB 3.48Å; Y328-H332 PolarHBondContact O-N 2.92Å
329	L	87	Confident	84	Confident	33 Å²	33	71.6 Å²	71.6	17%	0.173	37%	0.374	C	S	.	.	H	α-helix	trans	-60.9	-48.3	171.1	175	62	0	0	0	110.8	H314 C316 F323 S325 K326 F327 V331 H332 T333	H314-L329 HydrophobicContact CB-CB 4.23Å; H314-L329 HydrophobicContact CB-CD2 3.93Å; C316-L329 HydrophobicContact CB-CD1 3.6Å; F323-L329 HydrophobicContact CB-CB 4.23Å; F323-L329 HydrophobicContact CD2-CB 4.08Å; F323-L329 HydrophobicContact CD2-CD1 3.74Å; F323-L329 HydrophobicContact CE2-CD1 4.05Å; F323-L329 HydrophobicContact CG-CB 4.3Å; S325-L329 PolarHBondContact O-N 3.35Å; K326-L329 PolarHBondContact O-N 3.36Å; F327-L329 VanDerWaalsContact C-N 3.35Å; L329-V331 PolarHBondContact O-N 3.48Å; L329-H332 CarbonylContact O-C 3.44Å; L329-H332 WeakPolarHBondContact O-CA 3.48Å; L329-H332 WeakPolarHBondContact O-CB 3.45Å; L329-H332 PolarHBondContact O-N 3.15Å; L329-T333 HydrophobicContact CD1-CG2 3.96Å; L329-T333 HydrophobicContact CG-CG2 4.31Å; L329-T333 WeakPolarHBondContact O-CG2 3.33Å; L329-T333 PolarHBondContact O-N 2.94Å; L329-T333 PolarHBondContact O-OG1 3.36Å
330	L	84.8	Confident	83.9	Confident	86 Å²	86	74.5 Å²	74.5	45%	0.45	38%	0.381	S	S	.	.	H	α-helix	trans	-60	-42.5	178.9	179.6	67.8	0	0	0	112.8	K326 F327 H332 T333 R334	K326-L330 WeakPolarHBondContact O-CB 3.43Å; K326-L330 PolarHBondContact O-N 2.83Å; F327-L330 PolarHBondContact O-N 3.05Å; L330-H332 VanDerWaalsContact C-N 3.27Å; L330-H332 PolarHBondContact O-N 3.22Å; L330-T333 WeakPolarHBondContact CA-OG1 3.4Å; L330-T333 PolarHBondContact O-OG1 3.43Å; L330-R334 WeakPolarHBondContact O-CG 3.46Å; L330-R334 PolarHBondContact O-N 2.88Å
331	V	84.5	Confident	84	Confident	25 Å²	25	75.3 Å²	75.3	15%	0.152	38%	0.376	C	S	.	.	H	α-helix	trans	-66.1	-35	176	170.6	0	0	0	0	111.1	F327 L329 V353	F327-V331 HydrophobicContact CE1-CG2 4.04Å; F327-V331 HydrophobicContact CE2-CG2 4.21Å; F327-V331 HydrophobicContact CZ-CG2 3.88Å; F327-V331 WeakPolarHBondContact O-CG2 3.32Å; F327-V331 PolarHBondContact O-N 3.28Å; L329-V331 PolarHBondContact O-N 3.48Å; V331-V353 HydrophobicContact CB-CG2 4.41Å; V331-V353 HydrophobicContact CG1-CG2 3.4Å; V331-V353 HydrophobicContact CG2-CG2 4.08Å
332	H	86.5	Confident	84	Confident	21 Å²	21	72.4 Å²	72.4	10%	0.097	36%	0.362	C	S	.	.	H	α-helix	trans	-71	-42.3	177	172.3	67.3	0	0	0	112.7	C319 F323 Y328 L329 L330 R334 M335 H336	C319-H332 PolarHBondContact SG-NE2 3.41Å; F323-H332 HydrophobicContact CE1-CB 3.79Å; F323-H332 AromaticContact CE1-CG 3.95Å; F323-H332 HydrophobicContact CE2-CB 3.89Å; F323-H332 AromaticContact CE2-CD2 3.28Å; F323-H332 WeakPolarHBondContact CE2-CD2 3.33Å; F323-H332 AromaticContact CE2-CG 3.59Å; F323-H332 AromaticContact CE2-NE2 3.95Å; F323-H332 HydrophobicContact CZ-CB 3.4Å; F323-H332 VanDerWaalsContact CZ-CB 3.4Å; F323-H332 AromaticContact CZ-CD2 3.29Å; F323-H332 WeakPolarHBondContact CZ-CD2 3.43Å; F323-H332 AromaticContact CZ-CG 3.11Å; F323-H332 AromaticContact CZ-ND1 3.64Å; F323-H332 AromaticContact CZ-NE2 3.84Å; Y328-H332 VanDerWaalsContact O-CB 3.28Å; Y328-H332 WeakPolarHBondContact O-CB 3.48Å; Y328-H332 PolarHBondContact O-N 2.92Å; L329-H332 CarbonylContact O-C 3.44Å; L329-H332 WeakPolarHBondContact O-CA 3.48Å; L329-H332 WeakPolarHBondContact O-CB 3.45Å; L329-H332 PolarHBondContact O-N 3.15Å; L330-H332 VanDerWaalsContact C-N 3.27Å; L330-H332 PolarHBondContact O-N 3.22Å; H332-R334 PolarHBondContact O-N 2.88Å; H332-M335 WeakPolarHBondContact O-CB 3.36Å; H332-M335 WeakPolarHBondContact O-CG 3.38Å; H332-M335 PolarHBondContact O-N 3.22Å; H332-H336 AromaticContact CD2-NE2 3.82Å; H332-H336 AromaticContact CE1-CE1 3.96Å; H332-H336 AromaticContact CE1-NE2 3.53Å; H332-H336 AromaticContact NE2-CD2 3.96Å; H332-H336 AromaticContact NE2-CE1 3.86Å; H332-H336 AromaticContact NE2-NE2 3.05Å; H332-H336 PolarHBondContact NE2-NE2 3.18Å
333	T	84.6	Confident	84	Confident	36 Å²	36	77.2 Å²	77.2	22%	0.221	38%	0.38	C	S	.	.	H	α-helix	trans	-61.4	-30.5	178.9	53.5	0	0	0	0	112	L329 L330 M335 H336 T337	L329-T333 HydrophobicContact CD1-CG2 3.96Å; L329-T333 HydrophobicContact CG-CG2 4.31Å; L329-T333 WeakPolarHBondContact O-CG2 3.33Å; L329-T333 PolarHBondContact O-N 2.94Å; L329-T333 PolarHBondContact O-OG1 3.36Å; L330-T333 WeakPolarHBondContact CA-OG1 3.4Å; L330-T333 PolarHBondContact O-OG1 3.43Å; T333-M335 PolarHBondContact O-N 3.24Å; T333-M335 VanDerWaalsContact O-N 3.11Å; T333-H336 PolarHBondContact O-N 3.24Å; T333-T337 PolarHBondContact O-N 3.34Å; T333-T337 VanDerWaalsContact O-N 3.08Å; T333-T337 PolarHBondContact O-OG1 2.93Å
334	R	86.5	Confident	84	Confident	39 Å²	39	75.3 Å²	75.3	15%	0.147	37%	0.372	C	S	.	.	H	α-helix	trans	-59.3	-19.4	170.6	-69.7	174.6	-174.3	174.6	0.8	114.3	L330 H332 T337 G338 E339 N352	L330-R334 WeakPolarHBondContact O-CG 3.46Å; L330-R334 PolarHBondContact O-N 2.88Å; H332-R334 PolarHBondContact O-N 2.88Å; R334-T337 WeakPolarHBondContact CA-OG1 3.42Å; R334-G338 CarbonylContact O-C 3.26Å; R334-G338 WeakPolarHBondContact O-CA 3.28Å; R334-G338 PolarHBondContact O-N 3.08Å; R334-G338 VanDerWaalsContact O-N 3.12Å; R334-E339 HydrophobicContact CB-CB 4.42Å; R334-E339 WeakPolarHBondContact CB-O 3.42Å; R334-E339 HydrophobicContact CG-CB 4.11Å; R334-E339 PolarHBondContact O-N 2.89Å; R334-N352 HydrophobicContact CB-CB 4.24Å; R334-N352 PolarHBondContact NH1-O 3.15Å
335	M	82.1	Confident	84	Confident	131 Å²	131	76.8 Å²	76.8	65%	0.645	39%	0.393	S	S	*	.	H	α-helix	trans	-75.1	-29.9	173.2	-59	-178.5	60.2	0	0	112.2	H332 T333	H332-M335 WeakPolarHBondContact O-CB 3.36Å; H332-M335 WeakPolarHBondContact O-CG 3.38Å; H332-M335 PolarHBondContact O-N 3.22Å; T333-M335 PolarHBondContact O-N 3.24Å; T333-M335 VanDerWaalsContact O-N 3.11Å
336	H	82.4	Confident	83.8	Confident	84 Å²	84	80 Å²	80	39%	0.389	41%	0.408	S	S	.	.	H	α-helix	trans	-81.8	-43.6	177.2	-58.1	-50.2	0	0	0	110.9	C316 D318 C319 H332 T333 G338	C316-H336 PolarHBondContact SG-NE2 3.12Å; D318-H336 IonicContact OD2-CD2 3.7Å; D318-H336 PolarHBondContact OD2-CD2 3.23Å; D318-H336 IonicContact OD2-CG 3.94Å; C319-H336 PolarHBondContact SG-NE2 3.42Å; C319-H336 VanDerWaalsContact SG-NE2 3.4Å; H332-H336 AromaticContact CD2-NE2 3.82Å; H332-H336 AromaticContact CE1-CE1 3.96Å; H332-H336 AromaticContact CE1-NE2 3.53Å; H332-H336 AromaticContact NE2-CD2 3.96Å; H332-H336 AromaticContact NE2-CE1 3.86Å; H332-H336 AromaticContact NE2-NE2 3.05Å; H332-H336 PolarHBondContact NE2-NE2 3.18Å; T333-H336 PolarHBondContact O-N 3.24Å; H336-G338 VanDerWaalsContact C-N 3.28Å; H336-G338 PolarHBondContact O-N 3.24Å
337	T	81.3	Confident	83.8	Confident	82 Å²	82	75.3 Å²	75.3	50%	0.503	39%	0.394	S	S	.	.	H	α-helix	trans	-78.6	-12.5	-179.8	63.1	0	0	0	0	113.5	T333 R334 E339	T333-T337 PolarHBondContact O-N 3.34Å; T333-T337 VanDerWaalsContact O-N 3.08Å; T333-T337 PolarHBondContact O-OG1 2.93Å; R334-T337 WeakPolarHBondContact CA-OG1 3.42Å; T337-E339 PolarHBondContact O-N 3.24Å; T337-E339 VanDerWaalsContact O-N 3.16Å; T337-E339 WeakPolarHBondContact OG1-CB 3.43Å; T337-E339 WeakPolarHBondContact OG1-CG 3.45Å; T337-E339 PolarHBondContact OG1-N 3.14Å
338	G	80.9	Confident	83.9	Confident	49 Å²	49	71.5 Å²	71.5	51%	0.505	39%	0.389	S	S	.	.			trans	69.5	3.5	-174.4	0	0	0	0	0	114.2	R334 H336 K340	R334-G338 CarbonylContact O-C 3.26Å; R334-G338 WeakPolarHBondContact O-CA 3.28Å; R334-G338 PolarHBondContact O-N 3.08Å; R334-G338 VanDerWaalsContact O-N 3.12Å; H336-G338 VanDerWaalsContact C-N 3.28Å; H336-G338 PolarHBondContact O-N 3.24Å; G338-K340 PolarHBondContact O-N 3.36Å
339	E	80.6	Confident	83.8	Confident	109 Å²	109	71.3 Å²	71.3	51%	0.509	39%	0.39	S	S	.	.			trans	-60.1	118.4	-179.8	-77.9	179.8	-167.5	0	0	111.6	R334 T337 P341	R334-E339 HydrophobicContact CB-CB 4.42Å; R334-E339 WeakPolarHBondContact CB-O 3.42Å; R334-E339 HydrophobicContact CG-CB 4.11Å; R334-E339 PolarHBondContact O-N 2.89Å; T337-E339 PolarHBondContact O-N 3.24Å; T337-E339 VanDerWaalsContact O-N 3.16Å; T337-E339 WeakPolarHBondContact OG1-CB 3.43Å; T337-E339 WeakPolarHBondContact OG1-CG 3.45Å; T337-E339 PolarHBondContact OG1-N 3.14Å; E339-P341 WeakPolarHBondContact O-CD 3.33Å
340	K	84.3	Confident	83.7	Confident	111 Å²	111	72.3 Å²	72.3	48%	0.483	40%	0.398	S	S	.	.			trans	-125.5	80.2	175.3	-67.9	173.8	-179.6	179.4	0	109.9	G338 Y342 T350 F351 N352	G338-K340 PolarHBondContact O-N 3.36Å; K340-Y342 PolarHBondContact O-N 3.02Å; K340-T350 WeakPolarHBondContact CD-OG1 3.31Å; K340-F351 CarbonylContact C-O 3.54Å; K340-F351 VanDerWaalsContact C-O 3.29Å; K340-F351 WeakPolarHBondContact CA-O 3.45Å; K340-N352 HydrophobicContact CG-CB 4.37Å
341	P	84.7	Confident	83.7	Confident	74 Å²	74	69.8 Å²	69.8	48%	0.481	38%	0.384	S	S	.	.			trans	-64.9	-12.6	-170.1	-22.7	34.3	0	0	0	114.9	E339	E339-P341 WeakPolarHBondContact O-CD 3.33Å
342	Y	85.8	Confident	83.6	Confident	68 Å²	68	70.1 Å²	70.1	27%	0.267	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	98.7	-175.5	-51.9	-74.1	0	0	0	109.7	K340 T350 F351 K354 F357	K340-Y342 PolarHBondContact O-N 3.02Å; Y342-T350 CarbonylContact O-C 3.32Å; Y342-T350 WeakPolarHBondContact O-CA 3.41Å; Y342-F351 WeakPolarHBondContact CD2-O 3.31Å; Y342-F351 PolarHBondContact N-O 3.4Å; Y342-F351 PolarHBondContact O-N 3.36Å; Y342-K354 HydrophobicContact CD1-CB 4.27Å; Y342-K354 HydrophobicContact CD1-CG 4.25Å; Y342-K354 HydrophobicContact CD2-CB 4.39Å; Y342-K354 HydrophobicContact CE1-CB 3.79Å; Y342-K354 HydrophobicContact CE1-CD 4.23Å; Y342-K354 HydrophobicContact CE1-CG 3.89Å; Y342-K354 HydrophobicContact CE2-CB 3.91Å; Y342-F357 HydrophobicContact CG-CB 4.26Å
343	Q	87.4	Confident	83.4	Confident	130 Å²	130	70 Å²	70	61%	0.607	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.6	177.5	-176.3	172.6	-6.9	0	0	110.9	T350 F357	Q343-T350 HydrophobicContact CB-CG2 3.93Å; Q343-T350 HydrophobicContact CG-CG2 3.81Å; Q343-F357 VanDerWaalsContact O-CE2 3.28Å; Q343-F357 WeakPolarHBondContact O-CE2 3.28Å
344	C	86.1	Confident	83.2	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.014	40%	0.4	C	S	.	.			trans	-80.8	123.6	170.1	179.4	0	0	0	0	110.4	D346 C347 G348 K349 F357 H364	C344-D346 VanDerWaalsContact C-N 3.29Å; C344-D346 PolarHBondContact O-N 3.25Å; C344-D346 PolarHBondContact SG-N 3.43Å; C344-D346 VanDerWaalsContact SG-N 3.43Å; C344-C347 VanDerWaalsContact SG-SG 3.65Å; C344-G348 WeakPolarHBondContact O-CA 3.49Å; C344-G348 PolarHBondContact O-N 3.07Å; C344-K349 WeakPolarHBondContact CB-O 3.28Å; C344-K349 PolarHBondContact N-O 3.03Å; C344-F357 HydrophobicContact CB-CE2 4.14Å; C344-H364 PolarHBondContact SG-CD2 2.78Å; C344-H364 PolarHBondContact SG-NE2 3.45Å
345	S	84.5	Confident	82.7	Confident	104 Å²	104	76.8 Å²	76.8	73%	0.727	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-39.1	173	45.8	0	0	0	0	112.1
346	D	80.4	Confident	82.7	Confident	93 Å²	93	74.2 Å²	74.2	50%	0.497	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-24.3	-166.1	-45	-28.2	0	0	0	113	C344 H364	C344-D346 VanDerWaalsContact C-N 3.29Å; C344-D346 PolarHBondContact O-N 3.25Å; C344-D346 PolarHBondContact SG-N 3.43Å; C344-D346 VanDerWaalsContact SG-N 3.43Å; D346-H364 HydrophobicContact CB-CB 4.39Å; D346-H364 WeakPolarHBondContact OD2-CB 3.41Å; D346-H364 IonicContact OD2-CD2 3.09Å; D346-H364 PolarHBondContact OD2-CD2 3.01Å; D346-H364 IonicContact OD2-CG 3.13Å
347	C	82.3	Confident	82.8	Confident	54 Å²	54	72 Å²	72	37%	0.365	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.3	8.2	-179	72.5	0	0	0	0	114.7	C344 K349 H360 H364	C344-C347 VanDerWaalsContact SG-SG 3.65Å; C347-K349 PolarHBondContact O-N 2.83Å; C347-H360 VanDerWaalsContact SG-CE1 3.58Å; C347-H360 PolarHBondContact SG-NE2 3.16Å; C347-H364 PolarHBondContact SG-NE2 2.84Å; C347-H364 VanDerWaalsContact SG-NE2 3.36Å
348	G	81.4	Confident	82.6	Confident	41 Å²	41	71.9 Å²	71.9	42%	0.423	39%	0.392	S	S	.	.			trans	68.3	-2.9	178.9	0	0	0	0	0	115.7	C344 T350	C344-G348 WeakPolarHBondContact O-CA 3.49Å; C344-G348 PolarHBondContact O-N 3.07Å; G348-T350 PolarHBondContact O-N 3.28Å
349	K	81.5	Confident	82.5	Confident	125 Å²	125	71.5 Å²	71.5	54%	0.543	38%	0.38	S	S	.	.			trans	-65.7	133.4	-178.3	-72.5	179.8	-176.2	173.2	0	111.5	C344 C347 F351	C344-K349 WeakPolarHBondContact CB-O 3.28Å; C344-K349 PolarHBondContact N-O 3.03Å; C347-K349 PolarHBondContact O-N 2.83Å; K349-F351 HydrophobicContact CB-CE2 3.9Å; K349-F351 HydrophobicContact CB-CZ 4.04Å; K349-F351 WeakPolarHBondContact O-CE2 3.41Å
350	T	85.9	Confident	82.6	Confident	55 Å²	55	67.5 Å²	67.5	34%	0.337	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	142	-177.4	55.3	0	0	0	0	111.7	K340 Y342 Q343 G348	K340-T350 WeakPolarHBondContact CD-OG1 3.31Å; Y342-T350 CarbonylContact O-C 3.32Å; Y342-T350 WeakPolarHBondContact O-CA 3.41Å; Q343-T350 HydrophobicContact CB-CG2 3.93Å; Q343-T350 HydrophobicContact CG-CG2 3.81Å; G348-T350 PolarHBondContact O-N 3.28Å
351	F	84.2	Confident	82.3	Confident	33 Å²	33	65.9 Å²	65.9	15%	0.145	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.1	-176.6	-57.4	-91.3	0	0	0	111	K340 Y342 K349 Q356 F357 H360	K340-F351 CarbonylContact C-O 3.54Å; K340-F351 VanDerWaalsContact C-O 3.29Å; K340-F351 WeakPolarHBondContact CA-O 3.45Å; Y342-F351 WeakPolarHBondContact CD2-O 3.31Å; Y342-F351 PolarHBondContact N-O 3.4Å; Y342-F351 PolarHBondContact O-N 3.36Å; K349-F351 HydrophobicContact CB-CE2 3.9Å; K349-F351 HydrophobicContact CB-CZ 4.04Å; K349-F351 WeakPolarHBondContact O-CE2 3.41Å; F351-Q356 HydrophobicContact CB-CB 4.45Å; F351-Q356 HydrophobicContact CD1-CB 3.85Å; F351-Q356 HydrophobicContact CG-CB 4.44Å; F351-F357 HydrophobicContact CB-CB 4.1Å; F351-F357 HydrophobicContact CD2-CB 4.04Å; F351-F357 AromaticContact CD2-CD2 3.89Å; F351-F357 HydrophobicContact CD2-CD2 3.89Å; F351-F357 HydrophobicContact CD2-CG 4.49Å; F351-F357 HydrophobicContact CE2-CD2 4.36Å; F351-F357 HydrophobicContact CG-CB 4.18Å; F351-H360 HydrophobicContact CE1-CB 3.89Å; F351-H360 HydrophobicContact CE2-CB 3.76Å; F351-H360 AromaticContact CE2-CD2 3.31Å; F351-H360 WeakPolarHBondContact CE2-CD2 3.47Å; F351-H360 AromaticContact CE2-CG 3.53Å; F351-H360 HydrophobicContact CZ-CB 3.33Å; F351-H360 AromaticContact CZ-CD2 3.43Å; F351-H360 VanDerWaalsContact CZ-CD2 3.43Å; F351-H360 WeakPolarHBondContact CZ-CD2 3.45Å; F351-H360 AromaticContact CZ-CG 3.15Å; F351-H360 AromaticContact CZ-ND1 3.72Å
352	N	82.7	Confident	81.9	Confident	31 Å²	31	62.5 Å²	62.5	17%	0.166	33%	0.334	C	S	.	.	S	Bend	trans	-87.7	-14.9	177.8	63	-3.5	0	0	0	113.2	R334 K340 Q356	R334-N352 HydrophobicContact CB-CB 4.24Å; R334-N352 PolarHBondContact NH1-O 3.15Å; K340-N352 HydrophobicContact CG-CB 4.37Å; N352-Q356 PolarHBondContact OD1-OE1 3.07Å
353	V	81.7	Confident	81.4	Confident	20 Å²	20	64 Å²	64	12%	0.121	35%	0.35	C	S	.	.	S	Bend	trans	-128.3	131.3	179.6	-175.4	0	0	0	0	111.1	V331 T355 Q356 F357	V331-V353 HydrophobicContact CB-CG2 4.41Å; V331-V353 HydrophobicContact CG1-CG2 3.4Å; V331-V353 HydrophobicContact CG2-CG2 4.08Å; V353-T355 VanDerWaalsContact C-N 3.29Å; V353-T355 VanDerWaalsContact CG1-OG1 3.28Å; V353-T355 WeakPolarHBondContact CG1-OG1 3.28Å; V353-T355 PolarHBondContact O-N 3.15Å; V353-Q356 HydrophobicContact CB-CG 4.19Å; V353-Q356 WeakPolarHBondContact O-CB 3.29Å; V353-Q356 PolarHBondContact O-N 2.75Å; V353-Q356 VanDerWaalsContact O-N 3.08Å; V353-F357 PolarHBondContact O-N 3.46Å
354	K	80	Confident	80.8	Confident	122 Å²	122	61.4 Å²	61.4	53%	0.53	34%	0.338	S	S	.	.	H	α-helix	trans	-55.8	-38.6	-178.8	-167.8	176	179.7	177.2	0	113.6	Y342 Q356 F357 I358	Y342-K354 HydrophobicContact CD1-CB 4.27Å; Y342-K354 HydrophobicContact CD1-CG 4.25Å; Y342-K354 HydrophobicContact CD2-CB 4.39Å; Y342-K354 HydrophobicContact CE1-CB 3.79Å; Y342-K354 HydrophobicContact CE1-CD 4.23Å; Y342-K354 HydrophobicContact CE1-CG 3.89Å; Y342-K354 HydrophobicContact CE2-CB 3.91Å; K354-Q356 VanDerWaalsContact C-N 3.31Å; K354-Q356 PolarHBondContact O-N 3.05Å; K354-F357 WeakPolarHBondContact O-CB 3.29Å; K354-F357 PolarHBondContact O-N 2.97Å; K354-I358 HydrophobicContact CG-CD1 4.06Å; K354-I358 HydrophobicContact CG-CG1 4.44Å; K354-I358 WeakPolarHBondContact O-CG1 3.29Å; K354-I358 PolarHBondContact O-N 2.79Å
355	T	77.6	Confident	80.2	Confident	95 Å²	95	64.9 Å²	64.9	58%	0.583	36%	0.359	S	S	*	.	H	α-helix	trans	-64.5	-36.3	179.8	54.2	0	0	0	0	112.2	V353 V359	V353-T355 VanDerWaalsContact C-N 3.29Å; V353-T355 VanDerWaalsContact CG1-OG1 3.28Å; V353-T355 WeakPolarHBondContact CG1-OG1 3.28Å; V353-T355 PolarHBondContact O-N 3.15Å; T355-V359 VanDerWaalsContact O-CG2 3.31Å; T355-V359 WeakPolarHBondContact O-CG2 3.4Å; T355-V359 PolarHBondContact O-N 3.4Å; T355-V359 VanDerWaalsContact O-N 3.13Å
356	Q	81.4	Confident	79.5	Confident	77 Å²	77	62.6 Å²	62.6	36%	0.36	35%	0.351	S	S	.	.	H	α-helix	trans	-68.8	-39.6	175.6	-61.9	177.1	-1.5	0	0	111.1	F351 N352 V353 K354 V359 H360	F351-Q356 HydrophobicContact CB-CB 4.45Å; F351-Q356 HydrophobicContact CD1-CB 3.85Å; F351-Q356 HydrophobicContact CG-CB 4.44Å; N352-Q356 PolarHBondContact OD1-OE1 3.07Å; V353-Q356 HydrophobicContact CB-CG 4.19Å; V353-Q356 WeakPolarHBondContact O-CB 3.29Å; V353-Q356 PolarHBondContact O-N 2.75Å; V353-Q356 VanDerWaalsContact O-N 3.08Å; K354-Q356 VanDerWaalsContact C-N 3.31Å; K354-Q356 PolarHBondContact O-N 3.05Å; Q356-V359 PolarHBondContact O-N 2.76Å; Q356-H360 WeakPolarHBondContact O-CB 3.48Å; Q356-H360 PolarHBondContact O-N 3.38Å
357	F	83.6	Confident	79	Confident	38 Å²	38	66.5 Å²	66.5	17%	0.167	36%	0.364	C	S	.	.	H	α-helix	trans	-61	-47.9	174.2	171.4	-107.2	0	0	0	112.6	Y342 Q343 C344 F351 V353 K354 V359 H360 Q361	Y342-F357 HydrophobicContact CG-CB 4.26Å; Q343-F357 VanDerWaalsContact O-CE2 3.28Å; Q343-F357 WeakPolarHBondContact O-CE2 3.28Å; C344-F357 HydrophobicContact CB-CE2 4.14Å; F351-F357 HydrophobicContact CB-CB 4.1Å; F351-F357 HydrophobicContact CD2-CB 4.04Å; F351-F357 AromaticContact CD2-CD2 3.89Å; F351-F357 HydrophobicContact CD2-CD2 3.89Å; F351-F357 HydrophobicContact CD2-CG 4.49Å; F351-F357 HydrophobicContact CE2-CD2 4.36Å; F351-F357 HydrophobicContact CG-CB 4.18Å; V353-F357 PolarHBondContact O-N 3.46Å; K354-F357 WeakPolarHBondContact O-CB 3.29Å; K354-F357 PolarHBondContact O-N 2.97Å; F357-V359 VanDerWaalsContact C-N 3.34Å; F357-V359 PolarHBondContact O-N 3.35Å; F357-H360 WeakPolarHBondContact O-CB 3.42Å; F357-H360 PolarHBondContact O-N 3.19Å; F357-H360 VanDerWaalsContact O-N 3.12Å; F357-Q361 WeakPolarHBondContact O-CB 3.18Å; F357-Q361 PolarHBondContact O-N 3.27Å
358	I	78.5	Confident	78.5	Confident	78 Å²	78	65.3 Å²	65.3	40%	0.4	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-44.9	178	-68	166.8	0	0	0	111	K354 H360 Q361 G362	K354-I358 HydrophobicContact CG-CD1 4.06Å; K354-I358 HydrophobicContact CG-CG1 4.44Å; K354-I358 WeakPolarHBondContact O-CG1 3.29Å; K354-I358 PolarHBondContact O-N 2.79Å; I358-H360 VanDerWaalsContact C-N 3.29Å; I358-H360 PolarHBondContact O-N 3.35Å; I358-Q361 PolarHBondContact O-N 2.99Å; I358-G362 PolarHBondContact O-N 3.47Å; I358-G362 VanDerWaalsContact O-N 3.14Å
359	V	78.8	Confident	78.2	Confident	41 Å²	41	66.9 Å²	66.9	25%	0.248	36%	0.356	C	S	.	.	H	α-helix	trans	-61.7	-39.8	176.1	166.1	0	0	0	0	111.6	T355 Q356 F357 G362 N368 G380	T355-V359 VanDerWaalsContact O-CG2 3.31Å; T355-V359 WeakPolarHBondContact O-CG2 3.4Å; T355-V359 PolarHBondContact O-N 3.4Å; T355-V359 VanDerWaalsContact O-N 3.13Å; Q356-V359 PolarHBondContact O-N 2.76Å; F357-V359 VanDerWaalsContact C-N 3.34Å; F357-V359 PolarHBondContact O-N 3.35Å; V359-G362 PolarHBondContact O-N 3.24Å; V359-N368 PolarHBondContact O-OD1 3.49Å; V359-G380 WeakPolarHBondContact CG2-O 3.29Å
360	H	81.3	Confident	78.2	Confident	25 Å²	25	65.2 Å²	65.2	12%	0.116	35%	0.348	C	S	.	.	H	α-helix	trans	-67.8	-40.8	177	173.8	66.5	0	0	0	112.4	C347 F351 Q356 F357 I358 G362 V363 H364	C347-H360 VanDerWaalsContact SG-CE1 3.58Å; C347-H360 PolarHBondContact SG-NE2 3.16Å; F351-H360 HydrophobicContact CE1-CB 3.89Å; F351-H360 HydrophobicContact CE2-CB 3.76Å; F351-H360 AromaticContact CE2-CD2 3.31Å; F351-H360 WeakPolarHBondContact CE2-CD2 3.47Å; F351-H360 AromaticContact CE2-CG 3.53Å; F351-H360 HydrophobicContact CZ-CB 3.33Å; F351-H360 AromaticContact CZ-CD2 3.43Å; F351-H360 VanDerWaalsContact CZ-CD2 3.43Å; F351-H360 WeakPolarHBondContact CZ-CD2 3.45Å; F351-H360 AromaticContact CZ-CG 3.15Å; F351-H360 AromaticContact CZ-ND1 3.72Å; Q356-H360 WeakPolarHBondContact O-CB 3.48Å; Q356-H360 PolarHBondContact O-N 3.38Å; F357-H360 WeakPolarHBondContact O-CB 3.42Å; F357-H360 PolarHBondContact O-N 3.19Å; F357-H360 VanDerWaalsContact O-N 3.12Å; I358-H360 VanDerWaalsContact C-N 3.29Å; I358-H360 PolarHBondContact O-N 3.35Å; H360-G362 PolarHBondContact O-N 2.87Å; H360-V363 WeakPolarHBondContact O-CB 3.48Å; H360-V363 WeakPolarHBondContact O-CG2 3.09Å; H360-V363 PolarHBondContact O-N 2.81Å; H360-H364 AromaticContact CE1-NE2 3.65Å; H360-H364 AromaticContact NE2-CD2 3.99Å; H360-H364 AromaticContact NE2-NE2 3.28Å; H360-H364 PolarHBondContact NE2-NE2 2.99Å
361	Q	77.8	Confident	77.9	Confident	77 Å²	77	67.8 Å²	67.8	36%	0.36	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-28.9	176.2	-167.9	178.9	6	0	0	112	F357 I358 V363 H364 T365	F357-Q361 WeakPolarHBondContact O-CB 3.18Å; F357-Q361 PolarHBondContact O-N 3.27Å; I358-Q361 PolarHBondContact O-N 2.99Å; Q361-V363 PolarHBondContact O-N 3.21Å; Q361-H364 PolarHBondContact O-N 3.07Å; Q361-T365 HydrophobicContact CG-CG2 4.45Å; Q361-T365 PolarHBondContact O-N 3.49Å; Q361-T365 VanDerWaalsContact O-N 3.15Å; Q361-T365 PolarHBondContact O-OG1 2.92Å
362	G	76.7	Confident	77.8	Confident	3 Å²	3	66.2 Å²	66.2	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-21.2	170.7	0	0	0	0	0	114.3	I358 V359 H360 G366 K367 N368	I358-G362 PolarHBondContact O-N 3.47Å; I358-G362 VanDerWaalsContact O-N 3.14Å; V359-G362 PolarHBondContact O-N 3.24Å; H360-G362 PolarHBondContact O-N 2.87Å; G362-G366 CarbonylContact O-C 3.58Å; G362-G366 WeakPolarHBondContact O-CA 3.36Å; G362-G366 PolarHBondContact O-N 3Å; G362-G366 VanDerWaalsContact O-N 3.1Å; G362-K367 WeakPolarHBondContact CA-O 3.45Å; G362-K367 PolarHBondContact O-N 3.14Å; G362-N368 WeakPolarHBondContact CA-OD1 3.42Å
363	V	76.1	Confident	77.7	Confident	99 Å²	99	70 Å²	70	60%	0.6	38%	0.382	S	S	*	.	H	α-helix	trans	-70.8	-38.5	175.4	-178.5	0	0	0	0	111.5	H360 Q361	H360-V363 WeakPolarHBondContact O-CB 3.48Å; H360-V363 WeakPolarHBondContact O-CG2 3.09Å; H360-V363 PolarHBondContact O-N 2.81Å; Q361-V363 PolarHBondContact O-N 3.21Å
364	H	75.1	Confident	77.6	Confident	77 Å²	77	75.2 Å²	75.2	36%	0.356	40%	0.404	S	S	.	.	H	α-helix	trans	-81.2	-41.1	-179	-59.5	-55.3	0	0	0	111.9	C344 D346 C347 H360 Q361 G366	C344-H364 PolarHBondContact SG-CD2 2.78Å; C344-H364 PolarHBondContact SG-NE2 3.45Å; D346-H364 HydrophobicContact CB-CB 4.39Å; D346-H364 WeakPolarHBondContact OD2-CB 3.41Å; D346-H364 IonicContact OD2-CD2 3.09Å; D346-H364 PolarHBondContact OD2-CD2 3.01Å; D346-H364 IonicContact OD2-CG 3.13Å; C347-H364 PolarHBondContact SG-NE2 2.84Å; C347-H364 VanDerWaalsContact SG-NE2 3.36Å; H360-H364 AromaticContact CE1-NE2 3.65Å; H360-H364 AromaticContact NE2-CD2 3.99Å; H360-H364 AromaticContact NE2-NE2 3.28Å; H360-H364 PolarHBondContact NE2-NE2 2.99Å; Q361-H364 PolarHBondContact O-N 3.07Å; H364-G366 VanDerWaalsContact C-N 3.32Å; H364-G366 PolarHBondContact O-N 3.13Å
365	T	73	Confident	77.5	Confident	75 Å²	75	71.9 Å²	71.9	46%	0.46	40%	0.396	S	S	.	.	H	α-helix	trans	-82.9	-9.8	-176.9	56.5	0	0	0	0	113.5	Q361 K367	Q361-T365 HydrophobicContact CG-CG2 4.45Å; Q361-T365 PolarHBondContact O-N 3.49Å; Q361-T365 VanDerWaalsContact O-N 3.15Å; Q361-T365 PolarHBondContact O-OG1 2.92Å; T365-K367 PolarHBondContact O-N 3.4Å; T365-K367 PolarHBondContact OG1-N 3.23Å
366	G	69.3	Low	77.3	Confident	55 Å²	55	70.4 Å²	70.4	57%	0.567	40%	0.399	S	S	*	.	S	Bend	trans	65	-4	-168.7	0	0	0	0	0	114.1	G362 H364 N368	G362-G366 CarbonylContact O-C 3.58Å; G362-G366 WeakPolarHBondContact O-CA 3.36Å; G362-G366 PolarHBondContact O-N 3Å; G362-G366 VanDerWaalsContact O-N 3.1Å; H364-G366 VanDerWaalsContact C-N 3.32Å; H364-G366 PolarHBondContact O-N 3.13Å; G366-N368 PolarHBondContact O-N 2.97Å
367	K	69.4	Low	77	Confident	175 Å²	175	72.7 Å²	72.7	76%	0.761	41%	0.408	S	S	*	.			trans	-93.9	75.6	-178.1	-67.8	-177.6	-179.9	-179.9	0	109.7	G362 T365	G362-K367 WeakPolarHBondContact CA-O 3.45Å; G362-K367 PolarHBondContact O-N 3.14Å; T365-K367 PolarHBondContact O-N 3.4Å; T365-K367 PolarHBondContact OG1-N 3.23Å
368	N	73	Confident	76.7	Confident	30 Å²	30	72.6 Å²	72.6	16%	0.16	41%	0.414	C	S	.	.			trans	-81.3	144.3	168	-100.5	-23.2	0	0	0	109.7	V359 G362 G366 Y370 A378 F379	V359-N368 PolarHBondContact O-OD1 3.49Å; G362-N368 WeakPolarHBondContact CA-OD1 3.42Å; G366-N368 PolarHBondContact O-N 2.97Å; N368-Y370 PolarHBondContact O-N 3.26Å; N368-A378 HydrophobicContact CB-CB 3.5Å; N368-A378 PolarHBondContact ND2-O 3.44Å; N368-F379 WeakPolarHBondContact CB-O 3.49Å
369	P	75.3	Confident	76.7	Confident	73 Å²	73	70.8 Å²	70.8	47%	0.474	40%	0.403	S	S	.	.	S	Bend	trans	-67.5	-8.9	-170.7	-18.9	31	0	0	0	115.5
370	Y	80.6	Confident	76.5	Confident	91 Å²	91	69.1 Å²	69.1	36%	0.357	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	94.2	-174	-55.8	-78.4	0	0	0	110.3	N368 F379 R381 K382	N368-Y370 PolarHBondContact O-N 3.26Å; Y370-F379 WeakPolarHBondContact CB-O 3.18Å; Y370-F379 PolarHBondContact N-O 3.08Å; Y370-F379 PolarHBondContact O-N 3.13Å; Y370-R381 VanDerWaalsContact CD2-C 3.41Å; Y370-K382 HydrophobicContact CD1-CB 3.94Å; Y370-K382 HydrophobicContact CD1-CG 4.32Å; Y370-K382 HydrophobicContact CE1-CB 3.63Å; Y370-K382 HydrophobicContact CE1-CG 4.17Å; Y370-K382 HydrophobicContact CE2-CB 4.4Å; Y370-K382 HydrophobicContact CG-CB 4.44Å
371	D	79	Confident	76.3	Confident	108 Å²	108	74.3 Å²	74.3	58%	0.578	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	149.2	177	60.6	-70.7	0	0	0	112.9	A378 L385	D371-A378 HydrophobicContact CB-CB 4.45Å; D371-L385 WeakPolarHBondContact O-CD2 3.47Å
372	C	82.5	Confident	76.3	Confident	1 Å²	1	77.2 Å²	77.2	1%	0.007	42%	0.424	C	S	.	.			trans	-93.7	114.1	171.6	-179	0	0	0	0	109.4	Q374 C375 G376 K377 F379 L385 H388	C372-Q374 PolarHBondContact O-N 2.82Å; C372-C375 PolarHBondContact O-N 3.41Å; C372-G376 VanDerWaalsContact O-CA 3.29Å; C372-G376 WeakPolarHBondContact O-CA 3.49Å; C372-G376 PolarHBondContact O-N 3.32Å; C372-K377 WeakPolarHBondContact CB-O 3.49Å; C372-K377 PolarHBondContact N-O 2.89Å; C372-F379 HydrophobicContact CB-CE2 4.31Å; C372-L385 HydrophobicContact CB-CD1 3.73Å; C372-H388 PolarHBondContact SG-NE2 3.37Å
373	S	80.6	Confident	76.5	Confident	111 Å²	111	84.4 Å²	84.4	78%	0.776	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-23	177.9	55.2	0	0	0	0	113.9
374	Q	79.3	Confident	76.7	Confident	128 Å²	128	84 Å²	84	60%	0.598	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-25.7	-177	-61.9	-171.4	14	0	0	114.4	C372 H392	C372-Q374 PolarHBondContact O-N 2.82Å; Q374-H392 PolarHBondContact OE1-ND1 3.4Å
375	C	79.3	Confident	77.1	Confident	53 Å²	53	81.5 Å²	81.5	36%	0.358	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.4	6.8	-178.4	70.2	0	0	0	0	115	C372 K377 H388 H392	C372-C375 PolarHBondContact O-N 3.41Å; C375-K377 PolarHBondContact O-N 3.33Å; C375-K377 VanDerWaalsContact O-N 3.09Å; C375-H388 VanDerWaalsContact SG-CE1 3.57Å; C375-H388 PolarHBondContact SG-NE2 3.45Å; C375-H392 PolarHBondContact SG-NE2 3.1Å
376	G	73.4	Confident	77.6	Confident	63 Å²	63	80.7 Å²	80.7	65%	0.649	43%	0.433	S	S	*	.			trans	68.9	2.5	178.7	0	0	0	0	0	115.1	C372 A378	C372-G376 VanDerWaalsContact O-CA 3.29Å; C372-G376 WeakPolarHBondContact O-CA 3.49Å; C372-G376 PolarHBondContact O-N 3.32Å; G376-A378 PolarHBondContact O-N 2.94Å
377	K	74.8	Confident	78.1	Confident	126 Å²	126	80.1 Å²	80.1	55%	0.548	42%	0.423	S	S	.	.			trans	-71.8	130.3	178.9	-72.5	-179.8	-176.6	170.9	0	110.8	C372 C375 F379	C372-K377 WeakPolarHBondContact CB-O 3.49Å; C372-K377 PolarHBondContact N-O 2.89Å; C375-K377 PolarHBondContact O-N 3.33Å; C375-K377 VanDerWaalsContact O-N 3.09Å; K377-F379 HydrophobicContact CB-CE2 3.86Å; K377-F379 HydrophobicContact CB-CZ 4.04Å; K377-F379 WeakPolarHBondContact O-CE2 3.22Å
378	A	77.6	Confident	78.7	Confident	35 Å²	35	73.2 Å²	73.2	29%	0.289	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.9	-178.3	0	0	0	0	0	112.4	N368 D371 G376	N368-A378 HydrophobicContact CB-CB 3.5Å; N368-A378 PolarHBondContact ND2-O 3.44Å; D371-A378 HydrophobicContact CB-CB 4.45Å; G376-A378 PolarHBondContact O-N 2.94Å
379	F	77.4	Confident	79.1	Confident	40 Å²	40	74.8 Å²	74.8	18%	0.175	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	146	-172.6	-61	-90.3	0	0	0	111.9	N368 Y370 C372 K377 R381 Q384 L385 H388	N368-F379 WeakPolarHBondContact CB-O 3.49Å; Y370-F379 WeakPolarHBondContact CB-O 3.18Å; Y370-F379 PolarHBondContact N-O 3.08Å; Y370-F379 PolarHBondContact O-N 3.13Å; C372-F379 HydrophobicContact CB-CE2 4.31Å; K377-F379 HydrophobicContact CB-CE2 3.86Å; K377-F379 HydrophobicContact CB-CZ 4.04Å; K377-F379 WeakPolarHBondContact O-CE2 3.22Å; F379-R381 VanDerWaalsContact C-N 3.29Å; F379-R381 PolarHBondContact O-N 3.11Å; F379-Q384 HydrophobicContact CB-CB 4.1Å; F379-Q384 HydrophobicContact CD1-CB 3.83Å; F379-Q384 HydrophobicContact CG-CB 4.24Å; F379-L385 HydrophobicContact CB-CB 4.29Å; F379-L385 HydrophobicContact CD2-CB 3.99Å; F379-L385 HydrophobicContact CD2-CD1 3.78Å; F379-L385 HydrophobicContact CE2-CD1 4.01Å; F379-L385 HydrophobicContact CG-CB 4.3Å; F379-H388 HydrophobicContact CE1-CB 3.91Å; F379-H388 HydrophobicContact CE2-CB 3.89Å; F379-H388 AromaticContact CE2-CD2 3.28Å; F379-H388 WeakPolarHBondContact CE2-CD2 3.4Å; F379-H388 AromaticContact CE2-CG 3.59Å; F379-H388 AromaticContact CE2-NE2 3.92Å; F379-H388 HydrophobicContact CZ-CB 3.42Å; F379-H388 VanDerWaalsContact CZ-CB 3.42Å; F379-H388 AromaticContact CZ-CD2 3.39Å; F379-H388 WeakPolarHBondContact CZ-CD2 3.48Å; F379-H388 AromaticContact CZ-CG 3.19Å; F379-H388 AromaticContact CZ-ND1 3.71Å; F379-H388 AromaticContact CZ-NE2 3.95Å
380	G	74.8	Confident	79.5	Confident	6 Å²	6	74.6 Å²	74.6	6%	0.062	39%	0.391	C	S	.	.	S	Bend	trans	-72.5	-19.9	178	0	0	0	0	0	114.4	V359	V359-G380 WeakPolarHBondContact CG2-O 3.29Å
381	R	77.3	Confident	79.5	Confident	135 Å²	135	73.7 Å²	73.7	51%	0.509	40%	0.402	S	S	.	.	S	Bend	trans	-138.7	142.8	-175.6	-58.7	-176.4	-174.1	-179.5	3.5	111.3	Y370 F379 E383 Q384 L385	Y370-R381 VanDerWaalsContact CD2-C 3.41Å; F379-R381 VanDerWaalsContact C-N 3.29Å; F379-R381 PolarHBondContact O-N 3.11Å; R381-E383 VanDerWaalsContact C-N 3.29Å; R381-E383 PolarHBondContact O-N 3.44Å; R381-Q384 HydrophobicContact CB-CG 4.17Å; R381-Q384 WeakPolarHBondContact O-CB 3.37Å; R381-Q384 PolarHBondContact O-N 3.13Å; R381-L385 PolarHBondContact O-N 3.47Å
382	K	78.5	Confident	79.4	Confident	137 Å²	137	72 Å²	72	60%	0.596	39%	0.391	S	S	*	.	H	α-helix	trans	-54.4	-43.4	176.6	-170.4	175.5	179.2	176.8	0	112.7	Y370 Q384 L385 T386	Y370-K382 HydrophobicContact CD1-CB 3.94Å; Y370-K382 HydrophobicContact CD1-CG 4.32Å; Y370-K382 HydrophobicContact CE1-CB 3.63Å; Y370-K382 HydrophobicContact CE1-CG 4.17Å; Y370-K382 HydrophobicContact CE2-CB 4.4Å; Y370-K382 HydrophobicContact CG-CB 4.44Å; K382-Q384 PolarHBondContact O-N 3.02Å; K382-L385 WeakPolarHBondContact O-CB 2.95Å; K382-L385 PolarHBondContact O-N 3.43Å; K382-L385 VanDerWaalsContact O-N 3.15Å; K382-T386 PolarHBondContact O-N 2.98Å; K382-T386 PolarHBondContact O-OG1 3.39Å; K382-T386 VanDerWaalsContact O-OG1 3.1Å
383	E	80.4	Confident	79.4	Confident	155 Å²	155	75.1 Å²	75.1	72%	0.724	42%	0.417	S	S	*	.	H	α-helix	trans	-59.1	-35.5	178.9	-65.1	171	-178.4	0	0	112.8	R381 A387	R381-E383 VanDerWaalsContact C-N 3.29Å; R381-E383 PolarHBondContact O-N 3.44Å; E383-A387 WeakPolarHBondContact O-CB 3.48Å; E383-A387 PolarHBondContact O-N 3.23Å
384	Q	80.8	Confident	79.3	Confident	91 Å²	91	72.3 Å²	72.3	43%	0.425	41%	0.405	S	S	.	.	H	α-helix	trans	-71.7	-41.5	178.1	-65.5	173.7	-22.3	0	0	110.7	F379 R381 K382 A387 H388	F379-Q384 HydrophobicContact CB-CB 4.1Å; F379-Q384 HydrophobicContact CD1-CB 3.83Å; F379-Q384 HydrophobicContact CG-CB 4.24Å; R381-Q384 HydrophobicContact CB-CG 4.17Å; R381-Q384 WeakPolarHBondContact O-CB 3.37Å; R381-Q384 PolarHBondContact O-N 3.13Å; K382-Q384 PolarHBondContact O-N 3.02Å; Q384-A387 PolarHBondContact O-N 3.4Å; Q384-H388 VanDerWaalsContact O-CB 3.25Å; Q384-H388 WeakPolarHBondContact O-CB 3.41Å; Q384-H388 PolarHBondContact O-N 3.5Å
385	L	83.6	Confident	79.3	Confident	23 Å²	23	71.4 Å²	71.4	12%	0.12	40%	0.401	C	S	.	.	H	α-helix	trans	-60.8	-48.2	172	175.2	63.2	0	0	0	110.8	D371 C372 F379 R381 K382 A387 H388 L389	D371-L385 WeakPolarHBondContact O-CD2 3.47Å; C372-L385 HydrophobicContact CB-CD1 3.73Å; F379-L385 HydrophobicContact CB-CB 4.29Å; F379-L385 HydrophobicContact CD2-CB 3.99Å; F379-L385 HydrophobicContact CD2-CD1 3.78Å; F379-L385 HydrophobicContact CE2-CD1 4.01Å; F379-L385 HydrophobicContact CG-CB 4.3Å; R381-L385 PolarHBondContact O-N 3.47Å; K382-L385 WeakPolarHBondContact O-CB 2.95Å; K382-L385 PolarHBondContact O-N 3.43Å; K382-L385 VanDerWaalsContact O-N 3.15Å; L385-A387 PolarHBondContact O-N 2.77Å; L385-H388 CarbonylContact O-C 3.55Å; L385-H388 WeakPolarHBondContact O-CA 3.2Å; L385-H388 WeakPolarHBondContact O-CB 3.25Å; L385-H388 PolarHBondContact O-N 3.4Å; L385-H388 VanDerWaalsContact O-N 3.08Å; L385-L389 HydrophobicContact CD1-CD1 4.37Å; L385-L389 HydrophobicContact CD1-CD2 4.46Å; L385-L389 HydrophobicContact CD1-CG 4.14Å; L385-L389 HydrophobicContact CG-CD1 4.16Å; L385-L389 HydrophobicContact CG-CG 4.37Å; L385-L389 WeakPolarHBondContact O-CG 3.38Å; L385-L389 PolarHBondContact O-N 3.16Å
386	T	82.3	Confident	79.5	Confident	58 Å²	58	74.9 Å²	74.9	36%	0.356	41%	0.41	S	S	.	.	H	α-helix	trans	-59.7	-44.4	177.9	-55.9	0	0	0	0	111.9	K382 H388 L389 R390	K382-T386 PolarHBondContact O-N 2.98Å; K382-T386 PolarHBondContact O-OG1 3.39Å; K382-T386 VanDerWaalsContact O-OG1 3.1Å; T386-H388 VanDerWaalsContact C-N 3.28Å; T386-H388 PolarHBondContact O-N 3.49Å; T386-L389 PolarHBondContact O-N 3.08Å; T386-R390 PolarHBondContact O-N 3.12Å
387	A	79.9	Confident	80	Confident	43 Å²	43	75.2 Å²	75.2	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-33.8	175.6	0	0	0	0	0	112.4	E383 Q384 L385	E383-A387 WeakPolarHBondContact O-CB 3.48Å; E383-A387 PolarHBondContact O-N 3.23Å; Q384-A387 PolarHBondContact O-N 3.4Å; L385-A387 PolarHBondContact O-N 2.77Å
388	H	82.8	Confident	80.5	Confident	31 Å²	31	72.8 Å²	72.8	14%	0.144	39%	0.389	C	S	.	.	H	α-helix	trans	-70.3	-40.6	175	167.8	66.1	0	0	0	112.6	C372 C375 F379 Q384 L385 T386 R390 A391 H392	C372-H388 PolarHBondContact SG-NE2 3.37Å; C375-H388 VanDerWaalsContact SG-CE1 3.57Å; C375-H388 PolarHBondContact SG-NE2 3.45Å; F379-H388 HydrophobicContact CE1-CB 3.91Å; F379-H388 HydrophobicContact CE2-CB 3.89Å; F379-H388 AromaticContact CE2-CD2 3.28Å; F379-H388 WeakPolarHBondContact CE2-CD2 3.4Å; F379-H388 AromaticContact CE2-CG 3.59Å; F379-H388 AromaticContact CE2-NE2 3.92Å; F379-H388 HydrophobicContact CZ-CB 3.42Å; F379-H388 VanDerWaalsContact CZ-CB 3.42Å; F379-H388 AromaticContact CZ-CD2 3.39Å; F379-H388 WeakPolarHBondContact CZ-CD2 3.48Å; F379-H388 AromaticContact CZ-CG 3.19Å; F379-H388 AromaticContact CZ-ND1 3.71Å; F379-H388 AromaticContact CZ-NE2 3.95Å; Q384-H388 VanDerWaalsContact O-CB 3.25Å; Q384-H388 WeakPolarHBondContact O-CB 3.41Å; Q384-H388 PolarHBondContact O-N 3.5Å; L385-H388 CarbonylContact O-C 3.55Å; L385-H388 WeakPolarHBondContact O-CA 3.2Å; L385-H388 WeakPolarHBondContact O-CB 3.25Å; L385-H388 PolarHBondContact O-N 3.4Å; L385-H388 VanDerWaalsContact O-N 3.08Å; T386-H388 VanDerWaalsContact C-N 3.28Å; T386-H388 PolarHBondContact O-N 3.49Å; H388-R390 PolarHBondContact O-N 3.3Å; H388-A391 WeakPolarHBondContact O-CA 3.49Å; H388-A391 WeakPolarHBondContact O-CB 3.44Å; H388-A391 PolarHBondContact O-N 3.04Å; H388-H392 AromaticContact CE1-CD2 3.78Å; H388-H392 AromaticContact CE1-NE2 3.32Å; H388-H392 PolarHBondContact CE1-NE2 2.91Å; H388-H392 VanDerWaalsContact CE1-NE2 3.32Å; H388-H392 AromaticContact NE2-CD2 3.58Å; H388-H392 AromaticContact NE2-NE2 3.15Å; H388-H392 PolarHBondContact NE2-NE2 3.39Å; H388-H392 VanDerWaalsContact NE2-NE2 3.15Å
389	L	82.1	Confident	81	Confident	63 Å²	63	73.2 Å²	73.2	33%	0.33	40%	0.396	S	S	.	.	H	α-helix	trans	-60.2	-32.2	176.1	-70.7	173.1	0	0	0	112.1	L385 T386 A391 H392 A393	L385-L389 HydrophobicContact CD1-CD1 4.37Å; L385-L389 HydrophobicContact CD1-CD2 4.46Å; L385-L389 HydrophobicContact CD1-CG 4.14Å; L385-L389 HydrophobicContact CG-CD1 4.16Å; L385-L389 HydrophobicContact CG-CG 4.37Å; L385-L389 WeakPolarHBondContact O-CG 3.38Å; L385-L389 PolarHBondContact O-N 3.16Å; T386-L389 PolarHBondContact O-N 3.08Å; L389-A391 PolarHBondContact O-N 2.84Å; L389-H392 WeakPolarHBondContact O-CB 3.5Å; L389-H392 PolarHBondContact O-N 3.11Å; L389-A393 PolarHBondContact O-N 2.84Å
390	R	82.9	Confident	81.6	Confident	69 Å²	69	71.5 Å²	71.5	26%	0.26	39%	0.389	S	S	.	.	H	α-helix	trans	-60.4	-31	171.3	-65.4	176.2	-170.5	157.3	1.9	113.1	T386 H388 H392 A393 G394 E395	T386-R390 PolarHBondContact O-N 3.12Å; H388-R390 PolarHBondContact O-N 3.3Å; R390-H392 VanDerWaalsContact C-N 3.3Å; R390-A393 PolarHBondContact O-N 3.24Å; R390-G394 CarbonylContact O-C 3.34Å; R390-G394 PolarHBondContact O-N 3.38Å; R390-E395 HydrophobicContact CB-CB 4.12Å; R390-E395 HydrophobicContact CG-CB 4.33Å; R390-E395 PolarHBondContact O-N 3.18Å
391	A	79.5	Confident	82.1	Confident	71 Å²	71	76.7 Å²	76.7	59%	0.587	42%	0.424	S	S	*	.	H	α-helix	trans	-69.3	-31.5	176.3	0	0	0	0	0	112	H388 L389	H388-A391 WeakPolarHBondContact O-CA 3.49Å; H388-A391 WeakPolarHBondContact O-CB 3.44Å; H388-A391 PolarHBondContact O-N 3.04Å; L389-A391 PolarHBondContact O-N 2.84Å
392	H	78.9	Confident	82.5	Confident	73 Å²	73	74.9 Å²	74.9	34%	0.338	42%	0.422	S	S	.	.	H	α-helix	trans	-71.4	-44.5	172.8	-76.2	-71.8	0	0	0	112.1	Q374 C375 H388 L389 R390 G394	Q374-H392 PolarHBondContact OE1-ND1 3.4Å; C375-H392 PolarHBondContact SG-NE2 3.1Å; H388-H392 AromaticContact CE1-CD2 3.78Å; H388-H392 AromaticContact CE1-NE2 3.32Å; H388-H392 PolarHBondContact CE1-NE2 2.91Å; H388-H392 VanDerWaalsContact CE1-NE2 3.32Å; H388-H392 AromaticContact NE2-CD2 3.58Å; H388-H392 AromaticContact NE2-NE2 3.15Å; H388-H392 PolarHBondContact NE2-NE2 3.39Å; H388-H392 VanDerWaalsContact NE2-NE2 3.15Å; L389-H392 WeakPolarHBondContact O-CB 3.5Å; L389-H392 PolarHBondContact O-N 3.11Å; R390-H392 VanDerWaalsContact C-N 3.3Å; H392-G394 PolarHBondContact O-N 3.49Å
393	A	80.6	Confident	82.9	Confident	66 Å²	66	70.8 Å²	70.8	55%	0.545	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.1	177.7	0	0	0	0	0	113.5	L389 R390 E395	L389-A393 PolarHBondContact O-N 2.84Å; R390-A393 PolarHBondContact O-N 3.24Å; A393-E395 HydrophobicContact CB-CB 4.45Å; A393-E395 HydrophobicContact CB-CG 3.82Å; A393-E395 PolarHBondContact O-N 3.45Å; A393-E395 VanDerWaalsContact O-N 3.13Å
394	G	78.8	Confident	83.1	Confident	52 Å²	52	66.3 Å²	66.3	54%	0.536	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	7.9	-172.7	0	0	0	0	0	113.9	R390 H392 K396	R390-G394 CarbonylContact O-C 3.34Å; R390-G394 PolarHBondContact O-N 3.38Å; H392-G394 PolarHBondContact O-N 3.49Å; G394-K396 PolarHBondContact O-N 3.46Å
395	E	80.4	Confident	83.3	Confident	109 Å²	109	68 Å²	68	51%	0.509	41%	0.411	S	S	.	.			trans	-64.2	124.3	-178.6	-74.2	179.8	-169.9	0	0	110.7	R390 A393 P397	R390-E395 HydrophobicContact CB-CB 4.12Å; R390-E395 HydrophobicContact CG-CB 4.33Å; R390-E395 PolarHBondContact O-N 3.18Å; A393-E395 HydrophobicContact CB-CB 4.45Å; A393-E395 HydrophobicContact CB-CG 3.82Å; A393-E395 PolarHBondContact O-N 3.45Å; A393-E395 VanDerWaalsContact O-N 3.13Å; E395-P397 WeakPolarHBondContact O-CD 3.26Å
396	K	82.7	Confident	83.5	Confident	126 Å²	126	69.3 Å²	69.3	55%	0.548	42%	0.422	S	S	.	.			trans	-124.2	77.7	175.1	-65.6	-178.7	-173	177.1	0	109.1	G394 Y398 S406 F407	G394-K396 PolarHBondContact O-N 3.46Å; K396-Y398 PolarHBondContact O-N 3.14Å; K396-S406 VanDerWaalsContact CD-O 3.32Å; K396-S406 WeakPolarHBondContact CD-O 3.19Å; K396-S406 WeakPolarHBondContact O-CB 3.44Å; K396-F407 CarbonylContact C-O 3.36Å; K396-F407 VanDerWaalsContact C-O 3.3Å; K396-F407 WeakPolarHBondContact CA-O 3.38Å
397	P	84.3	Confident	83.6	Confident	71 Å²	71	68.8 Å²	68.8	46%	0.461	42%	0.415	S	S	.	.			trans	-65.7	-15.2	-170.5	-20.8	33.3	0	0	0	114.2	E395	E395-P397 WeakPolarHBondContact O-CD 3.26Å
398	Y	86.1	Confident	83.6	Confident	75 Å²	75	69.1 Å²	69.1	29%	0.294	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	89.1	-172.3	-55.5	-74.4	0	0	0	110.2	K396 S406 F407 S409 K410	K396-Y398 PolarHBondContact O-N 3.14Å; Y398-S406 CarbonylContact O-C 3.6Å; Y398-S406 WeakPolarHBondContact O-CA 3.41Å; Y398-F407 PolarHBondContact N-O 3.13Å; Y398-F407 PolarHBondContact O-N 2.68Å; Y398-S409 VanDerWaalsContact CD2-C 3.45Å; Y398-K410 HydrophobicContact CD1-CB 4.04Å; Y398-K410 HydrophobicContact CD1-CG 4.48Å; Y398-K410 HydrophobicContact CE1-CB 3.88Å; Y398-K410 HydrophobicContact CE1-CG 4.47Å; Y398-K410 HydrophobicContact CG-CB 4.43Å
399	G	86.6	Confident	83.5	Confident	43 Å²	43	69.6 Å²	69.6	44%	0.443	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	143.4	175.9	0	0	0	0	0	113.3
400	C	90.2	Very high	83.6	Confident	5 Å²	5	73.2 Å²	73.2	3%	0.034	44%	0.435	C	S	.	.			trans	-91.2	121.4	166.2	-178.3	0	0	0	0	109.4	E402 G404 K405 F407 L413 H420	C400-E402 VanDerWaalsContact C-N 3.27Å; C400-E402 PolarHBondContact O-N 3.42Å; C400-G404 VanDerWaalsContact O-CA 3.31Å; C400-G404 WeakPolarHBondContact O-CA 3.49Å; C400-G404 PolarHBondContact O-N 2.99Å; C400-K405 VanDerWaalsContact CB-O 3.24Å; C400-K405 WeakPolarHBondContact CB-O 3.25Å; C400-K405 PolarHBondContact N-O 3.15Å; C400-F407 HydrophobicContact CB-CE2 4.45Å; C400-L413 HydrophobicContact CB-CD1 3.72Å; C400-H420 PolarHBondContact SG-NE2 3.33Å; C400-H420 VanDerWaalsContact SG-NE2 3.37Å
401	S	86.3	Confident	83.6	Confident	114 Å²	114	73.9 Å²	73.9	80%	0.797	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-28	178.9	48.1	0	0	0	0	113.5
402	E	85.8	Confident	83.8	Confident	98 Å²	98	77.4 Å²	77.4	46%	0.458	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-26.2	-172.7	-65.7	164.5	-136.9	0	0	113.5	C400 R417 H420	C400-E402 VanDerWaalsContact C-N 3.27Å; C400-E402 PolarHBondContact O-N 3.42Å; E402-R417 IonicContact OE1-NE 3.13Å; E402-R417 IonicContact OE1-NH2 3.5Å; E402-H420 WeakPolarHBondContact OE2-CB 3.33Å; E402-H420 IonicContact OE2-CD2 3.18Å; E402-H420 PolarHBondContact OE2-CD2 3.22Å; E402-H420 IonicContact OE2-CG 3.36Å
403	C	86.9	Confident	84.2	Confident	51 Å²	51	75.1 Å²	75.1	35%	0.345	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	6.6	-176.3	72.6	0	0	0	0	114.6	K405 H416 H420	C403-K405 PolarHBondContact O-N 3.38Å; C403-K405 VanDerWaalsContact SG-CB 3.59Å; C403-K405 VanDerWaalsContact SG-CG 3.59Å; C403-H416 PolarHBondContact SG-NE2 3.47Å; C403-H420 PolarHBondContact SG-NE2 3.13Å
404	G	83.3	Confident	84.5	Confident	60 Å²	60	75.1 Å²	75.1	62%	0.619	43%	0.432	S	S	*	.			trans	67.9	-3.6	-179.1	0	0	0	0	0	115.4	C400 S406	C400-G404 VanDerWaalsContact O-CA 3.31Å; C400-G404 WeakPolarHBondContact O-CA 3.49Å; C400-G404 PolarHBondContact O-N 2.99Å; G404-S406 PolarHBondContact O-N 3.23Å
405	K	85.9	Confident	84.9	Confident	127 Å²	127	75 Å²	75	55%	0.552	42%	0.419	S	S	*	.			trans	-68.7	129.8	-179.8	-69.1	178.6	-176.1	172.5	0	110.5	C400 C403 F407	C400-K405 VanDerWaalsContact CB-O 3.24Å; C400-K405 WeakPolarHBondContact CB-O 3.25Å; C400-K405 PolarHBondContact N-O 3.15Å; C403-K405 PolarHBondContact O-N 3.38Å; C403-K405 VanDerWaalsContact SG-CB 3.59Å; C403-K405 VanDerWaalsContact SG-CG 3.59Å; K405-F407 HydrophobicContact CB-CE2 3.99Å; K405-F407 HydrophobicContact CB-CZ 4.06Å; K405-F407 WeakPolarHBondContact O-CE2 3.49Å
406	S	87.1	Confident	85.3	Confident	51 Å²	51	70.9 Å²	70.9	36%	0.357	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	150	178.8	-62.9	0	0	0	0	111.8	K396 Y398 G404	K396-S406 VanDerWaalsContact CD-O 3.32Å; K396-S406 WeakPolarHBondContact CD-O 3.19Å; K396-S406 WeakPolarHBondContact O-CB 3.44Å; Y398-S406 CarbonylContact O-C 3.6Å; Y398-S406 WeakPolarHBondContact O-CA 3.41Å; G404-S406 PolarHBondContact O-N 3.23Å
407	F	83.7	Confident	85.5	Confident	46 Å²	46	70.3 Å²	70.3	20%	0.202	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153	-176.9	-58.2	-89.4	0	0	0	111.7	K396 Y398 C400 K405 L413 H416	K396-F407 CarbonylContact C-O 3.36Å; K396-F407 VanDerWaalsContact C-O 3.3Å; K396-F407 WeakPolarHBondContact CA-O 3.38Å; Y398-F407 PolarHBondContact N-O 3.13Å; Y398-F407 PolarHBondContact O-N 2.68Å; C400-F407 HydrophobicContact CB-CE2 4.45Å; K405-F407 HydrophobicContact CB-CE2 3.99Å; K405-F407 HydrophobicContact CB-CZ 4.06Å; K405-F407 WeakPolarHBondContact O-CE2 3.49Å; F407-L413 HydrophobicContact CB-CB 4.5Å; F407-L413 HydrophobicContact CD2-CB 4.08Å; F407-L413 HydrophobicContact CD2-CD1 3.85Å; F407-L413 HydrophobicContact CE2-CD1 4.08Å; F407-H416 HydrophobicContact CE1-CB 4.03Å; F407-H416 HydrophobicContact CE2-CB 3.77Å; F407-H416 AromaticContact CE2-CD2 3.27Å; F407-H416 WeakPolarHBondContact CE2-CD2 3.47Å; F407-H416 AromaticContact CE2-CG 3.58Å; F407-H416 HydrophobicContact CZ-CB 3.44Å; F407-H416 VanDerWaalsContact CZ-CB 3.44Å; F407-H416 AromaticContact CZ-CD2 3.35Å; F407-H416 WeakPolarHBondContact CZ-CD2 3.48Å; F407-H416 AromaticContact CZ-CG 3.21Å; F407-H416 AromaticContact CZ-ND1 3.85Å; F407-H416 AromaticContact CZ-NE2 3.99Å
408	S	80.4	Confident	85.7	Confident	50 Å²	50	69.3 Å²	69.3	35%	0.35	38%	0.381	S	S	.	.	S	Bend	trans	-79.9	-14.9	179	56.3	0	0	0	0	114
409	S	80.4	Confident	85.7	Confident	41 Å²	41	69.6 Å²	69.6	29%	0.287	39%	0.391	S	S	.	.	S	Bend	trans	-140.6	142.6	178.5	171.5	0	0	0	0	112.1	Y398 S411 Y412 L413	Y398-S409 VanDerWaalsContact CD2-C 3.45Å; S409-S411 VanDerWaalsContact C-N 3.26Å; S409-S411 PolarHBondContact O-N 2.6Å; S409-S411 PolarHBondContact OG-N 3.09Å; S409-Y412 PolarHBondContact O-N 3.14Å; S409-Y412 VanDerWaalsContact O-N 3.13Å; S409-L413 PolarHBondContact O-N 3.45Å
410	K	84	Confident	85.7	Confident	139 Å²	139	71.1 Å²	71.1	60%	0.604	39%	0.386	S	S	*	.	H	α-helix	trans	-56.8	-37.6	177.5	-171.2	173.7	-178	174.5	0	112.5	Y398 Y412 L413 V414	Y398-K410 HydrophobicContact CD1-CB 4.04Å; Y398-K410 HydrophobicContact CD1-CG 4.48Å; Y398-K410 HydrophobicContact CE1-CB 3.88Å; Y398-K410 HydrophobicContact CE1-CG 4.47Å; Y398-K410 HydrophobicContact CG-CB 4.43Å; K410-Y412 VanDerWaalsContact C-N 3.3Å; K410-Y412 PolarHBondContact O-N 2.96Å; K410-L413 PolarHBondContact O-N 3.14Å; K410-V414 WeakPolarHBondContact O-CG2 3.39Å; K410-V414 PolarHBondContact O-N 3.21Å
411	S	84.3	Confident	85.4	Confident	83 Å²	83	74.3 Å²	74.3	58%	0.58	41%	0.406	S	S	*	.	H	α-helix	trans	-62.8	-37.3	179.2	-52.9	0	0	0	0	112.2	S409 V414 I415	S409-S411 VanDerWaalsContact C-N 3.26Å; S409-S411 PolarHBondContact O-N 2.6Å; S409-S411 PolarHBondContact OG-N 3.09Å; S411-V414 PolarHBondContact O-N 2.83Å; S411-I415 WeakPolarHBondContact O-CG1 3.41Å; S411-I415 PolarHBondContact O-N 3.24Å; S411-I415 VanDerWaalsContact O-N 3.12Å
412	Y	83.7	Confident	85.4	Confident	145 Å²	145	71.3 Å²	71.3	57%	0.569	39%	0.392	S	S	*	.	H	α-helix	trans	-70.8	-38	176	-72.4	-58.9	0	0	0	112	S409 K410 V414 I415 H416	S409-Y412 PolarHBondContact O-N 3.14Å; S409-Y412 VanDerWaalsContact O-N 3.13Å; K410-Y412 VanDerWaalsContact C-N 3.3Å; K410-Y412 PolarHBondContact O-N 2.96Å; Y412-V414 VanDerWaalsContact C-N 3.34Å; Y412-V414 PolarHBondContact O-N 3.01Å; Y412-I415 PolarHBondContact O-N 3.43Å; Y412-H416 WeakPolarHBondContact O-CB 3.37Å; Y412-H416 PolarHBondContact O-N 2.91Å
413	L	87.3	Confident	85.4	Confident	25 Å²	25	72 Å²	72	13%	0.131	40%	0.395	C	S	.	.	H	α-helix	trans	-59.7	-44.9	172.7	175.3	63.4	0	0	0	111.2	C400 F407 S409 K410 I415 H416 R417	C400-L413 HydrophobicContact CB-CD1 3.72Å; F407-L413 HydrophobicContact CB-CB 4.5Å; F407-L413 HydrophobicContact CD2-CB 4.08Å; F407-L413 HydrophobicContact CD2-CD1 3.85Å; F407-L413 HydrophobicContact CE2-CD1 4.08Å; S409-L413 PolarHBondContact O-N 3.45Å; K410-L413 PolarHBondContact O-N 3.14Å; L413-I415 PolarHBondContact O-N 3.37Å; L413-H416 WeakPolarHBondContact O-CB 3.33Å; L413-H416 PolarHBondContact O-N 3.37Å; L413-R417 HydrophobicContact CD1-CG 4.24Å; L413-R417 WeakPolarHBondContact O-CG 3.49Å; L413-R417 PolarHBondContact O-N 3.2Å
414	V	86.9	Confident	85.4	Confident	67 Å²	67	75.9 Å²	75.9	41%	0.406	40%	0.403	S	S	.	.	H	α-helix	trans	-60.9	-45.5	177.9	172.7	0	0	0	0	111.6	K410 S411 Y412 H416 R417 R418	K410-V414 WeakPolarHBondContact O-CG2 3.39Å; K410-V414 PolarHBondContact O-N 3.21Å; S411-V414 PolarHBondContact O-N 2.83Å; Y412-V414 VanDerWaalsContact C-N 3.34Å; Y412-V414 PolarHBondContact O-N 3.01Å; V414-H416 VanDerWaalsContact C-N 3.29Å; V414-H416 PolarHBondContact O-N 2.8Å; V414-R417 PolarHBondContact O-N 2.93Å; V414-R418 PolarHBondContact O-N 3.17Å
415	I	86.9	Confident	85.7	Confident	48 Å²	48	76.5 Å²	76.5	25%	0.246	40%	0.396	C	S	.	.	H	α-helix	trans	-64.5	-37	176.6	-65.1	165.3	0	0	0	110.8	S411 Y412 L413 R418 C436	S411-I415 WeakPolarHBondContact O-CG1 3.41Å; S411-I415 PolarHBondContact O-N 3.24Å; S411-I415 VanDerWaalsContact O-N 3.12Å; Y412-I415 PolarHBondContact O-N 3.43Å; L413-I415 PolarHBondContact O-N 3.37Å; I415-R418 WeakPolarHBondContact O-CB 3.35Å; I415-R418 PolarHBondContact O-N 3Å; I415-C436 HydrophobicContact CG2-CB 4.45Å
416	H	87.7	Confident	85.9	Confident	23 Å²	23	74.2 Å²	74.2	11%	0.106	39%	0.385	C	S	.	.	H	α-helix	trans	-66.6	-42.7	176.5	174.3	55	0	0	0	112.3	C403 F407 Y412 L413 V414 R418 T419 H420	C403-H416 PolarHBondContact SG-NE2 3.47Å; F407-H416 HydrophobicContact CE1-CB 4.03Å; F407-H416 HydrophobicContact CE2-CB 3.77Å; F407-H416 AromaticContact CE2-CD2 3.27Å; F407-H416 WeakPolarHBondContact CE2-CD2 3.47Å; F407-H416 AromaticContact CE2-CG 3.58Å; F407-H416 HydrophobicContact CZ-CB 3.44Å; F407-H416 VanDerWaalsContact CZ-CB 3.44Å; F407-H416 AromaticContact CZ-CD2 3.35Å; F407-H416 WeakPolarHBondContact CZ-CD2 3.48Å; F407-H416 AromaticContact CZ-CG 3.21Å; F407-H416 AromaticContact CZ-ND1 3.85Å; F407-H416 AromaticContact CZ-NE2 3.99Å; Y412-H416 WeakPolarHBondContact O-CB 3.37Å; Y412-H416 PolarHBondContact O-N 2.91Å; L413-H416 WeakPolarHBondContact O-CB 3.33Å; L413-H416 PolarHBondContact O-N 3.37Å; V414-H416 VanDerWaalsContact C-N 3.29Å; V414-H416 PolarHBondContact O-N 2.8Å; H416-R418 PolarHBondContact O-N 3.39Å; H416-R418 VanDerWaalsContact O-N 3.11Å; H416-T419 PolarHBondContact ND1-OG1 2.83Å; H416-T419 WeakPolarHBondContact O-CB 3.42Å; H416-T419 PolarHBondContact O-N 3.31Å; H416-T419 PolarHBondContact O-OG1 2.79Å; H416-H420 AromaticContact CE1-CE1 4Å; H416-H420 AromaticContact CE1-NE2 3.71Å; H416-H420 AromaticContact NE2-CE1 3.92Å; H416-H420 AromaticContact NE2-NE2 3.27Å; H416-H420 PolarHBondContact NE2-NE2 3.16Å
417	R	87.2	Confident	85.9	Confident	114 Å²	114	74.1 Å²	74.1	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-56.6	-31.5	178	-73.2	-172.4	70.5	-117.7	-4.8	112.7	E402 L413 V414 T419 H420 T421	E402-R417 IonicContact OE1-NE 3.13Å; E402-R417 IonicContact OE1-NH2 3.5Å; L413-R417 HydrophobicContact CD1-CG 4.24Å; L413-R417 WeakPolarHBondContact O-CG 3.49Å; L413-R417 PolarHBondContact O-N 3.2Å; V414-R417 PolarHBondContact O-N 2.93Å; R417-T419 PolarHBondContact O-N 3.36Å; R417-H420 PolarHBondContact O-N 2.87Å; R417-T421 PolarHBondContact O-N 2.89Å
418	R	89.7	Confident	86.2	Confident	50 Å²	50	72.6 Å²	72.6	19%	0.189	39%	0.386	C	S	.	.	H	α-helix	trans	-62.1	-21.1	174	-65.7	176.3	-180	165.7	-1.3	114.1	V414 I415 H416 H420 T421 G422 E423 C436	V414-R418 PolarHBondContact O-N 3.17Å; I415-R418 WeakPolarHBondContact O-CB 3.35Å; I415-R418 PolarHBondContact O-N 3Å; H416-R418 PolarHBondContact O-N 3.39Å; H416-R418 VanDerWaalsContact O-N 3.11Å; R418-H420 VanDerWaalsContact C-N 3.28Å; R418-T421 WeakPolarHBondContact CA-OG1 3.46Å; R418-G422 CarbonylContact O-C 3.55Å; R418-G422 WeakPolarHBondContact O-CA 3.48Å; R418-G422 PolarHBondContact O-N 3.32Å; R418-E423 HydrophobicContact CB-CB 4.35Å; R418-E423 HydrophobicContact CG-CB 4.23Å; R418-E423 PolarHBondContact O-N 2.83Å; R418-C436 HydrophobicContact CB-CB 3.89Å; R418-C436 WeakPolarHBondContact CD-O 3.29Å; R418-C436 PolarHBondContact NH1-O 3.31Å
419	T	85.8	Confident	86.5	Confident	82 Å²	82	75.2 Å²	75.2	50%	0.503	41%	0.405	S	S	.	.	H	α-helix	trans	-73.8	-23.3	174.4	68.9	0	0	0	0	112.6	H416 R417	H416-T419 PolarHBondContact ND1-OG1 2.83Å; H416-T419 WeakPolarHBondContact O-CB 3.42Å; H416-T419 PolarHBondContact O-N 3.31Å; H416-T419 PolarHBondContact O-OG1 2.79Å; R417-T419 PolarHBondContact O-N 3.36Å
420	H	85.7	Confident	86.7	Confident	74 Å²	74	79 Å²	79	34%	0.343	42%	0.421	S	S	.	.	H	α-helix	trans	-86.2	-41.8	175.5	-58.3	-51.8	0	0	0	111.4	C400 E402 C403 H416 R417 R418 G422	C400-H420 PolarHBondContact SG-NE2 3.33Å; C400-H420 VanDerWaalsContact SG-NE2 3.37Å; E402-H420 WeakPolarHBondContact OE2-CB 3.33Å; E402-H420 IonicContact OE2-CD2 3.18Å; E402-H420 PolarHBondContact OE2-CD2 3.22Å; E402-H420 IonicContact OE2-CG 3.36Å; C403-H420 PolarHBondContact SG-NE2 3.13Å; H416-H420 AromaticContact CE1-CE1 4Å; H416-H420 AromaticContact CE1-NE2 3.71Å; H416-H420 AromaticContact NE2-CE1 3.92Å; H416-H420 AromaticContact NE2-NE2 3.27Å; H416-H420 PolarHBondContact NE2-NE2 3.16Å; R417-H420 PolarHBondContact O-N 2.87Å; R418-H420 VanDerWaalsContact C-N 3.28Å; H420-G422 VanDerWaalsContact C-N 3.26Å; H420-G422 PolarHBondContact O-N 3.28Å
421	T	85.3	Confident	86.9	Confident	73 Å²	73	74.2 Å²	74.2	45%	0.448	41%	0.405	S	S	.	.	H	α-helix	trans	-76.3	-13.8	177.8	64.8	0	0	0	0	113.5	R417 R418 E423	R417-T421 PolarHBondContact O-N 2.89Å; R418-T421 WeakPolarHBondContact CA-OG1 3.46Å; T421-E423 PolarHBondContact O-N 3.19Å; T421-E423 WeakPolarHBondContact OG1-CG 3.32Å; T421-E423 PolarHBondContact OG1-N 3.26Å
422	G	84.3	Confident	86.9	Confident	50 Å²	50	79.9 Å²	79.9	52%	0.515	42%	0.422	S	S	.	.			trans	73.4	2.8	-175.2	0	0	0	0	0	114.4	R418 H420 R424	R418-G422 CarbonylContact O-C 3.55Å; R418-G422 WeakPolarHBondContact O-CA 3.48Å; R418-G422 PolarHBondContact O-N 3.32Å; H420-G422 VanDerWaalsContact C-N 3.26Å; H420-G422 PolarHBondContact O-N 3.28Å; G422-R424 PolarHBondContact O-N 3.1Å
423	E	86.9	Confident	87	Confident	112 Å²	112	80.2 Å²	80.2	52%	0.523	42%	0.422	S	S	.	.			trans	-63.1	123.7	179.9	-75.7	-178.7	-173.2	0	0	111.7	R418 T421 P425 C436	R418-E423 HydrophobicContact CB-CB 4.35Å; R418-E423 HydrophobicContact CG-CB 4.23Å; R418-E423 PolarHBondContact O-N 2.83Å; T421-E423 PolarHBondContact O-N 3.19Å; T421-E423 WeakPolarHBondContact OG1-CG 3.32Å; T421-E423 PolarHBondContact OG1-N 3.26Å; E423-P425 WeakPolarHBondContact O-CD 3.49Å; E423-C436 PolarHBondContact O-SG 3.08Å
424	R	87.4	Confident	87.1	Confident	134 Å²	134	80.1 Å²	80.1	51%	0.506	43%	0.425	S	S	.	.			trans	-126.7	76.7	178.2	-64.7	170.5	87.3	161	3.9	110.4	G422 Y426 A434 F435	G422-R424 PolarHBondContact O-N 3.1Å; R424-Y426 PolarHBondContact O-N 2.94Å; R424-Y426 VanDerWaalsContact O-N 3.1Å; R424-A434 HydrophobicContact CB-CB 3.47Å; R424-A434 VanDerWaalsContact CB-CB 3.47Å; R424-A434 HydrophobicContact CG-CB 4.48Å; R424-A434 VanDerWaalsContact NE-C 3.35Å; R424-A434 PolarHBondContact NE-O 3.25Å; R424-A434 PolarHBondContact NH2-O 2.95Å; R424-F435 CarbonylContact C-O 3.29Å; R424-F435 WeakPolarHBondContact CA-O 3.2Å
425	P	89.2	Confident	87.2	Confident	73 Å²	73	78.3 Å²	78.3	47%	0.474	41%	0.412	S	S	.	.			trans	-67.3	-13.5	-173.2	-21.1	33.9	0	0	0	114.7	E423	E423-P425 WeakPolarHBondContact O-CD 3.49Å
426	Y	89.7	Confident	87.1	Confident	79 Å²	79	76.7 Å²	76.7	31%	0.31	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	88	-173.3	-55.9	-73.1	0	0	0	110.6	R424 A434 F435 K438	R424-Y426 PolarHBondContact O-N 2.94Å; R424-Y426 VanDerWaalsContact O-N 3.1Å; Y426-A434 CarbonylContact O-C 3.54Å; Y426-A434 WeakPolarHBondContact O-CA 3.47Å; Y426-F435 WeakPolarHBondContact CD2-O 3.4Å; Y426-F435 PolarHBondContact N-O 3.17Å; Y426-F435 PolarHBondContact O-N 3.39Å; Y426-K438 HydrophobicContact CD1-CB 4.17Å; Y426-K438 HydrophobicContact CE1-CB 3.97Å; Y426-K438 HydrophobicContact CE2-CB 4.45Å
427	G	87.3	Confident	87.1	Confident	48 Å²	48	75.7 Å²	75.7	50%	0.495	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	143.9	173.7	0	0	0	0	0	112.9	L441	G427-L441 WeakPolarHBondContact O-CD2 3.36Å
428	C	90	Very high	87.1	Confident	15 Å²	15	76.8 Å²	76.8	10%	0.101	41%	0.409	C	S	.	.			trans	-80.1	137.7	164	-169.2	0	0	0	0	109.5	L430 C431 R433 L441	C428-L430 VanDerWaalsContact C-N 3.32Å; C428-C431 CarbonylContact C-O 3.3Å; C428-C431 WeakPolarHBondContact CB-O 3.49Å; C428-R433 VanDerWaalsContact CB-O 3.28Å; C428-R433 WeakPolarHBondContact CB-O 3.34Å; C428-R433 PolarHBondContact N-O 3.02Å; C428-L441 HydrophobicContact CB-CD1 3.85Å
429	S	86.4	Confident	86.9	Confident	105 Å²	105	78 Å²	78	73%	0.734	43%	0.425	S	S	*	.	S	Bend	trans	-79.4	-17	175.9	53.9	0	0	0	0	113.2
430	L	84.5	Confident	86.9	Confident	119 Å²	119	78.2 Å²	78.2	62%	0.623	42%	0.42	S	S	*	.	S	Bend	trans	-101.8	-10.4	-175.4	-59.7	175.5	0	0	0	112.9	C428 H448	C428-L430 VanDerWaalsContact C-N 3.32Å; L430-H448 HydrophobicContact CB-CB 4.48Å; L430-H448 HydrophobicContact CD1-CB 3.48Å; L430-H448 VanDerWaalsContact CD1-CB 3.48Å
431	C	89	Confident	87	Confident	40 Å²	40	75.6 Å²	75.6	27%	0.27	41%	0.408	S	S	.	.	S	Bend	trans	-158.1	165.8	173.4	71.6	0	0	0	0	110.7	C428 R433 H444 H448	C428-C431 CarbonylContact C-O 3.3Å; C428-C431 WeakPolarHBondContact CB-O 3.49Å; C431-R433 PolarHBondContact O-N 3.08Å; C431-H444 PolarHBondContact SG-NE2 3.28Å; C431-H448 PolarHBondContact SG-NE2 3.42Å; C431-H448 VanDerWaalsContact SG-NE2 3.36Å
432	E	84.3	Confident	87	Confident	202 Å²	202	75.5 Å²	75.5	94%	0.944	41%	0.405	S	S	*	.	S	Bend	trans	-71.6	6.4	-176.7	-61.3	175.3	179.9	0	0	114.4	A434	E432-A434 PolarHBondContact O-N 3Å
433	R	85.7	Confident	87.1	Confident	151 Å²	151	76.1 Å²	76.1	57%	0.57	40%	0.395	S	S	*	.			trans	-80.1	122.3	-179.1	-61.3	-176.1	102	-177.9	8.7	110.8	C428 C431 F435	C428-R433 VanDerWaalsContact CB-O 3.28Å; C428-R433 WeakPolarHBondContact CB-O 3.34Å; C428-R433 PolarHBondContact N-O 3.02Å; C431-R433 PolarHBondContact O-N 3.08Å; R433-F435 HydrophobicContact CB-CE2 3.99Å; R433-F435 HydrophobicContact CB-CZ 4.07Å
434	A	88.9	Confident	87	Confident	24 Å²	24	71.3 Å²	71.3	20%	0.198	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	164.4	170.1	0	0	0	0	0	112.1	R424 Y426 E432	R424-A434 HydrophobicContact CB-CB 3.47Å; R424-A434 VanDerWaalsContact CB-CB 3.47Å; R424-A434 HydrophobicContact CG-CB 4.48Å; R424-A434 VanDerWaalsContact NE-C 3.35Å; R424-A434 PolarHBondContact NE-O 3.25Å; R424-A434 PolarHBondContact NH2-O 2.95Å; Y426-A434 CarbonylContact O-C 3.54Å; Y426-A434 WeakPolarHBondContact O-CA 3.47Å; E432-A434 PolarHBondContact O-N 3Å
435	F	89.3	Confident	86.9	Confident	28 Å²	28	68.3 Å²	68.3	12%	0.123	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	153.9	-178.9	-60.7	-91.4	0	0	0	111.8	R424 Y426 R433 G437 Q440 L441 H444	R424-F435 CarbonylContact C-O 3.29Å; R424-F435 WeakPolarHBondContact CA-O 3.2Å; Y426-F435 WeakPolarHBondContact CD2-O 3.4Å; Y426-F435 PolarHBondContact N-O 3.17Å; Y426-F435 PolarHBondContact O-N 3.39Å; R433-F435 HydrophobicContact CB-CE2 3.99Å; R433-F435 HydrophobicContact CB-CZ 4.07Å; F435-G437 VanDerWaalsContact C-N 3.32Å; F435-Q440 HydrophobicContact CB-CB 3.99Å; F435-Q440 HydrophobicContact CD1-CB 3.8Å; F435-Q440 HydrophobicContact CG-CB 4.1Å; F435-L441 HydrophobicContact CB-CB 4.48Å; F435-L441 HydrophobicContact CD2-CB 4.04Å; F435-L441 HydrophobicContact CD2-CD1 3.97Å; F435-L441 HydrophobicContact CE2-CD1 4.2Å; F435-L441 HydrophobicContact CG-CB 4.47Å; F435-H444 HydrophobicContact CE1-CB 4.06Å; F435-H444 HydrophobicContact CE2-CB 3.73Å; F435-H444 AromaticContact CE2-CD2 3.28Å; F435-H444 WeakPolarHBondContact CE2-CD2 3.36Å; F435-H444 AromaticContact CE2-CG 3.61Å; F435-H444 HydrophobicContact CZ-CB 3.39Å; F435-H444 AromaticContact CZ-CD2 3.42Å; F435-H444 VanDerWaalsContact CZ-CD2 3.42Å; F435-H444 WeakPolarHBondContact CZ-CD2 3.27Å; F435-H444 AromaticContact CZ-CG 3.29Å
436	C	85.5	Confident	86.7	Confident	15 Å²	15	67.9 Å²	67.9	10%	0.101	35%	0.353	C	S	.	.	S	Bend	trans	-79.2	-16.6	179.4	-60	0	0	0	0	112.7	I415 R418 E423	I415-C436 HydrophobicContact CG2-CB 4.45Å; R418-C436 HydrophobicContact CB-CB 3.89Å; R418-C436 WeakPolarHBondContact CD-O 3.29Å; R418-C436 PolarHBondContact NH1-O 3.31Å; E423-C436 PolarHBondContact O-SG 3.08Å
437	G	87.4	Confident	86.3	Confident	2 Å²	2	68 Å²	68	2%	0.021	36%	0.362	C	S	.	.	S	Bend	trans	-138.7	146.4	178.3	0	0	0	0	0	113.7	F435 S439 Q440 L441	F435-G437 VanDerWaalsContact C-N 3.32Å; G437-S439 VanDerWaalsContact C-N 3.32Å; G437-S439 PolarHBondContact O-N 3.28Å; G437-Q440 WeakPolarHBondContact O-CB 3.49Å; G437-Q440 PolarHBondContact O-N 2.97Å; G437-L441 PolarHBondContact O-N 3.3Å
438	K	87	Confident	86	Confident	137 Å²	137	69.3 Å²	69.3	60%	0.596	36%	0.356	S	S	*	.	H	α-helix	trans	-60.5	-37.2	179.8	-172.8	175.8	-177.5	175.4	0	113.3	Y426 Q440 L441 I442	Y426-K438 HydrophobicContact CD1-CB 4.17Å; Y426-K438 HydrophobicContact CE1-CB 3.97Å; Y426-K438 HydrophobicContact CE2-CB 4.45Å; K438-Q440 VanDerWaalsContact C-N 3.29Å; K438-Q440 PolarHBondContact O-N 3.13Å; K438-L441 PolarHBondContact O-N 3.36Å; K438-I442 HydrophobicContact CG-CD1 4.2Å; K438-I442 WeakPolarHBondContact O-CG1 3.46Å; K438-I442 PolarHBondContact O-N 3.49Å
439	S	84.7	Confident	85.4	Confident	75 Å²	75	70.7 Å²	70.7	52%	0.524	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-36.6	177.7	52.4	0	0	0	0	112.5	G437 I442 I443	G437-S439 VanDerWaalsContact C-N 3.32Å; G437-S439 PolarHBondContact O-N 3.28Å; S439-I442 PolarHBondContact O-N 3.21Å; S439-I443 WeakPolarHBondContact O-CD1 3.36Å; S439-I443 VanDerWaalsContact O-CG1 3.26Å; S439-I443 WeakPolarHBondContact O-CG1 3.24Å; S439-I443 PolarHBondContact O-N 3.22Å
440	Q	86.6	Confident	84.7	Confident	86 Å²	86	72.3 Å²	72.3	40%	0.402	37%	0.371	S	S	.	.	H	α-helix	trans	-67.7	-41.6	177.2	-62.5	169.7	-9.4	0	0	110.9	F435 G437 K438 I443 H444	F435-Q440 HydrophobicContact CB-CB 3.99Å; F435-Q440 HydrophobicContact CD1-CB 3.8Å; F435-Q440 HydrophobicContact CG-CB 4.1Å; G437-Q440 WeakPolarHBondContact O-CB 3.49Å; G437-Q440 PolarHBondContact O-N 2.97Å; K438-Q440 VanDerWaalsContact C-N 3.29Å; K438-Q440 PolarHBondContact O-N 3.13Å; Q440-I443 PolarHBondContact O-N 3.31Å; Q440-H444 WeakPolarHBondContact O-CB 3.17Å; Q440-H444 PolarHBondContact O-N 3.45Å
441	L	88.6	Confident	84.3	Confident	19 Å²	19	72.6 Å²	72.6	10%	0.099	37%	0.369	C	S	.	.	H	α-helix	trans	-59.6	-48	173.5	173.6	62.6	0	0	0	111.6	G427 C428 F435 G437 K438 I443 H444 Q445	G427-L441 WeakPolarHBondContact O-CD2 3.36Å; C428-L441 HydrophobicContact CB-CD1 3.85Å; F435-L441 HydrophobicContact CB-CB 4.48Å; F435-L441 HydrophobicContact CD2-CB 4.04Å; F435-L441 HydrophobicContact CD2-CD1 3.97Å; F435-L441 HydrophobicContact CE2-CD1 4.2Å; F435-L441 HydrophobicContact CG-CB 4.47Å; G437-L441 PolarHBondContact O-N 3.3Å; K438-L441 PolarHBondContact O-N 3.36Å; L441-I443 VanDerWaalsContact C-N 3.33Å; L441-I443 PolarHBondContact O-N 3.02Å; L441-H444 CarbonylContact O-C 3.59Å; L441-H444 WeakPolarHBondContact O-CA 3.42Å; L441-H444 WeakPolarHBondContact O-CB 3.22Å; L441-H444 PolarHBondContact O-N 2.76Å; L441-Q445 HydrophobicContact CD1-CG 4.1Å; L441-Q445 HydrophobicContact CG-CG 4.42Å; L441-Q445 WeakPolarHBondContact O-CG 3.46Å; L441-Q445 PolarHBondContact O-N 3.48Å
442	I	85.3	Confident	84	Confident	72 Å²	72	76.6 Å²	76.6	37%	0.369	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-44.1	179.1	-67.3	167.6	0	0	0	111.1	K438 S439 H444 Q445 R446	K438-I442 HydrophobicContact CG-CD1 4.2Å; K438-I442 WeakPolarHBondContact O-CG1 3.46Å; K438-I442 PolarHBondContact O-N 3.49Å; S439-I442 PolarHBondContact O-N 3.21Å; I442-H444 VanDerWaalsContact C-N 3.27Å; I442-H444 PolarHBondContact O-N 2.71Å; I442-Q445 PolarHBondContact O-N 3.2Å; I442-R446 PolarHBondContact O-N 3.43Å
443	I	84.5	Confident	84	Confident	62 Å²	62	70.6 Å²	70.6	32%	0.318	36%	0.361	S	S	.	.	H	α-helix	trans	-64.4	-35.3	177.1	-68.6	165.7	0	0	0	111.1	S439 Q440 L441 R465	S439-I443 WeakPolarHBondContact O-CD1 3.36Å; S439-I443 VanDerWaalsContact O-CG1 3.26Å; S439-I443 WeakPolarHBondContact O-CG1 3.24Å; S439-I443 PolarHBondContact O-N 3.22Å; Q440-I443 PolarHBondContact O-N 3.31Å; L441-I443 VanDerWaalsContact C-N 3.33Å; L441-I443 PolarHBondContact O-N 3.02Å; I443-R465 HydrophobicContact CG2-CG 4.2Å
444	H	86.3	Confident	84.1	Confident	12 Å²	12	67 Å²	67	6%	0.056	35%	0.348	C	S	.	.	H	α-helix	trans	-71.1	-39	175.3	172.9	51.5	0	0	0	112.4	C431 F435 Q440 L441 I442 R446 T447 H448	C431-H444 PolarHBondContact SG-NE2 3.28Å; F435-H444 HydrophobicContact CE1-CB 4.06Å; F435-H444 HydrophobicContact CE2-CB 3.73Å; F435-H444 AromaticContact CE2-CD2 3.28Å; F435-H444 WeakPolarHBondContact CE2-CD2 3.36Å; F435-H444 AromaticContact CE2-CG 3.61Å; F435-H444 HydrophobicContact CZ-CB 3.39Å; F435-H444 AromaticContact CZ-CD2 3.42Å; F435-H444 VanDerWaalsContact CZ-CD2 3.42Å; F435-H444 WeakPolarHBondContact CZ-CD2 3.27Å; F435-H444 AromaticContact CZ-CG 3.29Å; Q440-H444 WeakPolarHBondContact O-CB 3.17Å; Q440-H444 PolarHBondContact O-N 3.45Å; L441-H444 CarbonylContact O-C 3.59Å; L441-H444 WeakPolarHBondContact O-CA 3.42Å; L441-H444 WeakPolarHBondContact O-CB 3.22Å; L441-H444 PolarHBondContact O-N 2.76Å; I442-H444 VanDerWaalsContact C-N 3.27Å; I442-H444 PolarHBondContact O-N 2.71Å; H444-R446 PolarHBondContact O-N 2.65Å; H444-R446 VanDerWaalsContact O-N 3.12Å; H444-T447 PolarHBondContact CE1-OG1 3.5Å; H444-T447 PolarHBondContact ND1-OG1 3.15Å; H444-T447 WeakPolarHBondContact O-CB 3.43Å; H444-T447 PolarHBondContact O-N 3.03Å; H444-T447 PolarHBondContact O-OG1 3.11Å; H444-H448 AromaticContact CE1-NE2 3.43Å; H444-H448 PolarHBondContact CE1-NE2 3.43Å; H444-H448 AromaticContact NE2-CD2 3.87Å; H444-H448 AromaticContact NE2-NE2 3.14Å; H444-H448 PolarHBondContact NE2-NE2 2.96Å; H444-H448 VanDerWaalsContact NE2-NE2 3.14Å
445	Q	85.4	Confident	84.1	Confident	70 Å²	70	71.4 Å²	71.4	33%	0.327	36%	0.364	S	S	.	.	H	α-helix	trans	-58.1	-29.6	177.7	-75.4	173.3	-43.3	0	0	112.3	L441 I442 T447 H448 S449	L441-Q445 HydrophobicContact CD1-CG 4.1Å; L441-Q445 HydrophobicContact CG-CG 4.42Å; L441-Q445 WeakPolarHBondContact O-CG 3.46Å; L441-Q445 PolarHBondContact O-N 3.48Å; I442-Q445 PolarHBondContact O-N 3.2Å; Q445-T447 PolarHBondContact O-N 3.02Å; Q445-T447 VanDerWaalsContact O-N 3.14Å; Q445-H448 WeakPolarHBondContact O-CB 2.87Å; Q445-H448 PolarHBondContact O-N 3.09Å; Q445-S449 PolarHBondContact O-N 3.24Å
446	R	84.3	Confident	84.2	Confident	64 Å²	64	70.1 Å²	70.1	24%	0.242	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-5.3	171.4	-60.7	177.6	-175.9	-179.6	-2.3	115.3	I442 H444 S449 S464	I442-R446 PolarHBondContact O-N 3.43Å; H444-R446 PolarHBondContact O-N 2.65Å; H444-R446 VanDerWaalsContact O-N 3.12Å; R446-S449 WeakPolarHBondContact CA-OG 3.44Å; R446-S464 PolarHBondContact NH1-O 3.31Å; R446-S464 VanDerWaalsContact NH1-O 3.16Å
447	T	82	Confident	84.3	Confident	81 Å²	81	77 Å²	77	50%	0.497	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-21	169.1	68.2	0	0	0	0	111.8	H444 Q445	H444-T447 PolarHBondContact CE1-OG1 3.5Å; H444-T447 PolarHBondContact ND1-OG1 3.15Å; H444-T447 WeakPolarHBondContact O-CB 3.43Å; H444-T447 PolarHBondContact O-N 3.03Å; H444-T447 PolarHBondContact O-OG1 3.11Å; Q445-T447 PolarHBondContact O-N 3.02Å; Q445-T447 VanDerWaalsContact O-N 3.14Å
448	H	81.3	Confident	84.2	Confident	76 Å²	76	83.5 Å²	83.5	35%	0.352	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-34.3	175.3	-60.6	-57.8	0	0	0	111.4	L430 C431 H444 Q445	L430-H448 HydrophobicContact CB-CB 4.48Å; L430-H448 HydrophobicContact CD1-CB 3.48Å; L430-H448 VanDerWaalsContact CD1-CB 3.48Å; C431-H448 PolarHBondContact SG-NE2 3.42Å; C431-H448 VanDerWaalsContact SG-NE2 3.36Å; H444-H448 AromaticContact CE1-NE2 3.43Å; H444-H448 PolarHBondContact CE1-NE2 3.43Å; H444-H448 AromaticContact NE2-CD2 3.87Å; H444-H448 AromaticContact NE2-NE2 3.14Å; H444-H448 PolarHBondContact NE2-NE2 2.96Å; H444-H448 VanDerWaalsContact NE2-NE2 3.14Å; Q445-H448 WeakPolarHBondContact O-CB 2.87Å; Q445-H448 PolarHBondContact O-N 3.09Å
449	S	75.8	Confident	84.3	Confident	44 Å²	44	79.4 Å²	79.4	31%	0.308	41%	0.413	S	S	.	.	S	Bend	trans	-81.9	145.2	167.7	69	0	0	0	0	110.8	Q445 R446 E451	Q445-S449 PolarHBondContact O-N 3.24Å; R446-S449 WeakPolarHBondContact CA-OG 3.44Å; S449-E451 PolarHBondContact O-N 3.43Å
450	T	71.6	Confident	84.3	Confident	139 Å²	139	77.9 Å²	77.9	85%	0.853	41%	0.408	S	S	*	.			trans	-72.9	4	170.1	47.7	0	0	0	0	112.5	K452	T450-K452 PolarHBondContact O-N 3.21Å; T450-K452 VanDerWaalsContact O-N 3.11Å
451	E	76.5	Confident	84.3	Confident	125 Å²	125	79.7 Å²	79.7	58%	0.584	42%	0.415	S	S	*	.			trans	-63.4	112.8	179.2	-66.5	-176.5	167.8	0	0	111	S449 P453	S449-E451 PolarHBondContact O-N 3.43Å; E451-P453 WeakPolarHBondContact O-CD 3.43Å
452	K	82.6	Confident	84.3	Confident	124 Å²	124	80.4 Å²	80.4	54%	0.539	42%	0.424	S	S	.	.			trans	-120.6	80.2	174.3	-71.6	167.9	171.1	-175	0	108.7	T450 Y454 A462 Y463	T450-K452 PolarHBondContact O-N 3.21Å; T450-K452 VanDerWaalsContact O-N 3.11Å; K452-Y454 PolarHBondContact O-N 2.88Å; K452-A462 HydrophobicContact CB-CB 3.5Å; K452-A462 HydrophobicContact CD-CB 4.12Å; K452-A462 WeakPolarHBondContact CD-O 3.45Å; K452-A462 HydrophobicContact CG-CB 4.44Å; K452-Y463 CarbonylContact C-O 3.58Å; K452-Y463 WeakPolarHBondContact CA-O 3.23Å
453	P	85	Confident	84.3	Confident	77 Å²	77	79.6 Å²	79.6	50%	0.5	42%	0.416	S	S	.	.			trans	-69.3	-6.8	-169.5	-19.3	33	0	0	0	114.7	E451	E451-P453 WeakPolarHBondContact O-CD 3.43Å
454	Y	87.8	Confident	84.3	Confident	74 Å²	74	78.1 Å²	78.1	29%	0.29	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	93.5	-174.1	-54.8	-73.8	0	0	0	109.5	K452 A462 Y463 K466	K452-Y454 PolarHBondContact O-N 2.88Å; Y454-A462 CarbonylContact O-C 3.56Å; Y454-A462 WeakPolarHBondContact O-CA 3.49Å; Y454-Y463 WeakPolarHBondContact CD2-O 3.42Å; Y454-Y463 PolarHBondContact N-O 3.23Å; Y454-Y463 PolarHBondContact O-N 3.21Å; Y454-K466 HydrophobicContact CD1-CB 3.97Å; Y454-K466 HydrophobicContact CD1-CG 4.37Å; Y454-K466 VanDerWaalsContact CD2-N 3.32Å; Y454-K466 HydrophobicContact CE1-CB 3.78Å; Y454-K466 HydrophobicContact CE1-CG 4.36Å; Y454-K466 HydrophobicContact CE2-CB 4.33Å; Y454-K466 HydrophobicContact CG-CB 4.33Å
455	E	88.5	Confident	84.2	Confident	118 Å²	118	83.3 Å²	83.3	55%	0.551	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	142.6	178.2	-168	173.5	170.9	0	0	111.7
456	C	90.7	Very high	84.3	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	44%	0.44	C	S	.	.			trans	-87.1	114.2	171.2	179.4	0	0	0	0	109.9	E458 C459 G460 K461 L469	C456-E458 PolarHBondContact O-N 3.45Å; C456-E458 VanDerWaalsContact O-N 3.15Å; C456-C459 PolarHBondContact O-N 3.39Å; C456-C459 VanDerWaalsContact SG-SG 3.6Å; C456-G460 VanDerWaalsContact O-CA 3.31Å; C456-G460 WeakPolarHBondContact O-CA 3.46Å; C456-G460 PolarHBondContact O-N 2.93Å; C456-K461 WeakPolarHBondContact CB-O 3.27Å; C456-K461 PolarHBondContact N-O 3.19Å; C456-L469 HydrophobicContact CB-CD1 3.6Å
457	N	88.3	Confident	84.4	Confident	161 Å²	161	85.5 Å²	85.5	86%	0.861	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.4	-179.9	-61.2	-6.7	0	0	0	113.7
458	E	86.3	Confident	84.7	Confident	137 Å²	137	83.9 Å²	83.9	64%	0.64	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-24.8	-177.1	-67.1	171.2	159.3	0	0	113.4	C456 H476	C456-E458 PolarHBondContact O-N 3.45Å; C456-E458 VanDerWaalsContact O-N 3.15Å; E458-H476 WeakPolarHBondContact OE2-CB 3.26Å; E458-H476 IonicContact OE2-CD2 3.86Å; E458-H476 PolarHBondContact OE2-CD2 2.9Å; E458-H476 IonicContact OE2-CG 3.02Å; E458-H476 IonicContact OE2-NE2 3.94Å
459	C	88.2	Confident	85.1	Confident	52 Å²	52	81.1 Å²	81.1	35%	0.351	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.6	7.5	-176.4	73.1	0	0	0	0	115.2	C456 K461 H472 H476	C456-C459 PolarHBondContact O-N 3.39Å; C456-C459 VanDerWaalsContact SG-SG 3.6Å; C459-K461 PolarHBondContact O-N 3.45Å; C459-H472 PolarHBondContact SG-NE2 3.07Å; C459-H476 PolarHBondContact SG-NE2 3.39Å; C459-H476 VanDerWaalsContact SG-NE2 3.43Å
460	G	84.6	Confident	85.6	Confident	42 Å²	42	84.1 Å²	84.1	43%	0.433	44%	0.44	S	S	.	.			trans	67.3	0.4	179.5	0	0	0	0	0	115.2	C456 A462	C456-G460 VanDerWaalsContact O-CA 3.31Å; C456-G460 WeakPolarHBondContact O-CA 3.46Å; C456-G460 PolarHBondContact O-N 2.93Å; G460-A462 PolarHBondContact O-N 2.9Å
461	K	86.7	Confident	86.3	Confident	125 Å²	125	80.5 Å²	80.5	54%	0.543	42%	0.415	S	S	.	.			trans	-69.9	122.2	-179.4	-72	-179.2	-177.6	173.2	0	110.6	C456 C459 Y463	C456-K461 WeakPolarHBondContact CB-O 3.27Å; C456-K461 PolarHBondContact N-O 3.19Å; C459-K461 PolarHBondContact O-N 3.45Å; K461-Y463 HydrophobicContact CB-CE2 3.86Å; K461-Y463 WeakPolarHBondContact O-CD2 3.46Å; K461-Y463 VanDerWaalsContact O-CE2 3.28Å; K461-Y463 WeakPolarHBondContact O-CE2 3.4Å
462	A	87.8	Confident	86.9	Confident	34 Å²	34	75.2 Å²	75.2	28%	0.281	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	143.4	179.1	0	0	0	0	0	112.9	K452 Y454 G460	K452-A462 HydrophobicContact CB-CB 3.5Å; K452-A462 HydrophobicContact CD-CB 4.12Å; K452-A462 WeakPolarHBondContact CD-O 3.45Å; K452-A462 HydrophobicContact CG-CB 4.44Å; Y454-A462 CarbonylContact O-C 3.56Å; Y454-A462 WeakPolarHBondContact O-CA 3.49Å; G460-A462 PolarHBondContact O-N 2.9Å
463	Y	85.9	Confident	87.1	Confident	54 Å²	54	73.4 Å²	73.4	21%	0.212	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	148.5	-177	-61.2	-88.5	0	0	0	111.6	K452 Y454 K461 R465 L469 H472	K452-Y463 CarbonylContact C-O 3.58Å; K452-Y463 WeakPolarHBondContact CA-O 3.23Å; Y454-Y463 WeakPolarHBondContact CD2-O 3.42Å; Y454-Y463 PolarHBondContact N-O 3.23Å; Y454-Y463 PolarHBondContact O-N 3.21Å; K461-Y463 HydrophobicContact CB-CE2 3.86Å; K461-Y463 WeakPolarHBondContact O-CD2 3.46Å; K461-Y463 VanDerWaalsContact O-CE2 3.28Å; K461-Y463 WeakPolarHBondContact O-CE2 3.4Å; Y463-R465 VanDerWaalsContact C-N 3.32Å; Y463-L469 HydrophobicContact CD2-CB 3.99Å; Y463-L469 HydrophobicContact CD2-CD1 3.88Å; Y463-L469 HydrophobicContact CE2-CD1 4.11Å; Y463-L469 HydrophobicContact CG-CB 4.39Å; Y463-H472 HydrophobicContact CE1-CB 4.23Å; Y463-H472 HydrophobicContact CE2-CB 3.86Å; Y463-H472 AromaticContact CE2-CD2 3.54Å; Y463-H472 AromaticContact CE2-CG 3.7Å; Y463-H472 AromaticContact CZ-CD2 3.78Å; Y463-H472 AromaticContact CZ-CG 3.48Å; Y463-H472 VanDerWaalsContact CZ-CG 3.48Å; Y463-H472 WeakPolarHBondContact OH-CB 3.31Å; Y463-H472 PolarHBondContact OH-CD2 3.4Å; Y463-H472 PolarHBondContact OH-CE1 3.38Å; Y463-H472 PolarHBondContact OH-ND1 3.11Å
464	S	84.3	Confident	87.3	Confident	31 Å²	31	72.2 Å²	72.2	22%	0.217	37%	0.371	C	S	.	.	S	Bend	trans	-78.8	-14.9	177.2	58.7	0	0	0	0	113.6	R446	R446-S464 PolarHBondContact NH1-O 3.31Å; R446-S464 VanDerWaalsContact NH1-O 3.16Å
465	R	85.4	Confident	87.2	Confident	121 Å²	121	74.1 Å²	74.1	46%	0.457	38%	0.384	S	S	.	.	S	Bend	trans	-134	137.9	-178.2	-59.4	179.5	-173.2	172.3	0.8	111.4	I443 Y463 A467 S468 L469	I443-R465 HydrophobicContact CG2-CG 4.2Å; Y463-R465 VanDerWaalsContact C-N 3.32Å; R465-A467 VanDerWaalsContact C-N 3.31Å; R465-A467 PolarHBondContact O-N 3.21Å; R465-S468 WeakPolarHBondContact O-CB 3.26Å; R465-S468 PolarHBondContact O-N 3.15Å; R465-S468 VanDerWaalsContact O-N 3.1Å; R465-L469 PolarHBondContact O-N 3.46Å
466	K	86.9	Confident	87	Confident	124 Å²	124	72.1 Å²	72.1	54%	0.539	38%	0.375	S	S	.	.	H	α-helix	trans	-58.3	-39.9	175.9	-173.1	173.5	-179.4	174.3	0	113	Y454 S468 L469 Q470	Y454-K466 HydrophobicContact CD1-CB 3.97Å; Y454-K466 HydrophobicContact CD1-CG 4.37Å; Y454-K466 VanDerWaalsContact CD2-N 3.32Å; Y454-K466 HydrophobicContact CE1-CB 3.78Å; Y454-K466 HydrophobicContact CE1-CG 4.36Å; Y454-K466 HydrophobicContact CE2-CB 4.33Å; Y454-K466 HydrophobicContact CG-CB 4.33Å; K466-S468 VanDerWaalsContact C-N 3.26Å; K466-S468 PolarHBondContact O-N 2.78Å; K466-L469 WeakPolarHBondContact O-CB 3.43Å; K466-L469 PolarHBondContact O-N 3.41Å; K466-Q470 WeakPolarHBondContact O-CG 3.41Å; K466-Q470 PolarHBondContact O-N 3.45Å
467	A	85.8	Confident	86.8	Confident	56 Å²	56	75.3 Å²	75.3	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-61.6	-35.5	177.9	0	0	0	0	0	112.3	R465 Q470 I471	R465-A467 VanDerWaalsContact C-N 3.31Å; R465-A467 PolarHBondContact O-N 3.21Å; A467-Q470 PolarHBondContact O-N 3.37Å; A467-I471 VanDerWaalsContact O-CG1 3.28Å; A467-I471 WeakPolarHBondContact O-CG1 3.4Å; A467-I471 PolarHBondContact O-N 2.8Å
468	S	87.9	Confident	86.5	Confident	47 Å²	47	70 Å²	70	33%	0.329	38%	0.38	S	S	.	.	H	α-helix	trans	-67.7	-41	176.2	-58.2	0	0	0	0	111.5	R465 K466 I471 H472	R465-S468 WeakPolarHBondContact O-CB 3.26Å; R465-S468 PolarHBondContact O-N 3.15Å; R465-S468 VanDerWaalsContact O-N 3.1Å; K466-S468 VanDerWaalsContact C-N 3.26Å; K466-S468 PolarHBondContact O-N 2.78Å; S468-I471 PolarHBondContact O-N 3.5Å; S468-H472 WeakPolarHBondContact O-CB 3.38Å; S468-H472 PolarHBondContact O-N 2.9Å
469	L	90.4	Very high	86.4	Confident	18 Å²	18	68.8 Å²	68.8	9%	0.094	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-46.2	171.9	175.2	63.6	0	0	0	111.4	C456 Y463 R465 K466 I471 H472 Q473	C456-L469 HydrophobicContact CB-CD1 3.6Å; Y463-L469 HydrophobicContact CD2-CB 3.99Å; Y463-L469 HydrophobicContact CD2-CD1 3.88Å; Y463-L469 HydrophobicContact CE2-CD1 4.11Å; Y463-L469 HydrophobicContact CG-CB 4.39Å; R465-L469 PolarHBondContact O-N 3.46Å; K466-L469 WeakPolarHBondContact O-CB 3.43Å; K466-L469 PolarHBondContact O-N 3.41Å; L469-I471 VanDerWaalsContact C-N 3.32Å; L469-I471 PolarHBondContact O-N 3.05Å; L469-H472 CarbonylContact O-C 3.57Å; L469-H472 WeakPolarHBondContact O-CA 3.32Å; L469-H472 WeakPolarHBondContact O-CB 3.19Å; L469-H472 PolarHBondContact O-N 3.43Å; L469-H472 VanDerWaalsContact O-N 3.08Å; L469-Q473 HydrophobicContact CD1-CG 4.17Å; L469-Q473 HydrophobicContact CG-CG 4.38Å; L469-Q473 WeakPolarHBondContact O-CG 3.47Å; L469-Q473 PolarHBondContact O-N 3.48Å
470	Q	87.1	Confident	86.3	Confident	107 Å²	107	72 Å²	72	50%	0.5	38%	0.383	S	S	.	.	H	α-helix	trans	-61.4	-39.1	178.8	-73.5	-175.2	-46.6	0	0	112.9	K466 A467 H472	K466-Q470 WeakPolarHBondContact O-CG 3.41Å; K466-Q470 PolarHBondContact O-N 3.45Å; A467-Q470 PolarHBondContact O-N 3.37Å; Q470-H472 VanDerWaalsContact C-N 3.33Å
471	I	86.1	Confident	86.5	Confident	64 Å²	64	73.5 Å²	73.5	33%	0.328	38%	0.384	S	S	.	.	H	α-helix	trans	-66.1	-40.9	174.2	-70.6	166.3	0	0	0	110.4	A467 S468 L469 K474 Q493	A467-I471 VanDerWaalsContact O-CG1 3.28Å; A467-I471 WeakPolarHBondContact O-CG1 3.4Å; A467-I471 PolarHBondContact O-N 2.8Å; S468-I471 PolarHBondContact O-N 3.5Å; L469-I471 VanDerWaalsContact C-N 3.32Å; L469-I471 PolarHBondContact O-N 3.05Å; I471-K474 WeakPolarHBondContact O-CB 3.33Å; I471-K474 PolarHBondContact O-N 3.3Å; I471-Q493 HydrophobicContact CG2-CG 3.86Å
472	H	88	Confident	86.6	Confident	14 Å²	14	70.6 Å²	70.6	7%	0.065	37%	0.372	C	S	.	.	H	α-helix	trans	-64.8	-41.2	177.8	170.5	63.8	0	0	0	112.5	C459 Y463 S468 L469 Q470 K474 I475 H476	C459-H472 PolarHBondContact SG-NE2 3.07Å; Y463-H472 HydrophobicContact CE1-CB 4.23Å; Y463-H472 HydrophobicContact CE2-CB 3.86Å; Y463-H472 AromaticContact CE2-CD2 3.54Å; Y463-H472 AromaticContact CE2-CG 3.7Å; Y463-H472 AromaticContact CZ-CD2 3.78Å; Y463-H472 AromaticContact CZ-CG 3.48Å; Y463-H472 VanDerWaalsContact CZ-CG 3.48Å; Y463-H472 WeakPolarHBondContact OH-CB 3.31Å; Y463-H472 PolarHBondContact OH-CD2 3.4Å; Y463-H472 PolarHBondContact OH-CE1 3.38Å; Y463-H472 PolarHBondContact OH-ND1 3.11Å; S468-H472 WeakPolarHBondContact O-CB 3.38Å; S468-H472 PolarHBondContact O-N 2.9Å; L469-H472 CarbonylContact O-C 3.57Å; L469-H472 WeakPolarHBondContact O-CA 3.32Å; L469-H472 WeakPolarHBondContact O-CB 3.19Å; L469-H472 PolarHBondContact O-N 3.43Å; L469-H472 VanDerWaalsContact O-N 3.08Å; Q470-H472 VanDerWaalsContact C-N 3.33Å; H472-K474 PolarHBondContact O-N 3.05Å; H472-K474 VanDerWaalsContact O-N 3.13Å; H472-I475 WeakPolarHBondContact O-CB 3.44Å; H472-I475 WeakPolarHBondContact O-CG1 3.44Å; H472-I475 PolarHBondContact O-N 3.25Å; H472-H476 AromaticContact CD2-NE2 3.96Å; H472-H476 AromaticContact CE1-NE2 3.47Å; H472-H476 PolarHBondContact CE1-NE2 2.72Å; H472-H476 AromaticContact NE2-CD2 3.84Å; H472-H476 AromaticContact NE2-CE1 4Å; H472-H476 AromaticContact NE2-NE2 3.07Å; H472-H476 PolarHBondContact NE2-NE2 3.29Å
473	Q	87.8	Confident	86.5	Confident	85 Å²	85	76 Å²	76	40%	0.397	39%	0.389	S	S	.	.	H	α-helix	trans	-57.8	-27.6	177.5	-75.5	174.3	-45.4	0	0	112.9	L469 I475 H476 S477	L469-Q473 HydrophobicContact CD1-CG 4.17Å; L469-Q473 HydrophobicContact CG-CG 4.38Å; L469-Q473 WeakPolarHBondContact O-CG 3.47Å; L469-Q473 PolarHBondContact O-N 3.48Å; Q473-I475 PolarHBondContact O-N 2.98Å; Q473-H476 PolarHBondContact O-N 3.33Å; Q473-H476 VanDerWaalsContact O-N 3.12Å; Q473-S477 PolarHBondContact O-N 3.34Å; Q473-S477 VanDerWaalsContact O-N 3.07Å
474	K	88.7	Confident	86.8	Confident	53 Å²	53	73.6 Å²	73.6	23%	0.23	38%	0.38	C	S	.	.	H	α-helix	trans	-65.5	-18	174.1	-63.3	-178.8	179.8	-171.4	0	114.2	I471 H472 S477 G478 E479 T492	I471-K474 WeakPolarHBondContact O-CB 3.33Å; I471-K474 PolarHBondContact O-N 3.3Å; H472-K474 PolarHBondContact O-N 3.05Å; H472-K474 VanDerWaalsContact O-N 3.13Å; K474-S477 WeakPolarHBondContact CA-OG 3.46Å; K474-G478 PolarHBondContact O-N 3.04Å; K474-G478 VanDerWaalsContact O-N 3.15Å; K474-E479 PolarHBondContact O-N 3.33Å; K474-T492 HydrophobicContact CB-CG2 4.45Å
475	I	85.4	Confident	86.9	Confident	113 Å²	113	79.7 Å²	79.7	58%	0.579	41%	0.411	S	S	*	.	H	α-helix	trans	-70.6	-41.7	174.2	-58.8	176.6	0	0	0	109.4	H472 Q473	H472-I475 WeakPolarHBondContact O-CB 3.44Å; H472-I475 WeakPolarHBondContact O-CG1 3.44Å; H472-I475 PolarHBondContact O-N 3.25Å; Q473-I475 PolarHBondContact O-N 2.98Å
476	H	85.3	Confident	86.9	Confident	77 Å²	77	80.1 Å²	80.1	36%	0.356	42%	0.417	S	S	.	.	H	α-helix	trans	-75.1	-41.2	179.8	-58.1	-53.3	0	0	0	112	E458 C459 H472 Q473 G478	E458-H476 WeakPolarHBondContact OE2-CB 3.26Å; E458-H476 IonicContact OE2-CD2 3.86Å; E458-H476 PolarHBondContact OE2-CD2 2.9Å; E458-H476 IonicContact OE2-CG 3.02Å; E458-H476 IonicContact OE2-NE2 3.94Å; C459-H476 PolarHBondContact SG-NE2 3.39Å; C459-H476 VanDerWaalsContact SG-NE2 3.43Å; H472-H476 AromaticContact CD2-NE2 3.96Å; H472-H476 AromaticContact CE1-NE2 3.47Å; H472-H476 PolarHBondContact CE1-NE2 2.72Å; H472-H476 AromaticContact NE2-CD2 3.84Å; H472-H476 AromaticContact NE2-CE1 4Å; H472-H476 AromaticContact NE2-NE2 3.07Å; H472-H476 PolarHBondContact NE2-NE2 3.29Å; Q473-H476 PolarHBondContact O-N 3.33Å; Q473-H476 VanDerWaalsContact O-N 3.12Å; H476-G478 PolarHBondContact O-N 3.18Å
477	S	85.1	Confident	87	Confident	67 Å²	67	76.7 Å²	76.7	47%	0.469	41%	0.409	S	S	.	.	S	Bend	trans	-73.7	-12.2	176.1	70.1	0	0	0	0	114	Q473 K474 E479	Q473-S477 PolarHBondContact O-N 3.34Å; Q473-S477 VanDerWaalsContact O-N 3.07Å; K474-S477 WeakPolarHBondContact CA-OG 3.46Å; S477-E479 PolarHBondContact O-N 2.77Å; S477-E479 VanDerWaalsContact O-N 3.12Å; S477-E479 WeakPolarHBondContact OG-CB 3.49Å; S477-E479 WeakPolarHBondContact OG-CG 3.26Å; S477-E479 PolarHBondContact OG-N 3.42Å
478	G	82.9	Confident	86.9	Confident	48 Å²	48	76.7 Å²	76.7	50%	0.495	41%	0.414	S	S	.	.			trans	66.8	4.9	-174.3	0	0	0	0	0	114.6	K474 H476 K480	K474-G478 PolarHBondContact O-N 3.04Å; K474-G478 VanDerWaalsContact O-N 3.15Å; H476-G478 PolarHBondContact O-N 3.18Å; G478-K480 PolarHBondContact O-N 3.2Å; G478-K480 VanDerWaalsContact O-N 3.16Å
479	E	84	Confident	86.9	Confident	113 Å²	113	80.7 Å²	80.7	53%	0.528	43%	0.426	S	S	.	.			trans	-62.6	116.5	-178.8	-76.6	-178.4	-172.3	0	0	111.4	K474 S477 P481	K474-E479 PolarHBondContact O-N 3.33Å; S477-E479 PolarHBondContact O-N 2.77Å; S477-E479 VanDerWaalsContact O-N 3.12Å; S477-E479 WeakPolarHBondContact OG-CB 3.49Å; S477-E479 WeakPolarHBondContact OG-CG 3.26Å; S477-E479 PolarHBondContact OG-N 3.42Å; E479-P481 WeakPolarHBondContact O-CD 3.35Å
480	K	86.9	Confident	86.8	Confident	119 Å²	119	81.3 Å²	81.3	52%	0.517	43%	0.434	S	S	.	.			trans	-119.9	78	175.1	-68.8	170	178.2	-179.8	0	110.6	G478 F482 A490 F491 T492	G478-K480 PolarHBondContact O-N 3.2Å; G478-K480 VanDerWaalsContact O-N 3.16Å; K480-F482 PolarHBondContact O-N 3.07Å; K480-A490 HydrophobicContact CB-CB 3.6Å; K480-A490 HydrophobicContact CD-CB 4.15Å; K480-A490 WeakPolarHBondContact CD-O 3.33Å; K480-A490 HydrophobicContact CG-CB 4.47Å; K480-F491 CarbonylContact C-O 3.54Å; K480-F491 WeakPolarHBondContact CA-O 3.45Å; K480-T492 HydrophobicContact CG-CG2 3.95Å
481	P	87.3	Confident	86.8	Confident	73 Å²	73	78.4 Å²	78.4	47%	0.474	42%	0.42	S	S	.	.			trans	-67.9	-18.6	-172.1	-20.3	33.5	0	0	0	114.1	E479	E479-P481 WeakPolarHBondContact O-CD 3.35Å
482	F	88.8	Confident	86.8	Confident	65 Å²	65	77 Å²	77	29%	0.285	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	97.3	-171.7	-57.5	-74.8	0	0	0	110.1	K480 A490 F491 Q493 K494 L497	K480-F482 PolarHBondContact O-N 3.07Å; F482-A490 CarbonylContact O-C 3.59Å; F482-A490 WeakPolarHBondContact O-CA 3.25Å; F482-F491 HydrophobicContact CB-CB 4.46Å; F482-F491 PolarHBondContact N-O 2.83Å; F482-F491 PolarHBondContact O-N 2.86Å; F482-Q493 VanDerWaalsContact CD2-C 3.4Å; F482-K494 HydrophobicContact CD1-CB 3.97Å; F482-K494 HydrophobicContact CD1-CG 4.35Å; F482-K494 HydrophobicContact CE1-CB 3.75Å; F482-K494 HydrophobicContact CE1-CG 4.29Å; F482-K494 HydrophobicContact CE2-CB 4.36Å; F482-K494 HydrophobicContact CG-CB 4.38Å; F482-K494 HydrophobicContact CZ-CB 3.95Å; F482-L497 HydrophobicContact CB-CB 4.1Å; F482-L497 HydrophobicContact CB-CD2 3.87Å
483	K	87.5	Confident	86.7	Confident	147 Å²	147	79.7 Å²	79.7	64%	0.639	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	139.4	178	-63.4	-176.6	179.8	-179.4	0	111.1	A490	K483-A490 HydrophobicContact CG-CB 3.93Å
484	C	90.7	Very high	86.6	Confident	3 Å²	3	83.1 Å²	83.1	2%	0.02	44%	0.44	C	S	.	.			trans	-81.4	123.7	170.6	-175.1	0	0	0	0	109.4	E486 C487 G488 K489 L497	C484-E486 VanDerWaalsContact C-N 3.28Å; C484-E486 PolarHBondContact O-N 3.11Å; C484-C487 VanDerWaalsContact SG-SG 3.62Å; C484-G488 WeakPolarHBondContact O-CA 3.28Å; C484-G488 PolarHBondContact O-N 2.82Å; C484-K489 WeakPolarHBondContact CB-O 3.47Å; C484-K489 PolarHBondContact N-O 3.32Å; C484-L497 HydrophobicContact CB-CD1 3.65Å
485	N	87.6	Confident	86.5	Confident	160 Å²	160	83.9 Å²	83.9	86%	0.856	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-25.2	-178.5	-65.8	-10.1	0	0	0	112.6
486	E	85.9	Confident	86.5	Confident	129 Å²	129	80.2 Å²	80.2	60%	0.603	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-29.9	-175.5	-66.8	171.8	157.2	0	0	113.3	C484 H504	C484-E486 VanDerWaalsContact C-N 3.28Å; C484-E486 PolarHBondContact O-N 3.11Å; E486-H504 WeakPolarHBondContact OE2-CB 3.31Å; E486-H504 IonicContact OE2-CD2 2.9Å; E486-H504 PolarHBondContact OE2-CD2 3.06Å; E486-H504 IonicContact OE2-CG 3.04Å; E486-H504 IonicContact OE2-NE2 3.9Å
487	C	87.8	Confident	86.6	Confident	52 Å²	52	77.4 Å²	77.4	35%	0.351	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.9	5.1	-175.9	73.5	0	0	0	0	114.6	C484 K489 H500 H504	C484-C487 VanDerWaalsContact SG-SG 3.62Å; C487-K489 PolarHBondContact O-N 3.45Å; C487-H500 PolarHBondContact SG-NE2 3.24Å; C487-H504 PolarHBondContact SG-NE2 2.93Å
488	G	84.3	Confident	86.6	Confident	57 Å²	57	75.5 Å²	75.5	59%	0.588	42%	0.415	S	S	*	.			trans	70.3	-7.3	178.7	0	0	0	0	0	115.8	C484 A490	C484-G488 WeakPolarHBondContact O-CA 3.28Å; C484-G488 PolarHBondContact O-N 2.82Å; G488-A490 PolarHBondContact O-N 3.17Å
489	K	87.1	Confident	86.6	Confident	130 Å²	130	78.1 Å²	78.1	57%	0.565	41%	0.414	S	S	*	.			trans	-62.8	132.1	-179	-71.5	-177.1	-180	178.8	0	111.3	C484 C487 F491	C484-K489 WeakPolarHBondContact CB-O 3.47Å; C484-K489 PolarHBondContact N-O 3.32Å; C487-K489 PolarHBondContact O-N 3.45Å; K489-F491 HydrophobicContact CB-CE2 3.88Å; K489-F491 HydrophobicContact CB-CZ 4.06Å; K489-F491 WeakPolarHBondContact O-CE2 3.34Å
490	A	88.8	Confident	86.7	Confident	32 Å²	32	74 Å²	74	26%	0.264	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	141.8	-177.7	0	0	0	0	0	112	K480 F482 K483 G488	K480-A490 HydrophobicContact CB-CB 3.6Å; K480-A490 HydrophobicContact CD-CB 4.15Å; K480-A490 WeakPolarHBondContact CD-O 3.33Å; K480-A490 HydrophobicContact CG-CB 4.47Å; F482-A490 CarbonylContact O-C 3.59Å; F482-A490 WeakPolarHBondContact O-CA 3.25Å; K483-A490 HydrophobicContact CG-CB 3.93Å; G488-A490 PolarHBondContact O-N 3.17Å
491	F	87.4	Confident	86.6	Confident	46 Å²	46	72.4 Å²	72.4	20%	0.202	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.2	-175.5	-59.2	-90.6	0	0	0	111.3	K480 F482 K489 L497 H500	K480-F491 CarbonylContact C-O 3.54Å; K480-F491 WeakPolarHBondContact CA-O 3.45Å; F482-F491 HydrophobicContact CB-CB 4.46Å; F482-F491 PolarHBondContact N-O 2.83Å; F482-F491 PolarHBondContact O-N 2.86Å; K489-F491 HydrophobicContact CB-CE2 3.88Å; K489-F491 HydrophobicContact CB-CZ 4.06Å; K489-F491 WeakPolarHBondContact O-CE2 3.34Å; F491-L497 HydrophobicContact CB-CB 4.43Å; F491-L497 HydrophobicContact CD2-CB 4.02Å; F491-L497 HydrophobicContact CD2-CD1 3.85Å; F491-L497 HydrophobicContact CE2-CD1 4.02Å; F491-L497 HydrophobicContact CG-CB 4.41Å; F491-H500 HydrophobicContact CE1-CB 4.03Å; F491-H500 HydrophobicContact CE2-CB 3.83Å; F491-H500 AromaticContact CE2-CD2 3.53Å; F491-H500 AromaticContact CE2-CG 3.63Å; F491-H500 HydrophobicContact CZ-CB 3.43Å; F491-H500 VanDerWaalsContact CZ-CB 3.43Å; F491-H500 AromaticContact CZ-CD2 3.63Å; F491-H500 AromaticContact CZ-CG 3.26Å; F491-H500 AromaticContact CZ-ND1 3.76Å
492	T	85.7	Confident	86.4	Confident	35 Å²	35	72.4 Å²	72.4	22%	0.215	38%	0.38	C	S	.	.	S	Bend	trans	-78.6	-22.5	178.1	56.7	0	0	0	0	112.8	K474 K480	K474-T492 HydrophobicContact CB-CG2 4.45Å; K480-T492 HydrophobicContact CG-CG2 3.95Å
493	Q	86.3	Confident	86.1	Confident	69 Å²	69	72.8 Å²	72.8	32%	0.322	39%	0.387	S	S	.	.	S	Bend	trans	-130.1	144.7	-177.7	-59.7	179.5	40.6	0	0	112.1	I471 F482 S495 S496 L497	I471-Q493 HydrophobicContact CG2-CG 3.86Å; F482-Q493 VanDerWaalsContact CD2-C 3.4Å; Q493-S495 VanDerWaalsContact C-N 3.34Å; Q493-S495 PolarHBondContact O-N 3.43Å; Q493-S495 PolarHBondContact OE1-OG 3.44Å; Q493-S496 PolarHBondContact O-N 2.98Å; Q493-L497 PolarHBondContact O-N 3.45Å
494	K	86.4	Confident	85.8	Confident	157 Å²	157	69.2 Å²	69.2	68%	0.683	37%	0.373	S	S	*	.	H	α-helix	trans	-64.5	-35.7	176.8	-172.5	175.8	179.9	176.8	0	112.9	F482 S496 L497 G498	F482-K494 HydrophobicContact CD1-CB 3.97Å; F482-K494 HydrophobicContact CD1-CG 4.35Å; F482-K494 HydrophobicContact CE1-CB 3.75Å; F482-K494 HydrophobicContact CE1-CG 4.29Å; F482-K494 HydrophobicContact CE2-CB 4.36Å; F482-K494 HydrophobicContact CG-CB 4.38Å; F482-K494 HydrophobicContact CZ-CB 3.95Å; K494-S496 VanDerWaalsContact C-N 3.35Å; K494-L497 PolarHBondContact O-N 3.16Å; K494-G498 PolarHBondContact O-N 3.23Å
495	S	85.1	Confident	85.4	Confident	69 Å²	69	72.6 Å²	72.6	48%	0.483	39%	0.394	S	S	.	.	H	α-helix	trans	-60	-44.9	175.3	42.9	0	0	0	0	111.5	Q493 L497 G498 E499	Q493-S495 VanDerWaalsContact C-N 3.34Å; Q493-S495 PolarHBondContact O-N 3.43Å; Q493-S495 PolarHBondContact OE1-OG 3.44Å; S495-L497 VanDerWaalsContact C-N 3.35Å; S495-L497 PolarHBondContact O-N 3.14Å; S495-G498 PolarHBondContact O-N 3.06Å; S495-E499 WeakPolarHBondContact O-CG 3.25Å; S495-E499 PolarHBondContact O-N 3.32Å
496	S	86.5	Confident	84.7	Confident	36 Å²	36	75 Å²	75	25%	0.252	39%	0.391	S	S	.	.	H	α-helix	trans	-64	-38.5	177	-53.6	0	0	0	0	112.3	Q493 K494 H500	Q493-S496 PolarHBondContact O-N 2.98Å; K494-S496 VanDerWaalsContact C-N 3.35Å; S496-H500 VanDerWaalsContact O-CB 3.28Å; S496-H500 WeakPolarHBondContact O-CB 3.28Å; S496-H500 PolarHBondContact O-N 3.13Å
497	L	87.8	Confident	84.2	Confident	18 Å²	18	74.1 Å²	74.1	9%	0.094	39%	0.387	C	S	.	.	H	α-helix	trans	-62.8	-46.2	171.2	174.6	62.7	0	0	0	111.3	F482 C484 F491 Q493 K494 S495 E499 H500 Q501	F482-L497 HydrophobicContact CB-CB 4.1Å; F482-L497 HydrophobicContact CB-CD2 3.87Å; C484-L497 HydrophobicContact CB-CD1 3.65Å; F491-L497 HydrophobicContact CB-CB 4.43Å; F491-L497 HydrophobicContact CD2-CB 4.02Å; F491-L497 HydrophobicContact CD2-CD1 3.85Å; F491-L497 HydrophobicContact CE2-CD1 4.02Å; F491-L497 HydrophobicContact CG-CB 4.41Å; Q493-L497 PolarHBondContact O-N 3.45Å; K494-L497 PolarHBondContact O-N 3.16Å; S495-L497 VanDerWaalsContact C-N 3.35Å; S495-L497 PolarHBondContact O-N 3.14Å; L497-E499 VanDerWaalsContact C-N 3.35Å; L497-E499 PolarHBondContact O-N 2.97Å; L497-H500 CarbonylContact O-C 3.56Å; L497-H500 WeakPolarHBondContact O-CB 3.38Å; L497-H500 PolarHBondContact O-N 3.25Å; L497-H500 VanDerWaalsContact O-N 3.12Å; L497-Q501 HydrophobicContact CD1-CG 4.23Å; L497-Q501 HydrophobicContact CG-CG 4.45Å; L497-Q501 WeakPolarHBondContact O-CG 3.33Å; L497-Q501 PolarHBondContact O-N 3.23Å
498	G	84.6	Confident	83.9	Confident	27 Å²	27	77.3 Å²	77.3	28%	0.278	40%	0.395	S	S	.	.	H	α-helix	trans	-63.4	-37.5	178.4	0	0	0	0	0	113.4	K494 S495 H500	K494-G498 PolarHBondContact O-N 3.23Å; S495-G498 PolarHBondContact O-N 3.06Å; G498-H500 VanDerWaalsContact C-N 3.34Å
499	E	82.8	Confident	83.8	Confident	103 Å²	103	78.1 Å²	78.1	48%	0.481	39%	0.39	S	S	.	.	H	α-helix	trans	-66.5	-37.3	171.7	-74.1	-179.1	164.4	0	0	112	S495 L497 R502	S495-E499 WeakPolarHBondContact O-CG 3.25Å; S495-E499 PolarHBondContact O-N 3.32Å; L497-E499 VanDerWaalsContact C-N 3.35Å; L497-E499 PolarHBondContact O-N 2.97Å; E499-R502 WeakPolarHBondContact O-CB 3.4Å; E499-R502 PolarHBondContact O-N 3.37Å
500	H	85.4	Confident	83.5	Confident	27 Å²	27	76.3 Å²	76.3	13%	0.125	38%	0.379	C	S	.	.	H	α-helix	trans	-67.7	-40.1	176	172.9	65.9	0	0	0	112.5	C487 F491 S496 L497 G498 R502 V503 H504	C487-H500 PolarHBondContact SG-NE2 3.24Å; F491-H500 HydrophobicContact CE1-CB 4.03Å; F491-H500 HydrophobicContact CE2-CB 3.83Å; F491-H500 AromaticContact CE2-CD2 3.53Å; F491-H500 AromaticContact CE2-CG 3.63Å; F491-H500 HydrophobicContact CZ-CB 3.43Å; F491-H500 VanDerWaalsContact CZ-CB 3.43Å; F491-H500 AromaticContact CZ-CD2 3.63Å; F491-H500 AromaticContact CZ-CG 3.26Å; F491-H500 AromaticContact CZ-ND1 3.76Å; S496-H500 VanDerWaalsContact O-CB 3.28Å; S496-H500 WeakPolarHBondContact O-CB 3.28Å; S496-H500 PolarHBondContact O-N 3.13Å; L497-H500 CarbonylContact O-C 3.56Å; L497-H500 WeakPolarHBondContact O-CB 3.38Å; L497-H500 PolarHBondContact O-N 3.25Å; L497-H500 VanDerWaalsContact O-N 3.12Å; G498-H500 VanDerWaalsContact C-N 3.34Å; H500-R502 PolarHBondContact O-N 2.95Å; H500-R502 VanDerWaalsContact O-N 3.12Å; H500-V503 VanDerWaalsContact O-CB 3.25Å; H500-V503 WeakPolarHBondContact O-CB 3.5Å; H500-V503 WeakPolarHBondContact O-CG2 3.41Å; H500-V503 PolarHBondContact O-N 3.49Å; H500-H504 AromaticContact CE1-NE2 3.81Å; H500-H504 AromaticContact NE2-CD2 3.97Å; H500-H504 AromaticContact NE2-NE2 3.26Å; H500-H504 PolarHBondContact NE2-NE2 3.41Å
501	Q	84.9	Confident	83.3	Confident	86 Å²	86	81.5 Å²	81.5	40%	0.402	40%	0.396	S	S	.	.	H	α-helix	trans	-58	-26.7	177.9	-76	174.3	-45.6	0	0	112.7	L497 V503 H504 T505	L497-Q501 HydrophobicContact CD1-CG 4.23Å; L497-Q501 HydrophobicContact CG-CG 4.45Å; L497-Q501 WeakPolarHBondContact O-CG 3.33Å; L497-Q501 PolarHBondContact O-N 3.23Å; Q501-V503 PolarHBondContact O-N 3.39Å; Q501-H504 PolarHBondContact O-N 2.93Å; Q501-T505 PolarHBondContact O-N 3.4Å; Q501-T505 VanDerWaalsContact O-N 3.14Å
502	R	83.1	Confident	83.4	Confident	72 Å²	72	79.3 Å²	79.3	27%	0.272	39%	0.386	S	S	.	.	H	α-helix	trans	-64.6	-19.9	174.3	-63	-179.5	-175.6	157.6	3.8	114.4	E499 H500 H504 T505 R506	E499-R502 WeakPolarHBondContact O-CB 3.4Å; E499-R502 PolarHBondContact O-N 3.37Å; H500-R502 PolarHBondContact O-N 2.95Å; H500-R502 VanDerWaalsContact O-N 3.12Å; R502-H504 VanDerWaalsContact C-N 3.29Å; R502-T505 WeakPolarHBondContact CA-OG1 3.43Å; R502-R506 WeakPolarHBondContact O-CA 3.47Å; R502-R506 PolarHBondContact O-N 3.17Å; R502-R506 VanDerWaalsContact O-N 3.09Å
503	V	82.3	Confident	83.4	Confident	73 Å²	73	82.1 Å²	82.1	44%	0.442	41%	0.407	S	S	.	.	H	α-helix	trans	-67.6	-36.9	174.2	-179.7	0	0	0	0	110.1	H500 Q501 W521	H500-V503 VanDerWaalsContact O-CB 3.25Å; H500-V503 WeakPolarHBondContact O-CB 3.5Å; H500-V503 WeakPolarHBondContact O-CG2 3.41Å; H500-V503 PolarHBondContact O-N 3.49Å; Q501-V503 PolarHBondContact O-N 3.39Å; V503-W521 HydrophobicContact CG2-CZ2 4.43Å
504	H	82.6	Confident	83.3	Confident	72 Å²	72	84.6 Å²	84.6	33%	0.333	42%	0.419	S	S	.	.	H	α-helix	trans	-81.1	-40.6	-179.2	-58.9	-52.5	0	0	0	111.9	E486 C487 H500 Q501 R502 R506	E486-H504 WeakPolarHBondContact OE2-CB 3.31Å; E486-H504 IonicContact OE2-CD2 2.9Å; E486-H504 PolarHBondContact OE2-CD2 3.06Å; E486-H504 IonicContact OE2-CG 3.04Å; E486-H504 IonicContact OE2-NE2 3.9Å; C487-H504 PolarHBondContact SG-NE2 2.93Å; H500-H504 AromaticContact CE1-NE2 3.81Å; H500-H504 AromaticContact NE2-CD2 3.97Å; H500-H504 AromaticContact NE2-NE2 3.26Å; H500-H504 PolarHBondContact NE2-NE2 3.41Å; Q501-H504 PolarHBondContact O-N 2.93Å; R502-H504 VanDerWaalsContact C-N 3.29Å; H504-R506 PolarHBondContact O-N 2.91Å
505	T	80.3	Confident	83.3	Confident	74 Å²	74	79.7 Å²	79.7	45%	0.454	40%	0.403	S	S	.	.	H	α-helix	trans	-76.2	-9.1	176.8	64.9	0	0	0	0	113.7	Q501 R502 E507	Q501-T505 PolarHBondContact O-N 3.4Å; Q501-T505 VanDerWaalsContact O-N 3.14Å; R502-T505 WeakPolarHBondContact CA-OG1 3.43Å; T505-E507 PolarHBondContact O-N 2.81Å; T505-E507 WeakPolarHBondContact OG1-CG 3.35Å
506	R	73.2	Confident	83.2	Confident	210 Å²	210	78 Å²	78	79%	0.792	40%	0.397	S	S	*	.			trans	52.1	20	-173.1	-62.4	-175.6	176.8	-173	0.5	114.3	R502 H504 K508	R502-R506 WeakPolarHBondContact O-CA 3.47Å; R502-R506 PolarHBondContact O-N 3.17Å; R502-R506 VanDerWaalsContact O-N 3.09Å; H504-R506 PolarHBondContact O-N 2.91Å; R506-K508 PolarHBondContact O-N 3.18Å
507	E	77	Confident	83.2	Confident	111 Å²	111	82.3 Å²	82.3	52%	0.519	41%	0.411	S	S	.	.			trans	-64.3	126.2	175.8	-75.1	179.2	180	0	0	110.2	T505 P509	T505-E507 PolarHBondContact O-N 2.81Å; T505-E507 WeakPolarHBondContact OG1-CG 3.35Å; E507-P509 VanDerWaalsContact C-CD 3.48Å; E507-P509 WeakPolarHBondContact O-CD 3.48Å
508	K	80.4	Confident	83.1	Confident	120 Å²	120	83.7 Å²	83.7	52%	0.522	42%	0.422	S	S	.	.			trans	-119.8	74.7	177	-69.5	173	171	-172.1	0	110.8	R506 W510 S518 F519 C520	R506-K508 PolarHBondContact O-N 3.18Å; K508-W510 PolarHBondContact O-N 3.38Å; K508-S518 WeakPolarHBondContact CD-O 3.3Å; K508-F519 CarbonylContact C-O 3.46Å; K508-F519 WeakPolarHBondContact CA-O 3.3Å; K508-C520 VanDerWaalsContact CG-SG 3.6Å
509	P	81.9	Confident	83	Confident	74 Å²	74	84.8 Å²	84.8	48%	0.481	42%	0.42	S	S	.	.			trans	-68.8	-19.2	-174.5	-17.2	31.3	0	0	0	113.5	E507 K511	E507-P509 VanDerWaalsContact C-CD 3.48Å; E507-P509 WeakPolarHBondContact O-CD 3.48Å; P509-K511 PolarHBondContact O-N 2.94Å
510	W	81.7	Confident	82.7	Confident	91 Å²	91	81.4 Å²	81.4	35%	0.345	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	87.3	-170.4	-58.5	96.7	0	0	0	110.4	K508 S518 F519 N522 L525	K508-W510 PolarHBondContact O-N 3.38Å; W510-S518 CarbonylContact O-C 3.58Å; W510-S518 WeakPolarHBondContact O-CA 3.45Å; W510-F519 HydrophobicContact CB-CB 4.34Å; W510-F519 WeakPolarHBondContact CB-O 3.3Å; W510-F519 PolarHBondContact N-O 2.92Å; W510-F519 PolarHBondContact O-N 3.07Å; W510-N522 HydrophobicContact CD2-CB 3.74Å; W510-N522 HydrophobicContact CE3-CB 3.91Å; W510-N522 HydrophobicContact CG-CB 4.36Å; W510-N522 HydrophobicContact CH2-CB 4.01Å; W510-N522 HydrophobicContact CZ2-CB 3.85Å; W510-N522 HydrophobicContact CZ3-CB 4.04Å; W510-L525 HydrophobicContact CB-CB 4.02Å; W510-L525 HydrophobicContact CB-CD2 3.89Å; W510-L525 HydrophobicContact CE3-CD2 4.26Å
511	K	84.9	Confident	82.4	Confident	141 Å²	141	86.3 Å²	86.3	61%	0.613	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	132	177.6	-166.9	174.7	-179	-179.2	0	111.3	P509 S513 G516	P509-K511 PolarHBondContact O-N 2.94Å; K511-S513 PolarHBondContact O-N 3.04Å; K511-G516 WeakPolarHBondContact CG-O 3.47Å
512	C	88.8	Confident	82.2	Confident	1 Å²	1	86 Å²	86	1%	0.007	43%	0.425	C	S	.	.			trans	-72.9	123.2	169.5	-172.3	0	0	0	0	109.5	E514 C515 G516 K517 F519 L525	C512-E514 VanDerWaalsContact C-N 3.28Å; C512-E514 PolarHBondContact O-N 2.87Å; C512-C515 VanDerWaalsContact SG-SG 3.64Å; C512-G516 WeakPolarHBondContact O-CA 3.47Å; C512-G516 PolarHBondContact O-N 3.36Å; C512-K517 VanDerWaalsContact CB-O 3.3Å; C512-K517 WeakPolarHBondContact CB-O 3.45Å; C512-K517 PolarHBondContact N-O 2.61Å; C512-F519 HydrophobicContact CB-CE2 4.45Å; C512-L525 HydrophobicContact CB-CD1 3.66Å
513	S	85	Confident	82.1	Confident	93 Å²	93	85.5 Å²	85.5	65%	0.65	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-27.9	178.1	41.2	0	0	0	0	112.9	K511 R529	K511-S513 PolarHBondContact O-N 3.04Å; S513-R529 PolarHBondContact OG-NH2 2.91Å
514	E	83.7	Confident	82	Confident	122 Å²	122	83 Å²	83	57%	0.57	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-35.5	-174.6	-69.3	161.7	-157.4	0	0	113	C512 H532	C512-E514 VanDerWaalsContact C-N 3.28Å; C512-E514 PolarHBondContact O-N 2.87Å; E514-H532 WeakPolarHBondContact OE2-CB 3.46Å; E514-H532 IonicContact OE2-CD2 3.8Å; E514-H532 PolarHBondContact OE2-CD2 3.21Å; E514-H532 IonicContact OE2-CG 3.11Å
515	C	88.1	Confident	82.1	Confident	53 Å²	53	79.8 Å²	79.8	36%	0.358	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	6.8	-176.8	70.3	0	0	0	0	114.6	C512 K517 H528 H532	C512-C515 VanDerWaalsContact SG-SG 3.64Å; C515-K517 PolarHBondContact O-N 3.1Å; C515-H528 PolarHBondContact SG-NE2 3.31Å; C515-H532 PolarHBondContact SG-NE2 3.25Å
516	G	82.5	Confident	82.2	Confident	33 Å²	33	84.3 Å²	84.3	34%	0.34	42%	0.416	S	S	.	.			trans	70.3	-6.3	177.7	0	0	0	0	0	116.3	K511 C512 S518	K511-G516 WeakPolarHBondContact CG-O 3.47Å; C512-G516 WeakPolarHBondContact O-CA 3.47Å; C512-G516 PolarHBondContact O-N 3.36Å; G516-S518 PolarHBondContact O-N 3.46Å
517	K	85.9	Confident	82.7	Confident	128 Å²	128	79.6 Å²	79.6	56%	0.557	41%	0.405	S	S	*	.			trans	-61.6	130.2	178.9	-71.5	179	-178.9	175	0	111.2	C512 C515 F519	C512-K517 VanDerWaalsContact CB-O 3.3Å; C512-K517 WeakPolarHBondContact CB-O 3.45Å; C512-K517 PolarHBondContact N-O 2.61Å; C515-K517 PolarHBondContact O-N 3.1Å; K517-F519 HydrophobicContact CB-CE2 3.79Å; K517-F519 HydrophobicContact CB-CZ 3.96Å; K517-F519 WeakPolarHBondContact O-CE2 3.18Å
518	S	85.8	Confident	83.1	Confident	47 Å²	47	75.2 Å²	75.2	33%	0.329	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	139.4	-179.3	-55.9	0	0	0	0	111.8	K508 W510 G516	K508-S518 WeakPolarHBondContact CD-O 3.3Å; W510-S518 CarbonylContact O-C 3.58Å; W510-S518 WeakPolarHBondContact O-CA 3.45Å; G516-S518 PolarHBondContact O-N 3.46Å
519	F	81.8	Confident	83.3	Confident	50 Å²	50	74.4 Å²	74.4	22%	0.219	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	148.5	-176.5	-59.5	-92	0	0	0	111	K508 W510 C512 K517 W521 L525 H528	K508-F519 CarbonylContact C-O 3.46Å; K508-F519 WeakPolarHBondContact CA-O 3.3Å; W510-F519 HydrophobicContact CB-CB 4.34Å; W510-F519 WeakPolarHBondContact CB-O 3.3Å; W510-F519 PolarHBondContact N-O 2.92Å; W510-F519 PolarHBondContact O-N 3.07Å; C512-F519 HydrophobicContact CB-CE2 4.45Å; K517-F519 HydrophobicContact CB-CE2 3.79Å; K517-F519 HydrophobicContact CB-CZ 3.96Å; K517-F519 WeakPolarHBondContact O-CE2 3.18Å; F519-W521 PolarHBondContact O-N 3.27Å; F519-L525 HydrophobicContact CB-CB 4.4Å; F519-L525 HydrophobicContact CD2-CB 3.97Å; F519-L525 HydrophobicContact CD2-CD1 3.95Å; F519-L525 HydrophobicContact CE2-CD1 4.13Å; F519-L525 HydrophobicContact CG-CB 4.36Å; F519-H528 HydrophobicContact CE1-CB 3.92Å; F519-H528 HydrophobicContact CE2-CB 3.86Å; F519-H528 AromaticContact CE2-CD2 3.31Å; F519-H528 WeakPolarHBondContact CE2-CD2 2.9Å; F519-H528 AromaticContact CE2-CG 3.63Å; F519-H528 HydrophobicContact CZ-CB 3.39Å; F519-H528 AromaticContact CZ-CD2 3.38Å; F519-H528 WeakPolarHBondContact CZ-CD2 3.39Å; F519-H528 AromaticContact CZ-CG 3.2Å; F519-H528 AromaticContact CZ-ND1 3.84Å
520	C	77.8	Confident	83.4	Confident	32 Å²	32	77.6 Å²	77.6	22%	0.216	39%	0.385	C	S	.	.	S	Bend	trans	-71.3	-23.7	175.4	-53.5	0	0	0	0	111.9	K508	K508-C520 VanDerWaalsContact CG-SG 3.6Å
521	W	79.6	Confident	83.4	Confident	130 Å²	130	76.2 Å²	76.2	49%	0.492	39%	0.386	S	S	.	.	S	Bend	trans	-130.2	143.6	-174.8	-47.9	-39.6	0	0	0	112.2	V503 F519 S523 G524 L525	V503-W521 HydrophobicContact CG2-CZ2 4.43Å; F519-W521 PolarHBondContact O-N 3.27Å; W521-S523 VanDerWaalsContact C-N 3.27Å; W521-S523 WeakPolarHBondContact CB-OG 3.38Å; W521-S523 PolarHBondContact O-N 3.21Å; W521-G524 PolarHBondContact O-N 2.92Å; W521-L525 PolarHBondContact O-N 3.19Å; W521-L525 VanDerWaalsContact O-N 3.15Å
522	N	79.9	Confident	83.1	Confident	79 Å²	79	71.2 Å²	71.2	42%	0.422	37%	0.365	S	S	.	.	H	α-helix	trans	-64.5	-32.1	174.5	-169.8	16.8	0	0	0	112	W510 G524 L525 R526	W510-N522 HydrophobicContact CD2-CB 3.74Å; W510-N522 HydrophobicContact CE3-CB 3.91Å; W510-N522 HydrophobicContact CG-CB 4.36Å; W510-N522 HydrophobicContact CH2-CB 4.01Å; W510-N522 HydrophobicContact CZ2-CB 3.85Å; W510-N522 HydrophobicContact CZ3-CB 4.04Å; N522-G524 VanDerWaalsContact C-N 3.32Å; N522-G524 PolarHBondContact O-N 3.49Å; N522-L525 PolarHBondContact O-N 2.69Å; N522-R526 VanDerWaalsContact O-CB 3.27Å; N522-R526 WeakPolarHBondContact O-CB 3.44Å; N522-R526 PolarHBondContact O-N 2.86Å
523	S	80.9	Confident	82	Confident	61 Å²	61	78.5 Å²	78.5	43%	0.427	40%	0.397	S	S	.	.	H	α-helix	trans	-59.9	-43.1	173.4	49.5	0	0	0	0	111.7	W521 R526 I527	W521-S523 VanDerWaalsContact C-N 3.27Å; W521-S523 WeakPolarHBondContact CB-OG 3.38Å; W521-S523 PolarHBondContact O-N 3.21Å; S523-R526 PolarHBondContact O-N 3.35Å; S523-I527 WeakPolarHBondContact O-CD1 3.37Å; S523-I527 VanDerWaalsContact O-CG1 3.28Å; S523-I527 WeakPolarHBondContact O-CG1 3.47Å; S523-I527 PolarHBondContact O-N 3.34Å
524	G	80.7	Confident	80.8	Confident	20 Å²	20	76.4 Å²	76.4	21%	0.206	39%	0.385	C	S	.	.	H	α-helix	trans	-62.4	-46.9	174.7	0	0	0	0	0	112.1	W521 N522 R526 I527 H528	W521-G524 PolarHBondContact O-N 2.92Å; N522-G524 VanDerWaalsContact C-N 3.32Å; N522-G524 PolarHBondContact O-N 3.49Å; G524-R526 VanDerWaalsContact C-N 3.31Å; G524-R526 PolarHBondContact O-N 3.33Å; G524-I527 PolarHBondContact O-N 3Å; G524-H528 VanDerWaalsContact O-CB 3.27Å; G524-H528 WeakPolarHBondContact O-CB 3.48Å; G524-H528 PolarHBondContact O-N 2.99Å
525	L	84.1	Confident	79.3	Confident	5 Å²	5	75.5 Å²	75.5	3%	0.026	38%	0.384	C	S	.	.	H	α-helix	trans	-60.1	-40.9	173.5	175.2	61.8	0	0	0	112	W510 C512 F519 W521 N522 H528 R529	W510-L525 HydrophobicContact CB-CB 4.02Å; W510-L525 HydrophobicContact CB-CD2 3.89Å; W510-L525 HydrophobicContact CE3-CD2 4.26Å; C512-L525 HydrophobicContact CB-CD1 3.66Å; F519-L525 HydrophobicContact CB-CB 4.4Å; F519-L525 HydrophobicContact CD2-CB 3.97Å; F519-L525 HydrophobicContact CD2-CD1 3.95Å; F519-L525 HydrophobicContact CE2-CD1 4.13Å; F519-L525 HydrophobicContact CG-CB 4.36Å; W521-L525 PolarHBondContact O-N 3.19Å; W521-L525 VanDerWaalsContact O-N 3.15Å; N522-L525 PolarHBondContact O-N 2.69Å; L525-H528 PolarHBondContact O-N 2.69Å; L525-R529 HydrophobicContact CD1-CG 4.14Å; L525-R529 HydrophobicContact CG-CG 4.48Å; L525-R529 WeakPolarHBondContact O-CB 3.27Å; L525-R529 WeakPolarHBondContact O-CG 3.35Å; L525-R529 PolarHBondContact O-N 3.31Å
526	R	82.8	Confident	77.7	Confident	169 Å²	169	78.6 Å²	78.6	64%	0.638	40%	0.396	S	S	*	.	H	α-helix	trans	-68.8	-36.7	-179.1	-164.9	-180	69.6	169.6	2.8	112.3	N522 S523 G524 K530	N522-R526 VanDerWaalsContact O-CB 3.27Å; N522-R526 WeakPolarHBondContact O-CB 3.44Å; N522-R526 PolarHBondContact O-N 2.86Å; S523-R526 PolarHBondContact O-N 3.35Å; G524-R526 VanDerWaalsContact C-N 3.31Å; G524-R526 PolarHBondContact O-N 3.33Å; R526-K530 WeakPolarHBondContact O-CG 3.36Å
527	I	83.9	Confident	76.1	Confident	111 Å²	111	84.8 Å²	84.8	57%	0.569	42%	0.416	S	S	*	.	H	α-helix	trans	-67.9	-46.6	172.7	-68.5	161.8	0	0	0	109.6	S523 G524 R529 K530	S523-I527 WeakPolarHBondContact O-CD1 3.37Å; S523-I527 VanDerWaalsContact O-CG1 3.28Å; S523-I527 WeakPolarHBondContact O-CG1 3.47Å; S523-I527 PolarHBondContact O-N 3.34Å; G524-I527 PolarHBondContact O-N 3Å; I527-R529 PolarHBondContact O-N 3.45Å; I527-K530 VanDerWaalsContact O-CB 3.29Å; I527-K530 WeakPolarHBondContact O-CB 3.49Å; I527-K530 PolarHBondContact O-N 3.14Å
528	H	85.4	Confident	74.3	Confident	20 Å²	20	84.6 Å²	84.6	9%	0.093	43%	0.425	C	S	.	.	H	α-helix	trans	-61.9	-39.4	177.8	172.2	61.5	0	0	0	113	C515 F519 G524 L525 K530 T531 H532	C515-H528 PolarHBondContact SG-NE2 3.31Å; F519-H528 HydrophobicContact CE1-CB 3.92Å; F519-H528 HydrophobicContact CE2-CB 3.86Å; F519-H528 AromaticContact CE2-CD2 3.31Å; F519-H528 WeakPolarHBondContact CE2-CD2 2.9Å; F519-H528 AromaticContact CE2-CG 3.63Å; F519-H528 HydrophobicContact CZ-CB 3.39Å; F519-H528 AromaticContact CZ-CD2 3.38Å; F519-H528 WeakPolarHBondContact CZ-CD2 3.39Å; F519-H528 AromaticContact CZ-CG 3.2Å; F519-H528 AromaticContact CZ-ND1 3.84Å; G524-H528 VanDerWaalsContact O-CB 3.27Å; G524-H528 WeakPolarHBondContact O-CB 3.48Å; G524-H528 PolarHBondContact O-N 2.99Å; L525-H528 PolarHBondContact O-N 2.69Å; H528-K530 PolarHBondContact O-N 2.88Å; H528-K530 VanDerWaalsContact O-N 3.14Å; H528-T531 PolarHBondContact O-N 3.23Å; H528-T531 PolarHBondContact O-OG1 3.14Å; H528-H532 AromaticContact CD2-NE2 3.83Å; H528-H532 AromaticContact CE1-CE1 3.85Å; H528-H532 AromaticContact CE1-NE2 3.2Å; H528-H532 PolarHBondContact CE1-NE2 3.23Å; H528-H532 AromaticContact NE2-CD2 3.76Å; H528-H532 AromaticContact NE2-CE1 3.91Å; H528-H532 AromaticContact NE2-NE2 2.94Å; H528-H532 PolarHBondContact NE2-NE2 3.46Å
529	R	83.5	Confident	72.5	Confident	103 Å²	103	90.6 Å²	90.6	39%	0.389	45%	0.45	S	S	.	.	H	α-helix	trans	-61.1	-21.8	172.8	-81.1	180	170.7	172.5	-3.4	113.7	S513 L525 I527 T531	S513-R529 PolarHBondContact OG-NH2 2.91Å; L525-R529 HydrophobicContact CD1-CG 4.14Å; L525-R529 HydrophobicContact CG-CG 4.48Å; L525-R529 WeakPolarHBondContact O-CB 3.27Å; L525-R529 WeakPolarHBondContact O-CG 3.35Å; L525-R529 PolarHBondContact O-N 3.31Å; I527-R529 PolarHBondContact O-N 3.45Å; R529-T531 VanDerWaalsContact C-N 3.34Å
530	K	84.3	Confident	70.5	Confident	140 Å²	140	99.9 Å²	99.9	61%	0.609	49%	0.491	S	S	*	.	H	α-helix	trans	-75.1	-24.4	173.1	-65.6	177.7	176.1	-167.5	0	112.3	R526 I527 H528 K533 A534	R526-K530 WeakPolarHBondContact O-CG 3.36Å; I527-K530 VanDerWaalsContact O-CB 3.29Å; I527-K530 WeakPolarHBondContact O-CB 3.49Å; I527-K530 PolarHBondContact O-N 3.14Å; H528-K530 PolarHBondContact O-N 2.88Å; H528-K530 VanDerWaalsContact O-N 3.14Å; K530-K533 PolarHBondContact O-N 3.29Å; K530-A534 PolarHBondContact O-N 3.47Å
531	T	82.2	Confident	70.1	Confident	62 Å²	62	103.3 Å²	103.3	38%	0.38	50%	0.504	S	S	.	.	H	α-helix	trans	-70	-41	177.1	69.1	0	0	0	0	110.6	H528 R529 K533 A534 D535	H528-T531 PolarHBondContact O-N 3.23Å; H528-T531 PolarHBondContact O-OG1 3.14Å; R529-T531 VanDerWaalsContact C-N 3.34Å; T531-K533 PolarHBondContact O-N 3.28Å; T531-A534 WeakPolarHBondContact O-CB 3.39Å; T531-A534 PolarHBondContact O-N 3.37Å; T531-D535 VanDerWaalsContact O-CG 3.26Å; T531-D535 PolarHBondContact O-N 3.31Å
532	H	78.4	Confident	69.6	Low	36 Å²	36	101.9 Å²	101.9	17%	0.167	51%	0.505	C	S	.	.	H	α-helix	trans	-59.8	-34.1	172	-63.8	-55.6	0	0	0	113.1	E514 C515 H528 I536	E514-H532 WeakPolarHBondContact OE2-CB 3.46Å; E514-H532 IonicContact OE2-CD2 3.8Å; E514-H532 PolarHBondContact OE2-CD2 3.21Å; E514-H532 IonicContact OE2-CG 3.11Å; C515-H532 PolarHBondContact SG-NE2 3.25Å; H528-H532 AromaticContact CD2-NE2 3.83Å; H528-H532 AromaticContact CE1-CE1 3.85Å; H528-H532 AromaticContact CE1-NE2 3.2Å; H528-H532 PolarHBondContact CE1-NE2 3.23Å; H528-H532 AromaticContact NE2-CD2 3.76Å; H528-H532 AromaticContact NE2-CE1 3.91Å; H528-H532 AromaticContact NE2-NE2 2.94Å; H528-H532 PolarHBondContact NE2-NE2 3.46Å; H532-I536 WeakPolarHBondContact O-CD1 3.41Å; H532-I536 VanDerWaalsContact O-CG1 3.27Å; H532-I536 WeakPolarHBondContact O-CG1 3.39Å; H532-I536 PolarHBondContact O-N 2.85Å
533	K	65.5	Low	69.1	Low	154 Å²	154	103.2 Å²	103.2	67%	0.67	51%	0.51	S	S	*	.	H	α-helix	trans	-72.4	-30.6	173.9	-74.9	-168.6	172.9	-166.8	0	113.6	K530 T531	K530-K533 PolarHBondContact O-N 3.29Å; T531-K533 PolarHBondContact O-N 3.28Å
534	A	59.3	Low	68.4	Low	50 Å²	50	105.6 Å²	105.6	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-74.4	-38.6	176.8	0	0	0	0	0	111.3	K530 T531 I536 Q537	K530-A534 PolarHBondContact O-N 3.47Å; T531-A534 WeakPolarHBondContact O-CB 3.39Å; T531-A534 PolarHBondContact O-N 3.37Å; A534-I536 VanDerWaalsContact C-N 3.31Å; A534-I536 PolarHBondContact O-N 2.9Å; A534-Q537 PolarHBondContact O-N 3.28Å; A534-Q537 VanDerWaalsContact O-N 3.14Å
535	D	52.9	Low	67.6	Low	103 Å²	103	111 Å²	111	55%	0.551	53%	0.534	S	S	*	.	H	α-helix	trans	-68.6	-28.6	179.9	-62	-28.6	0	0	0	112.4	T531 Q537	T531-D535 VanDerWaalsContact O-CG 3.26Å; T531-D535 PolarHBondContact O-N 3.31Å; D535-Q537 VanDerWaalsContact C-N 3.28Å; D535-Q537 PolarHBondContact O-N 2.95Å
536	I	54.6	Low	66.5	Low	118 Å²	118	118.1 Å²	118.1	61%	0.605	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-21.2	174.5	-68	167.3	0	0	0	112.4	H532 A534	H532-I536 WeakPolarHBondContact O-CD1 3.41Å; H532-I536 VanDerWaalsContact O-CG1 3.27Å; H532-I536 WeakPolarHBondContact O-CG1 3.39Å; H532-I536 PolarHBondContact O-N 2.85Å; A534-I536 VanDerWaalsContact C-N 3.31Å; A534-I536 PolarHBondContact O-N 2.9Å
537	Q	49.3	Very low	65.4	Low	162 Å²	162	114.4 Å²	114.4	76%	0.757	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-5.7	-176.6	-127.6	165.1	-4.5	0	0	113.7	A534 D535	A534-Q537 PolarHBondContact O-N 3.28Å; A534-Q537 VanDerWaalsContact O-N 3.14Å; D535-Q537 VanDerWaalsContact C-N 3.28Å; D535-Q537 PolarHBondContact O-N 2.95Å
538	V	48	Very low	63.9	Low	124 Å²	124	114.7 Å²	114.7	75%	0.752	56%	0.562	S	S	*	*	S	Bend	trans	-102.2	-5.4	176.5	-177.3	0	0	0	0	111.9
539	M	47.3	Very low	62.1	Low	174 Å²	174	122.6 Å²	122.6	86%	0.857	60%	0.601	S	S	*	*			trans	-110.3	24.6	176.1	-69.1	-165.9	178.8	0	0	113.9
540	K	40.5	Very low	60.2	Low	245 Å²	245	124.4 Å²	124.4	100%	1.065	62%	0.62	S	S	*	*			trans	-125.4	0	164.6	-78.1	-171.3	176.2	-173.3	0	108.4

Retrieved 540 of 540 residues in 80.9 ms (Link to these results)

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