A0A087XBG7_POEFO Loading...

Cholinergic receptor, nicotinic, delta (muscle)

After binding acetylcholine, the AChR responds by an extensive change in conformation that affects all subunits and leads to opening of an ion-conducting channel across the plasma membrane.

AlphaFold DB , UniProt , Accession A0A087XBG7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 521 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	54.8	Low	63.5	Low	195 Å²	195	120.9 Å²	120.9	96%	0.961	63%	0.632	S	S	*	*				0	-33.7	0	-132.8	165.7	70.9	0	0	112.5
2	E	56.7	Low	63.9	Low	144 Å²	144	119.3 Å²	119.3	67%	0.673	62%	0.623	S	S	*	*	H	α-helix	trans	-66.1	-40.3	177	-70.3	-65.5	123.4	0	0	114.6	H4 R5 A6	E2-H4 VanDerWaalsContact C-N 3.31Å; E2-H4 PolarHBondContact O-N 3.32Å; E2-R5 PolarHBondContact O-N 3.05Å; E2-A6 PolarHBondContact O-N 2.97Å
3	L	56.8	Low	64.1	Low	157 Å²	157	117.1 Å²	117.1	82%	0.822	61%	0.612	S	S	*	*	H	α-helix	trans	-66.2	-31.1	-176.9	-143	83.9	0	0	0	113.5	A7	L3-A7 PolarHBondContact O-N 2.77Å
4	H	57.6	Low	64.2	Low	153 Å²	153	117.6 Å²	117.6	71%	0.708	61%	0.614	S	S	*	*	H	α-helix	trans	-75.8	-31.5	179.3	-117.9	4.6	0	0	0	112.4	E2 L8	E2-H4 VanDerWaalsContact C-N 3.31Å; E2-H4 PolarHBondContact O-N 3.32Å; H4-L8 WeakPolarHBondContact O-CB 3.48Å; H4-L8 PolarHBondContact O-N 3.27Å
5	R	60.7	Low	64.1	Low	171 Å²	171	114.6 Å²	114.6	65%	0.645	60%	0.603	S	S	*	*	H	α-helix	trans	-69.5	-40.6	174.4	-79.5	-177.4	167.4	-177.4	-5.2	111.7	E2 L8 V9	E2-R5 PolarHBondContact O-N 3.05Å; R5-L8 PolarHBondContact O-N 2.97Å; R5-V9 WeakPolarHBondContact O-CB 3.37Å; R5-V9 WeakPolarHBondContact O-CG2 3.35Å; R5-V9 PolarHBondContact O-N 3.35Å
6	A	63.3	Low	63.8	Low	59 Å²	59	113.3 Å²	113.3	49%	0.488	60%	0.596	S	S	.	*	H	α-helix	trans	-65	-39.3	176.1	0	0	0	0	0	112.7	E2 T10	E2-A6 PolarHBondContact O-N 2.97Å; A6-T10 WeakPolarHBondContact O-CB 3.44Å; A6-T10 WeakPolarHBondContact O-CG2 3.49Å; A6-T10 PolarHBondContact O-N 3.01Å; A6-T10 PolarHBondContact O-OG1 3.32Å
7	A	65.4	Low	63.5	Low	49 Å²	49	112.8 Å²	112.8	41%	0.405	59%	0.593	S	S	.	*	H	α-helix	trans	-66.3	-40	174.6	0	0	0	0	0	112.3	L3 T10 L11	L3-A7 PolarHBondContact O-N 2.77Å; A7-T10 WeakPolarHBondContact CA-OG1 3.22Å; A7-T10 PolarHBondContact O-OG1 3.23Å; A7-L11 WeakPolarHBondContact O-CB 3.35Å; A7-L11 PolarHBondContact O-N 2.99Å
8	L	68.6	Low	63.1	Low	117 Å²	117	110.3 Å²	110.3	61%	0.613	59%	0.586	S	S	*	*	H	α-helix	trans	-68.2	-39.4	177.6	-135.5	107.4	0	0	0	111.9	H4 R5 L11 L12	H4-L8 WeakPolarHBondContact O-CB 3.48Å; H4-L8 PolarHBondContact O-N 3.27Å; R5-L8 PolarHBondContact O-N 2.97Å; L8-L11 PolarHBondContact O-N 3.5Å; L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 PolarHBondContact O-N 3.37Å
9	V	72.5	Confident	62.5	Low	87 Å²	87	108.3 Å²	108.3	53%	0.527	58%	0.582	S	S	.	*	H	α-helix	trans	-68.4	-40.7	178.3	169.8	0	0	0	0	111.3	R5 L12 L13	R5-V9 WeakPolarHBondContact O-CB 3.37Å; R5-V9 WeakPolarHBondContact O-CG2 3.35Å; R5-V9 PolarHBondContact O-N 3.35Å; V9-L12 PolarHBondContact O-N 2.9Å; V9-L13 HydrophobicContact CG1-CD1 3.84Å; V9-L13 WeakPolarHBondContact O-CB 3.44Å; V9-L13 PolarHBondContact O-N 3.11Å
10	T	70.9	Confident	61.9	Low	77 Å²	77	110.7 Å²	110.7	47%	0.472	59%	0.589	S	S	.	*	H	α-helix	trans	-68	-39	175.2	44	0	0	0	0	112.1	A6 A7 L13 L14	A6-T10 WeakPolarHBondContact O-CB 3.44Å; A6-T10 WeakPolarHBondContact O-CG2 3.49Å; A6-T10 PolarHBondContact O-N 3.01Å; A6-T10 PolarHBondContact O-OG1 3.32Å; A7-T10 WeakPolarHBondContact CA-OG1 3.22Å; A7-T10 PolarHBondContact O-OG1 3.23Å; T10-L13 PolarHBondContact O-N 3.28Å; T10-L14 WeakPolarHBondContact O-CB 3.4Å; T10-L14 WeakPolarHBondContact O-CD1 3.28Å; T10-L14 PolarHBondContact O-N 3.44Å
11	L	71	Confident	61.5	Low	121 Å²	121	110.6 Å²	110.6	63%	0.634	60%	0.596	S	S	*	*	H	α-helix	trans	-63.7	-41.6	172.7	-147.8	93.5	0	0	0	111.2	A7 L8 L14 T15	A7-L11 WeakPolarHBondContact O-CB 3.35Å; A7-L11 PolarHBondContact O-N 2.99Å; L8-L11 PolarHBondContact O-N 3.5Å; L11-L14 PolarHBondContact O-N 2.75Å; L11-T15 WeakPolarHBondContact O-CG2 3.35Å; L11-T15 PolarHBondContact O-N 2.9Å; L11-T15 PolarHBondContact O-OG1 2.88Å; L11-T15 VanDerWaalsContact O-OG1 3.11Å
12	L	68.6	Low	61.4	Low	101 Å²	101	108.7 Å²	108.7	53%	0.529	59%	0.589	S	S	.	*	H	α-helix	trans	-64.2	-43.3	177.7	-142.6	97.7	0	0	0	111.6	L8 V9 T15 L16	L8-L12 WeakPolarHBondContact O-CB 3.49Å; L8-L12 PolarHBondContact O-N 3.37Å; V9-L12 PolarHBondContact O-N 2.9Å; L12-T15 VanDerWaalsContact CA-OG1 3.28Å; L12-T15 WeakPolarHBondContact CA-OG1 3.4Å; L12-T15 PolarHBondContact O-N 3.36Å; L12-T15 PolarHBondContact O-OG1 3.48Å; L12-L16 HydrophobicContact CD2-CD1 4.05Å; L12-L16 HydrophobicContact CG-CD1 4.4Å; L12-L16 WeakPolarHBondContact O-CB 3.37Å; L12-L16 WeakPolarHBondContact O-CD1 3.33Å; L12-L16 WeakPolarHBondContact O-CG 3.37Å; L12-L16 PolarHBondContact O-N 2.8Å
13	L	67.1	Low	61.3	Low	91 Å²	91	107 Å²	107	48%	0.476	59%	0.592	S	S	.	*	H	α-helix	trans	-63.9	-42.9	175.2	-96	143.3	0	0	0	111.8	V9 T10 T15 L16 I17	V9-L13 HydrophobicContact CG1-CD1 3.84Å; V9-L13 WeakPolarHBondContact O-CB 3.44Å; V9-L13 PolarHBondContact O-N 3.11Å; T10-L13 PolarHBondContact O-N 3.28Å; L13-T15 VanDerWaalsContact C-N 3.35Å; L13-T15 PolarHBondContact O-N 2.89Å; L13-L16 PolarHBondContact O-N 3.19Å; L13-I17 WeakPolarHBondContact O-CB 3.3Å; L13-I17 VanDerWaalsContact O-CD1 3.3Å; L13-I17 WeakPolarHBondContact O-CD1 3.41Å; L13-I17 WeakPolarHBondContact O-CG1 3.12Å; L13-I17 PolarHBondContact O-N 2.95Å
14	L	65.2	Low	61.7	Low	124 Å²	124	107.1 Å²	107.1	65%	0.649	58%	0.581	S	S	*	*	H	α-helix	trans	-63.2	-39.7	173.8	-96.3	138.5	0	0	0	111.9	T10 L11 S18	T10-L14 WeakPolarHBondContact O-CB 3.4Å; T10-L14 WeakPolarHBondContact O-CD1 3.28Å; T10-L14 PolarHBondContact O-N 3.44Å; L11-L14 PolarHBondContact O-N 2.75Å; L14-S18 WeakPolarHBondContact O-CB 3.38Å; L14-S18 PolarHBondContact O-N 3.44Å; L14-S18 PolarHBondContact O-OG 3.03Å
15	T	62.3	Low	63	Low	73 Å²	73	104 Å²	104	45%	0.448	57%	0.57	S	S	.	*	H	α-helix	trans	-68.2	-38.4	175	53	0	0	0	0	112.4	L11 L12 L13 S18 S19	L11-T15 WeakPolarHBondContact O-CG2 3.35Å; L11-T15 PolarHBondContact O-N 2.9Å; L11-T15 PolarHBondContact O-OG1 2.88Å; L11-T15 VanDerWaalsContact O-OG1 3.11Å; L12-T15 VanDerWaalsContact CA-OG1 3.28Å; L12-T15 WeakPolarHBondContact CA-OG1 3.4Å; L12-T15 PolarHBondContact O-N 3.36Å; L12-T15 PolarHBondContact O-OG1 3.48Å; L13-T15 VanDerWaalsContact C-N 3.35Å; L13-T15 PolarHBondContact O-N 2.89Å; T15-S18 WeakPolarHBondContact CA-OG 3.35Å; T15-S18 PolarHBondContact O-N 2.96Å; T15-S18 PolarHBondContact O-OG 2.84Å; T15-S19 WeakPolarHBondContact O-CB 3.35Å; T15-S19 PolarHBondContact O-N 3.32Å
16	L	59.8	Low	64.2	Low	94 Å²	94	98.5 Å²	98.5	49%	0.492	55%	0.551	S	S	.	*	H	α-helix	trans	-66.2	-44	176.3	-81.9	155.6	0	0	0	111.6	L12 L13 S18 S19 E20	L12-L16 HydrophobicContact CD2-CD1 4.05Å; L12-L16 HydrophobicContact CG-CD1 4.4Å; L12-L16 WeakPolarHBondContact O-CB 3.37Å; L12-L16 WeakPolarHBondContact O-CD1 3.33Å; L12-L16 WeakPolarHBondContact O-CG 3.37Å; L12-L16 PolarHBondContact O-N 2.8Å; L13-L16 PolarHBondContact O-N 3.19Å; L16-S18 PolarHBondContact O-N 2.88Å; L16-S19 PolarHBondContact O-N 2.82Å; L16-E20 PolarHBondContact O-N 3.19Å
17	I	58.3	Low	65.4	Low	105 Å²	105	99.9 Å²	99.9	54%	0.538	55%	0.548	S	S	.	.	H	α-helix	trans	-66.5	-37.7	176.9	-64.3	161	0	0	0	111	L13 S19 C21	L13-I17 WeakPolarHBondContact O-CB 3.3Å; L13-I17 VanDerWaalsContact O-CD1 3.3Å; L13-I17 WeakPolarHBondContact O-CD1 3.41Å; L13-I17 WeakPolarHBondContact O-CG1 3.12Å; L13-I17 PolarHBondContact O-N 2.95Å; I17-S19 VanDerWaalsContact C-N 3.31Å; I17-S19 PolarHBondContact O-N 3.5Å; I17-C21 PolarHBondContact O-N 3.08Å
18	S	56	Low	66.6	Low	68 Å²	68	102.7 Å²	102.7	48%	0.476	55%	0.553	S	S	.	*	H	α-helix	trans	-69.1	-30.1	174.4	68.1	0	0	0	0	113	L14 T15 L16	L14-S18 WeakPolarHBondContact O-CB 3.38Å; L14-S18 PolarHBondContact O-N 3.44Å; L14-S18 PolarHBondContact O-OG 3.03Å; T15-S18 WeakPolarHBondContact CA-OG 3.35Å; T15-S18 PolarHBondContact O-N 2.96Å; T15-S18 PolarHBondContact O-OG 2.84Å; L16-S18 PolarHBondContact O-N 2.88Å
19	S	52.7	Low	67.7	Low	71 Å²	71	101.1 Å²	101.1	50%	0.497	54%	0.539	S	S	.	.	H	α-helix	trans	-78.9	-29.4	179.8	-160.2	0	0	0	0	112.6	T15 L16 I17 C21 L22	T15-S19 WeakPolarHBondContact O-CB 3.35Å; T15-S19 PolarHBondContact O-N 3.32Å; L16-S19 PolarHBondContact O-N 2.82Å; I17-S19 VanDerWaalsContact C-N 3.31Å; I17-S19 PolarHBondContact O-N 3.5Å; S19-C21 VanDerWaalsContact C-N 3.32Å; S19-L22 PolarHBondContact O-N 3.5Å
20	E	50.4	Low	68.6	Low	157 Å²	157	97 Å²	97	73%	0.734	51%	0.513	S	S	*	.	H	α-helix	trans	-71	-27.6	172.1	-76.2	-179.5	174	0	0	112.4	L16 L22	L16-E20 PolarHBondContact O-N 3.19Å; E20-L22 VanDerWaalsContact C-N 3.34Å
21	C	52.3	Low	69.7	Low	108 Å²	108	95.7 Å²	95.7	73%	0.73	50%	0.503	S	S	*	.	H	α-helix	trans	-76.6	-21.5	177.3	-154.4	0	0	0	0	113	I17 S19	I17-C21 PolarHBondContact O-N 3.08Å; S19-C21 VanDerWaalsContact C-N 3.32Å
22	L	52.5	Low	70.7	Confident	155 Å²	155	93 Å²	93	81%	0.812	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-3.9	-176.6	-124	81	0	0	0	114.7	S19 E20	S19-L22 PolarHBondContact O-N 3.5Å; E20-L22 VanDerWaalsContact C-N 3.34Å
23	C	55.4	Low	71.8	Confident	108 Å²	108	90.2 Å²	90.2	73%	0.73	47%	0.474	S	S	*	.			trans	-116.8	30.7	-171.7	-67.8	0	0	0	0	113.3
24	R	65.9	Low	73	Confident	161 Å²	161	86 Å²	86	61%	0.608	45%	0.451	S	S	*	.			trans	-92.7	128.3	171.3	-161.3	152.4	105.1	170	6.8	109.2	E26	R24-E26 PolarHBondContact O-N 3.41Å; R24-E26 VanDerWaalsContact O-N 3.12Å
25	N	83.2	Confident	74.4	Confident	87 Å²	87	81.7 Å²	81.7	47%	0.465	43%	0.428	S	S	.	.			trans	-64.4	116.6	175.3	-170.9	-1	0	0	0	108.6	E27 E28 R29	N25-E27 PolarHBondContact O-N 3.05Å; N25-E27 PolarHBondContact OD1-N 3.08Å; N25-E28 HydrophobicContact CB-CB 4.16Å; N25-E28 WeakPolarHBondContact O-CB 3.32Å; N25-E28 PolarHBondContact O-N 3.48Å; N25-R29 PolarHBondContact O-N 3.17Å
26	E	86.9	Confident	75.7	Confident	55 Å²	55	84.5 Å²	84.5	26%	0.257	44%	0.439	S	S	.	.	H	α-helix	trans	-64.1	-28.9	-178.2	-73.9	-61.9	146.5	0	0	111.9	R24 E28 R29 L30 D98 I100	R24-E26 PolarHBondContact O-N 3.41Å; R24-E26 VanDerWaalsContact O-N 3.12Å; E26-E28 VanDerWaalsContact C-N 3.33Å; E26-E28 PolarHBondContact O-N 3.5Å; E26-R29 PolarHBondContact O-N 3.37Å; E26-R29 IonicContact OE1-NE 3.63Å; E26-R29 IonicContact OE2-CZ 3.04Å; E26-R29 IonicContact OE2-NE 2.7Å; E26-R29 PolarHBondContact OE2-NE 2.65Å; E26-R29 IonicContact OE2-NH2 2.65Å; E26-R29 PolarHBondContact OE2-NH2 2.7Å; E26-L30 WeakPolarHBondContact O-CB 3.17Å; E26-L30 PolarHBondContact O-N 3.14Å; E26-D98 HydrophobicContact CB-CB 4.24Å; E26-D98 HydrophobicContact CG-CB 3.99Å; E26-I100 HydrophobicContact CB-CD1 3.97Å
27	E	88.6	Confident	77.2	Confident	88 Å²	88	87 Å²	87	41%	0.411	45%	0.448	S	S	.	.	H	α-helix	trans	-62.3	-40	171	-65.4	-177.5	162.1	0	0	111.9	N25 R29 L30 I31 I100 L103	N25-E27 PolarHBondContact O-N 3.05Å; N25-E27 PolarHBondContact OD1-N 3.08Å; E27-R29 VanDerWaalsContact C-N 3.35Å; E27-L30 PolarHBondContact O-N 2.82Å; E27-I31 WeakPolarHBondContact O-CB 3.26Å; E27-I31 WeakPolarHBondContact O-CG1 3.48Å; E27-I31 PolarHBondContact O-N 3.12Å; E27-I100 HydrophobicContact CG-CD1 3.84Å; E27-L103 HydrophobicContact CB-CD1 4.27Å; E27-L103 HydrophobicContact CG-CD1 4.38Å
28	E	90.3	Very high	78.6	Confident	109 Å²	109	86.6 Å²	86.6	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-67.4	-38.8	177.9	-172.3	-176.1	175.4	0	0	111	N25 E26 I31 N32	N25-E28 HydrophobicContact CB-CB 4.16Å; N25-E28 WeakPolarHBondContact O-CB 3.32Å; N25-E28 PolarHBondContact O-N 3.48Å; E26-E28 VanDerWaalsContact C-N 3.33Å; E26-E28 PolarHBondContact O-N 3.5Å; E28-I31 PolarHBondContact O-N 3.12Å; E28-N32 WeakPolarHBondContact O-CB 3.47Å; E28-N32 PolarHBondContact O-N 3.08Å; E28-N32 PolarHBondContact O-ND2 3.16Å; E28-N32 VanDerWaalsContact O-ND2 3.15Å
29	R	91.5	Very high	80.2	Confident	84 Å²	84	86 Å²	86	32%	0.317	45%	0.447	S	S	.	.	H	α-helix	trans	-62	-44.2	173.4	-173.5	173.1	67.5	121	13.1	110.8	N25 E26 E27 N32 H33 E96 F97	N25-R29 PolarHBondContact O-N 3.17Å; E26-R29 PolarHBondContact O-N 3.37Å; E26-R29 IonicContact OE1-NE 3.63Å; E26-R29 IonicContact OE2-CZ 3.04Å; E26-R29 IonicContact OE2-NE 2.7Å; E26-R29 PolarHBondContact OE2-NE 2.65Å; E26-R29 IonicContact OE2-NH2 2.65Å; E26-R29 PolarHBondContact OE2-NH2 2.7Å; E27-R29 VanDerWaalsContact C-N 3.35Å; R29-N32 PolarHBondContact O-N 3.05Å; R29-H33 WeakPolarHBondContact O-CB 3.46Å; R29-H33 PolarHBondContact O-N 2.74Å; R29-E96 PolarHBondContact NH2-O 3.28Å; R29-F97 HydrophobicContact CG-CE1 4.32Å
30	L	92.4	Very high	82.2	Confident	0 Å²	0	83.9 Å²	83.9	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-63.9	-46	177.4	176.7	59.8	0	0	0	112.1	E26 E27 N32 H33 L34 W92 F97 I100 L103	E26-L30 WeakPolarHBondContact O-CB 3.17Å; E26-L30 PolarHBondContact O-N 3.14Å; E27-L30 PolarHBondContact O-N 2.82Å; L30-N32 PolarHBondContact O-N 2.68Å; L30-H33 WeakPolarHBondContact O-CB 3.45Å; L30-H33 PolarHBondContact O-N 3Å; L30-L34 HydrophobicContact CD1-CD1 4.01Å; L30-L34 HydrophobicContact CD1-CD2 4.49Å; L30-L34 HydrophobicContact CD1-CG 3.99Å; L30-L34 HydrophobicContact CG-CD1 4.07Å; L30-L34 HydrophobicContact CG-CG 4.44Å; L30-L34 WeakPolarHBondContact O-CG 3.41Å; L30-L34 PolarHBondContact O-N 3.31Å; L30-W92 HydrophobicContact CD1-CB 3.78Å; L30-W92 HydrophobicContact CD1-CD2 3.91Å; L30-W92 HydrophobicContact CD1-CE3 4.41Å; L30-W92 HydrophobicContact CD1-CG 3.59Å; L30-W92 HydrophobicContact CD2-CD2 3.86Å; L30-W92 HydrophobicContact CD2-CE3 4.42Å; L30-W92 HydrophobicContact CD2-CG 4.16Å; L30-W92 HydrophobicContact CD2-CZ2 4.03Å; L30-W92 HydrophobicContact CG-CD2 4.44Å; L30-F97 HydrophobicContact CB-CD1 3.78Å; L30-F97 HydrophobicContact CB-CE1 4.18Å; L30-F97 HydrophobicContact CB-CG 4.19Å; L30-F97 HydrophobicContact CD1-CD1 4.04Å; L30-F97 HydrophobicContact CD1-CD2 3.8Å; L30-F97 HydrophobicContact CD1-CE1 4.08Å; L30-F97 HydrophobicContact CD1-CE2 3.86Å; L30-F97 HydrophobicContact CD1-CG 3.9Å; L30-F97 HydrophobicContact CD1-CZ 4Å; L30-F97 HydrophobicContact CG-CD1 4.47Å; L30-F97 HydrophobicContact CG-CG 4.48Å; L30-I100 HydrophobicContact CD2-CB 4.46Å; L30-I100 HydrophobicContact CD2-CD1 4.5Å; L30-I100 HydrophobicContact CD2-CG2 4.06Å; L30-L103 HydrophobicContact CD2-CD1 4.45Å; L30-L103 HydrophobicContact CD2-CD2 4.05Å; L30-L103 HydrophobicContact CG-CD2 4.27Å
31	I	92.8	Very high	84.2	Confident	50 Å²	50	79.6 Å²	79.6	26%	0.256	41%	0.41	S	S	.	.	H	α-helix	trans	-58.9	-48.5	176.9	-69.9	166.9	0	0	0	110.1	E27 E28 H33 L34 F35 L103 L105	E27-I31 WeakPolarHBondContact O-CB 3.26Å; E27-I31 WeakPolarHBondContact O-CG1 3.48Å; E27-I31 PolarHBondContact O-N 3.12Å; E28-I31 PolarHBondContact O-N 3.12Å; I31-H33 VanDerWaalsContact C-N 3.3Å; I31-H33 PolarHBondContact O-N 3.11Å; I31-L34 PolarHBondContact O-N 2.83Å; I31-F35 HydrophobicContact CG2-CD2 3.79Å; I31-F35 HydrophobicContact CG2-CE2 4.22Å; I31-F35 VanDerWaalsContact O-CD2 3.28Å; I31-F35 WeakPolarHBondContact O-CD2 3.43Å; I31-F35 PolarHBondContact O-N 2.71Å; I31-L103 HydrophobicContact CD1-CD1 4.28Å; I31-L103 HydrophobicContact CG1-CD1 4.17Å; I31-L103 HydrophobicContact CG1-CD2 3.97Å; I31-L105 HydrophobicContact CD1-CD2 4.19Å; I31-L105 HydrophobicContact CG1-CD2 3.95Å
32	N	92.6	Very high	86.1	Confident	63 Å²	63	79.2 Å²	79.2	34%	0.337	40%	0.396	S	S	.	.	H	α-helix	trans	-61.5	-39.3	178.1	-74.3	-34	0	0	0	112.1	E28 R29 L30 L36 E37	E28-N32 WeakPolarHBondContact O-CB 3.47Å; E28-N32 PolarHBondContact O-N 3.08Å; E28-N32 PolarHBondContact O-ND2 3.16Å; E28-N32 VanDerWaalsContact O-ND2 3.15Å; R29-N32 PolarHBondContact O-N 3.05Å; L30-N32 PolarHBondContact O-N 2.68Å; N32-L36 HydrophobicContact CB-CD1 4.24Å; N32-L36 WeakPolarHBondContact O-CA 3.31Å; N32-L36 VanDerWaalsContact O-CB 3.25Å; N32-L36 WeakPolarHBondContact O-CB 3.37Å; N32-L36 PolarHBondContact O-N 3.06Å; N32-E37 PolarHBondContact O-N 2.86Å
33	H	91.9	Very high	87.9	Confident	44 Å²	44	79.1 Å²	79.1	20%	0.204	39%	0.392	C	S	.	.	I	π-helix	trans	-61.9	-47	174.5	178.9	71.5	0	0	0	112.2	R29 L30 I31 E37 K38 F97	R29-H33 WeakPolarHBondContact O-CB 3.46Å; R29-H33 PolarHBondContact O-N 2.74Å; L30-H33 WeakPolarHBondContact O-CB 3.45Å; L30-H33 PolarHBondContact O-N 3Å; I31-H33 VanDerWaalsContact C-N 3.3Å; I31-H33 PolarHBondContact O-N 3.11Å; H33-E37 IonicContact CE1-OE2 3.76Å; H33-E37 IonicContact CG-OE2 2.7Å; H33-E37 IonicContact ND1-OE2 3.71Å; H33-E37 PolarHBondContact ND1-OE2 3.47Å; H33-E37 WeakPolarHBondContact O-CB 3.2Å; H33-E37 PolarHBondContact O-N 3.3Å; H33-K38 WeakPolarHBondContact NE2-CE 3.37Å; H33-K38 PolarHBondContact O-N 3.29Å; H33-F97 HydrophobicContact CB-CE1 4.27Å; H33-F97 HydrophobicContact CB-CZ 4.1Å; H33-F97 AromaticContact CD2-CZ 3.71Å; H33-F97 AromaticContact CG-CZ 3.86Å
34	L	92.6	Very high	89.6	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.005	38%	0.383	C	S	.	.	I	π-helix	trans	-68.1	-40	-178.5	-68.6	176.7	0	0	0	113.1	L30 I31 K38 W92 L103	L30-L34 HydrophobicContact CD1-CD1 4.01Å; L30-L34 HydrophobicContact CD1-CD2 4.49Å; L30-L34 HydrophobicContact CD1-CG 3.99Å; L30-L34 HydrophobicContact CG-CD1 4.07Å; L30-L34 HydrophobicContact CG-CG 4.44Å; L30-L34 WeakPolarHBondContact O-CG 3.41Å; L30-L34 PolarHBondContact O-N 3.31Å; I31-L34 PolarHBondContact O-N 2.83Å; L34-K38 HydrophobicContact CD2-CD 4.24Å; L34-K38 WeakPolarHBondContact O-CB 3.47Å; L34-W92 HydrophobicContact CD1-CE3 3.87Å; L34-W92 HydrophobicContact CD1-CZ3 4.17Å; L34-W92 HydrophobicContact CD2-CE3 4.47Å; L34-L103 HydrophobicContact CD1-CD2 4.01Å
35	F	93.4	Very high	90.9	Very high	35 Å²	35	73.1 Å²	73.1	15%	0.154	36%	0.361	C	S	.	.	I	π-helix	trans	-94.7	-43.5	-173.4	-71.7	-79.9	0	0	0	113.7	I31 G39 Y40 L90 L105 M109 V110	I31-F35 HydrophobicContact CG2-CD2 3.79Å; I31-F35 HydrophobicContact CG2-CE2 4.22Å; I31-F35 VanDerWaalsContact O-CD2 3.28Å; I31-F35 WeakPolarHBondContact O-CD2 3.43Å; I31-F35 PolarHBondContact O-N 2.71Å; F35-G39 WeakPolarHBondContact O-CA 3.48Å; F35-G39 PolarHBondContact O-N 2.92Å; F35-Y40 AromaticContact CD1-CD1 3.77Å; F35-Y40 HydrophobicContact CD1-CD1 3.77Å; F35-Y40 AromaticContact CD1-CG 3.94Å; F35-Y40 HydrophobicContact CD1-CG 3.94Å; F35-Y40 AromaticContact CE1-CD1 3.52Å; F35-Y40 HydrophobicContact CE1-CD1 3.52Å; F35-Y40 HydrophobicContact CE1-CE1 4.04Å; F35-Y40 AromaticContact CE1-CG 3.93Å; F35-Y40 HydrophobicContact CE1-CG 3.93Å; F35-Y40 PolarHBondContact O-N 3.03Å; F35-Y40 VanDerWaalsContact O-N 3.1Å; F35-L90 HydrophobicContact CZ-CD2 4.28Å; F35-L105 HydrophobicContact CE2-CD1 3.9Å; F35-L105 HydrophobicContact CE2-CD2 3.89Å; F35-L105 HydrophobicContact CZ-CD1 3.87Å; F35-L105 HydrophobicContact CZ-CD2 4.41Å; F35-M109 HydrophobicContact CE1-CB 4.08Å; F35-M109 WeakPolarHBondContact CE1-O 3.48Å; F35-M109 HydrophobicContact CZ-CB 4.08Å; F35-V110 HydrophobicContact CZ-CG1 4.07Å
36	L	90.8	Very high	91.5	Very high	131 Å²	131	69.5 Å²	69.5	69%	0.686	34%	0.342	S	S	*	.	I	π-helix	trans	-90	-50.9	-175.7	-59.1	172.7	0	0	0	111.8	N32 G39	N32-L36 HydrophobicContact CB-CD1 4.24Å; N32-L36 WeakPolarHBondContact O-CA 3.31Å; N32-L36 VanDerWaalsContact O-CB 3.25Å; N32-L36 WeakPolarHBondContact O-CB 3.37Å; N32-L36 PolarHBondContact O-N 3.06Å; L36-G39 PolarHBondContact O-N 2.97Å
37	E	90	Very high	91.8	Very high	146 Å²	146	68 Å²	68	68%	0.682	34%	0.336	S	S	*	.	I	π-helix	trans	-74.1	-42.3	-174.2	-60	-178.7	-173.3	0	0	112	N32 H33 G39	N32-E37 PolarHBondContact O-N 2.86Å; H33-E37 IonicContact CE1-OE2 3.76Å; H33-E37 IonicContact CG-OE2 2.7Å; H33-E37 IonicContact ND1-OE2 3.71Å; H33-E37 PolarHBondContact ND1-OE2 3.47Å; H33-E37 WeakPolarHBondContact O-CB 3.2Å; H33-E37 PolarHBondContact O-N 3.3Å; E37-G39 VanDerWaalsContact C-N 3.33Å
38	K	88.7	Confident	91.9	Very high	98 Å²	98	71.1 Å²	71.1	43%	0.426	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.5	174.1	-68	-173.4	-179.3	178.5	0	114	H33 L34 S91	H33-K38 WeakPolarHBondContact NE2-CE 3.37Å; H33-K38 PolarHBondContact O-N 3.29Å; L34-K38 HydrophobicContact CD2-CD 4.24Å; L34-K38 WeakPolarHBondContact O-CB 3.47Å; K38-S91 PolarHBondContact NZ-O 2.8Å
39	G	89.1	Confident	92	Very high	55 Å²	55	72.3 Å²	72.3	57%	0.567	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	56	178.7	0	0	0	0	0	113.7	F35 L36 E37 N41	F35-G39 WeakPolarHBondContact O-CA 3.48Å; F35-G39 PolarHBondContact O-N 2.92Å; L36-G39 PolarHBondContact O-N 2.97Å; E37-G39 VanDerWaalsContact C-N 3.33Å; G39-N41 PolarHBondContact O-N 3.47Å
40	Y	94.8	Very high	91.8	Very high	27 Å²	27	75.9 Å²	75.9	11%	0.106	37%	0.372	C	S	.	.			trans	-68.7	127.5	-178.6	-173.6	-90.3	0	0	0	111.9	F35 K42 D87 R89 L90 M109 W111	F35-Y40 AromaticContact CD1-CD1 3.77Å; F35-Y40 HydrophobicContact CD1-CD1 3.77Å; F35-Y40 AromaticContact CD1-CG 3.94Å; F35-Y40 HydrophobicContact CD1-CG 3.94Å; F35-Y40 AromaticContact CE1-CD1 3.52Å; F35-Y40 HydrophobicContact CE1-CD1 3.52Å; F35-Y40 HydrophobicContact CE1-CE1 4.04Å; F35-Y40 AromaticContact CE1-CG 3.93Å; F35-Y40 HydrophobicContact CE1-CG 3.93Å; F35-Y40 PolarHBondContact O-N 3.03Å; F35-Y40 VanDerWaalsContact O-N 3.1Å; Y40-K42 HydrophobicContact CE1-CB 3.98Å; Y40-D87 VanDerWaalsContact CE2-OD2 3.27Å; Y40-D87 WeakPolarHBondContact CE2-OD2 3.38Å; Y40-D87 PolarHBondContact OH-OD2 2.82Å; Y40-R89 HydrophobicContact CD2-CB 3.92Å; Y40-R89 HydrophobicContact CE2-CB 4.06Å; Y40-R89 PolarHBondContact OH-NH2 3.05Å; Y40-L90 HydrophobicContact CD2-CD2 3.85Å; Y40-L90 HydrophobicContact CD2-CG 4.32Å; Y40-L90 HydrophobicContact CE2-CD1 4.19Å; Y40-L90 HydrophobicContact CE2-CD2 3.73Å; Y40-L90 HydrophobicContact CE2-CG 3.77Å; Y40-M109 WeakPolarHBondContact CE1-O 3.42Å; Y40-W111 WeakPolarHBondContact OH-CB 3.45Å; Y40-W111 PolarHBondContact OH-N 3.2Å
41	N	92.8	Very high	91.6	Very high	66 Å²	66	83.5 Å²	83.5	35%	0.353	41%	0.408	S	S	.	.			trans	-115.6	116	171.6	-173.2	-9.5	0	0	0	110.6	G39 E43 L44 R89	G39-N41 PolarHBondContact O-N 3.47Å; N41-E43 VanDerWaalsContact C-N 3.31Å; N41-E43 PolarHBondContact O-N 3.26Å; N41-E43 PolarHBondContact OD1-N 3.32Å; N41-L44 HydrophobicContact CB-CD1 4.11Å; N41-L44 HydrophobicContact CB-CG 4.31Å; N41-L44 PolarHBondContact O-N 3.21Å; N41-R89 PolarHBondContact O-NH1 2.73Å
42	K	91.9	Very high	91.6	Very high	100 Å²	100	84.5 Å²	84.5	44%	0.435	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.2	-179.5	69.4	173.5	-179.5	175.1	0	114.7	Y40 L44 S108 W111	Y40-K42 HydrophobicContact CE1-CB 3.98Å; K42-L44 PolarHBondContact O-N 3.15Å; K42-S108 VanDerWaalsContact CD-O 3.28Å; K42-S108 WeakPolarHBondContact CD-O 3.36Å; K42-S108 PolarHBondContact NZ-O 3.1Å; K42-W111 WeakPolarHBondContact O-CB 3.45Å; K42-W111 VanDerWaalsContact O-CD1 3.23Å
43	E	91.2	Very high	91.7	Very high	154 Å²	154	84.4 Å²	84.4	72%	0.72	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-16.5	179.7	-61.7	-178.5	174.3	0	0	111.6	N41	N41-E43 VanDerWaalsContact C-N 3.31Å; N41-E43 PolarHBondContact O-N 3.26Å; N41-E43 PolarHBondContact OD1-N 3.32Å
44	L	91.5	Very high	91.8	Very high	103 Å²	103	82.7 Å²	82.7	54%	0.539	41%	0.406	S	S	.	.	S	Bend	trans	-96	129.2	180	-61.1	178	0	0	0	110.6	N41 K42 R89	N41-L44 HydrophobicContact CB-CD1 4.11Å; N41-L44 HydrophobicContact CB-CG 4.31Å; N41-L44 PolarHBondContact O-N 3.21Å; K42-L44 PolarHBondContact O-N 3.15Å; L44-R89 PolarHBondContact O-NH1 2.76Å; L44-R89 PolarHBondContact O-NH2 2.85Å
45	R	92.9	Very high	91.9	Very high	40 Å²	40	85.8 Å²	85.8	15%	0.151	42%	0.423	C	S	.	.			trans	-61.6	144	172	59.1	175.6	-178.1	118.7	0.3	111.5	V47 Q50 E52 W111	R45-V47 VanDerWaalsContact C-N 3.31Å; R45-V47 HydrophobicContact CG-CG2 4.11Å; R45-V47 PolarHBondContact O-N 2.89Å; R45-Q50 PolarHBondContact NH2-O 3.5Å; R45-E52 PolarHBondContact NH1-O 3.49Å; R45-W111 HydrophobicContact CB-CZ2 4.16Å
46	P	94.3	Very high	92.1	Very high	10 Å²	10	84.2 Å²	84.2	7%	0.065	42%	0.416	C	S	.	.	S	Bend	trans	-81	69.3	-171.9	33.6	-39	0	0	0	113.3	V54 D87 W111	P46-V54 HydrophobicContact CG-CG1 4.24Å; P46-V54 HydrophobicContact CG-CG2 4.02Å; P46-D87 HydrophobicContact CB-CB 3.85Å; P46-D87 VanDerWaalsContact CB-OD1 3.31Å; P46-D87 WeakPolarHBondContact CB-OD1 3.43Å; P46-D87 HydrophobicContact CG-CB 4.35Å; P46-W111 VanDerWaalsContact CD-CD2 3.46Å; P46-W111 VanDerWaalsContact CD-CE3 3.47Å; P46-W111 HydrophobicContact CG-CD2 4.26Å; P46-W111 HydrophobicContact CG-CE3 3.77Å; P46-W111 HydrophobicContact CG-CZ3 3.91Å
47	V	93.8	Very high	92.3	Very high	23 Å²	23	80.1 Å²	80.1	14%	0.139	39%	0.392	C	S	.	.			trans	-120.2	149.5	175.7	-62.8	0	0	0	0	112.1	R45 K49 E52 V54 Y88	R45-V47 VanDerWaalsContact C-N 3.31Å; R45-V47 HydrophobicContact CG-CG2 4.11Å; R45-V47 PolarHBondContact O-N 2.89Å; V47-K49 WeakPolarHBondContact CB-O 3.44Å; V47-K49 WeakPolarHBondContact CG2-O 3.1Å; V47-E52 HydrophobicContact CB-CB 4.18Å; V47-E52 HydrophobicContact CG1-CB 4.16Å; V47-V54 HydrophobicContact CG1-CG2 3.58Å; V47-Y88 VanDerWaalsContact C-CE1 3.42Å; V47-Y88 WeakPolarHBondContact O-CE1 3.27Å; V47-Y88 PolarHBondContact O-OH 3.22Å
48	K	90.8	Very high	92.6	Very high	155 Å²	155	73.2 Å²	73.2	67%	0.674	36%	0.36	S	S	*	.	S	Bend	trans	-84.2	-36.2	174.5	-64.8	-179.2	-177.8	177	0	110.6	E52 Y88	K48-E52 WeakPolarHBondContact CB-OE2 3.4Å; K48-E52 PolarHBondContact N-OE2 2.84Å; K48-Y88 HydrophobicContact CG-CD1 4.06Å; K48-Y88 HydrophobicContact CG-CD2 4.16Å; K48-Y88 HydrophobicContact CG-CE1 3.98Å; K48-Y88 HydrophobicContact CG-CE2 4.07Å; K48-Y88 HydrophobicContact CG-CG 4.14Å
49	K	92.3	Very high	92.9	Very high	134 Å²	134	68.7 Å²	68.7	58%	0.583	34%	0.341	S	S	*	.	S	Bend	trans	-122	148.1	175.9	-60.2	176.5	-175.5	171.4	0	110.6	V47 Q51 E52	V47-K49 WeakPolarHBondContact CB-O 3.44Å; V47-K49 WeakPolarHBondContact CG2-O 3.1Å; K49-Q51 PolarHBondContact O-N 3.23Å; K49-E52 HydrophobicContact CB-CG 4.09Å; K49-E52 PolarHBondContact N-OE2 2.88Å; K49-E52 VanDerWaalsContact N-OE2 3.12Å; K49-E52 WeakPolarHBondContact O-CB 3.37Å; K49-E52 PolarHBondContact O-N 3.23Å; K49-E52 VanDerWaalsContact O-N 3.1Å
50	Q	86.6	Confident	93.2	Very high	158 Å²	158	66.1 Å²	66.1	74%	0.738	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-24.7	-179.5	-168.5	176.1	-1	0	0	113.1	R45 E52	R45-Q50 PolarHBondContact NH2-O 3.5Å; Q50-E52 VanDerWaalsContact C-N 3.33Å
51	Q	88.8	Confident	93.2	Very high	160 Å²	160	66.5 Å²	66.5	75%	0.748	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-10.6	178.5	-63.5	80.2	4.7	0	0	113.6	K49	K49-Q51 PolarHBondContact O-N 3.23Å
52	E	93.6	Very high	93.3	Very high	71 Å²	71	63.5 Å²	63.5	33%	0.332	30%	0.303	S	S	.	.			trans	-76.2	152.2	178.3	-70.4	164.8	-174.5	0	0	110.6	R45 V47 K48 K49 Q50	R45-E52 PolarHBondContact NH1-O 3.49Å; V47-E52 HydrophobicContact CB-CB 4.18Å; V47-E52 HydrophobicContact CG1-CB 4.16Å; K48-E52 WeakPolarHBondContact CB-OE2 3.4Å; K48-E52 PolarHBondContact N-OE2 2.84Å; K49-E52 HydrophobicContact CB-CG 4.09Å; K49-E52 PolarHBondContact N-OE2 2.88Å; K49-E52 VanDerWaalsContact N-OE2 3.12Å; K49-E52 WeakPolarHBondContact O-CB 3.37Å; K49-E52 PolarHBondContact O-N 3.23Å; K49-E52 VanDerWaalsContact O-N 3.1Å; Q50-E52 VanDerWaalsContact C-N 3.33Å
53	V	93.3	Very high	93.3	Very high	61 Å²	61	59.7 Å²	59.7	37%	0.37	29%	0.289	S	S	.	.			trans	-113.2	140.2	-179.5	-166.7	0	0	0	0	107.7	K179 E180 K182	V53-K179 WeakPolarHBondContact CG2-O 3.49Å; V53-E180 WeakPolarHBondContact CA-O 3.46Å; V53-E180 WeakPolarHBondContact CG1-O 3.4Å; V53-K182 HydrophobicContact CG1-CB 3.79Å
54	V	95.3	Very high	93.4	Very high	8 Å²	8	54.4 Å²	54.4	5%	0.048	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.5	173.9	-175.4	0	0	0	0	108.4	P46 V47 V56 W85 W111 E180 I181 K182	P46-V54 HydrophobicContact CG-CG1 4.24Å; P46-V54 HydrophobicContact CG-CG2 4.02Å; V47-V54 HydrophobicContact CG1-CG2 3.58Å; V54-V56 HydrophobicContact CG1-CG2 4.16Å; V54-W85 HydrophobicContact CG1-CB 4.39Å; V54-W111 HydrophobicContact CB-CH2 4.48Å; V54-W111 HydrophobicContact CG1-CH2 4.09Å; V54-W111 HydrophobicContact CG1-CZ3 4.19Å; V54-E180 PolarHBondContact N-O 2.7Å; V54-I181 HydrophobicContact CB-CG1 4.47Å; V54-I181 CarbonylContact O-C 3.59Å; V54-I181 WeakPolarHBondContact O-CA 3.34Å; V54-K182 PolarHBondContact O-N 3.33Å
55	D	95.3	Very high	93.5	Very high	67 Å²	67	50 Å²	50	36%	0.358	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	121.6	172.1	-69.8	-22.9	0	0	0	108.9	F57 K182 L184	D55-F57 HydrophobicContact CB-CE2 4.27Å; D55-K182 WeakPolarHBondContact OD1-CB 3.49Å; D55-K182 WeakPolarHBondContact OD1-CD 3.37Å; D55-L184 HydrophobicContact CB-CD1 4.24Å
56	V	95.8	Very high	93.4	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	113.9	178	178.6	0	0	0	0	108.1	V54 A84 W85 P113 I115 I181 K182 M183 L184	V54-V56 HydrophobicContact CG1-CG2 4.16Å; V56-A84 WeakPolarHBondContact CA-O 2.96Å; V56-W85 HydrophobicContact CG2-CB 4.17Å; V56-P113 HydrophobicContact CG1-CB 4.19Å; V56-P113 HydrophobicContact CG1-CG 3.87Å; V56-P113 HydrophobicContact CG2-CB 3.92Å; V56-P113 HydrophobicContact CG2-CG 4.1Å; V56-I115 HydrophobicContact CG1-CD1 3.7Å; V56-I181 HydrophobicContact CB-CG2 4.02Å; V56-I181 HydrophobicContact CG2-CG2 3.52Å; V56-K182 PolarHBondContact N-O 3.36Å; V56-M183 WeakPolarHBondContact O-CA 3.17Å; V56-L184 PolarHBondContact O-N 3.48Å
57	F	95.7	Very high	93.3	Very high	45 Å²	45	53.3 Å²	53.3	20%	0.197	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.7	176.1	-59.5	-86.6	0	0	0	109.5	D55 H83 A84 L184 L185 E187	D55-F57 HydrophobicContact CB-CE2 4.27Å; F57-H83 WeakPolarHBondContact O-CA 3.44Å; F57-A84 HydrophobicContact CB-CB 4.17Å; F57-A84 PolarHBondContact N-O 3.47Å; F57-A84 PolarHBondContact O-N 2.64Å; F57-L184 CarbonylContact C-O 3.45Å; F57-L184 WeakPolarHBondContact CA-O 3.4Å; F57-L184 HydrophobicContact CD1-CB 3.81Å; F57-L184 HydrophobicContact CD1-CD1 4.43Å; F57-L184 HydrophobicContact CE1-CB 4Å; F57-L184 HydrophobicContact CE1-CD1 3.79Å; F57-L184 HydrophobicContact CZ-CD1 4.09Å; F57-L185 WeakPolarHBondContact CD1-O 3.5Å; F57-E187 HydrophobicContact CE1-CG 4.27Å
58	L	95.7	Very high	93.3	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.3	-179.4	-165.2	78.4	0	0	0	109.7	I81 D82 I115 F171 L184 L185 K186 I238 F240	L58-I81 HydrophobicContact CD1-CG2 3.55Å; L58-I81 HydrophobicContact CG-CG2 4.4Å; L58-D82 CarbonylContact C-O 3.33Å; L58-D82 VanDerWaalsContact CA-O 3.28Å; L58-D82 WeakPolarHBondContact CA-O 3.28Å; L58-I115 HydrophobicContact CD1-CD1 4.26Å; L58-I115 HydrophobicContact CD1-CG2 4.47Å; L58-F171 HydrophobicContact CD2-CB 4Å; L58-F171 HydrophobicContact CD2-CD2 4.39Å; L58-F171 HydrophobicContact CD2-CG 4.2Å; L58-L184 PolarHBondContact N-O 3.49Å; L58-L185 WeakPolarHBondContact O-CA 3.47Å; L58-K186 PolarHBondContact O-N 3.1Å; L58-I238 HydrophobicContact CB-CD1 3.78Å; L58-I238 HydrophobicContact CD2-CB 4.07Å; L58-I238 HydrophobicContact CD2-CD1 4.02Å; L58-I238 HydrophobicContact CD2-CG2 4.08Å; L58-F240 HydrophobicContact CD2-CE2 3.76Å; L58-F240 HydrophobicContact CD2-CZ 4.08Å; L58-F240 HydrophobicContact CG-CE2 4.48Å; L58-F240 HydrophobicContact CG-CZ 4.39Å
59	A	95.3	Very high	93.3	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.033	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	160.2	162.4	0	0	0	0	0	110.3	D82 K186	A59-D82 HydrophobicContact CB-CB 3.95Å; A59-D82 PolarHBondContact N-O 3.04Å; A59-D82 PolarHBondContact O-N 2.86Å; A59-K186 HydrophobicContact CB-CB 3.62Å; A59-K186 HydrophobicContact CB-CD 3.84Å; A59-K186 HydrophobicContact CB-CG 4.4Å
60	L	95.4	Very high	93.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.1	180	-166.5	73.5	0	0	0	109.1	V79 I81 L169 F171 I200 V201 F240	L60-V79 HydrophobicContact CD1-CB 3.77Å; L60-V79 HydrophobicContact CD1-CG1 4.29Å; L60-V79 HydrophobicContact CD1-CG2 3.84Å; L60-V79 HydrophobicContact CD2-CG1 4.27Å; L60-V79 HydrophobicContact CG-CB 4.2Å; L60-V79 HydrophobicContact CG-CG1 4.32Å; L60-I81 HydrophobicContact CD1-CG1 3.98Å; L60-L169 HydrophobicContact CD2-CD1 3.95Å; L60-F171 HydrophobicContact CD1-CE2 4.28Å; L60-F171 HydrophobicContact CD1-CZ 4.17Å; L60-F171 HydrophobicContact CD2-CE2 4.46Å; L60-I200 HydrophobicContact CB-CG2 4.47Å; L60-I200 HydrophobicContact CD2-CD1 4.5Å; L60-I200 HydrophobicContact CD2-CG1 4.34Å; L60-I200 HydrophobicContact CD2-CG2 4.31Å; L60-I200 HydrophobicContact CG-CG2 4.46Å; L60-I200 WeakPolarHBondContact O-CG2 3.25Å; L60-V201 PolarHBondContact O-N 2.85Å; L60-F240 HydrophobicContact CB-CD1 3.75Å; L60-F240 HydrophobicContact CB-CD2 4.2Å; L60-F240 HydrophobicContact CB-CE1 3.51Å; L60-F240 HydrophobicContact CB-CE2 3.97Å; L60-F240 HydrophobicContact CB-CG 4.1Å; L60-F240 HydrophobicContact CB-CZ 3.63Å; L60-F240 HydrophobicContact CD2-CB 4.05Å; L60-F240 HydrophobicContact CD2-CD1 4.2Å; L60-F240 HydrophobicContact CD2-CD2 4Å; L60-F240 HydrophobicContact CD2-CG 3.82Å
61	T	94.9	Very high	93	Very high	36 Å²	36	41.3 Å²	41.3	22%	0.221	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	118.7	171	-53.2	0	0	0	0	108.9	V79 W80 V201	T61-V79 CarbonylContact O-C 3.53Å; T61-V79 VanDerWaalsContact O-CA 3.29Å; T61-V79 WeakPolarHBondContact O-CA 3.43Å; T61-W80 PolarHBondContact N-O 3.45Å; T61-W80 PolarHBondContact O-N 3.35Å; T61-V201 CarbonylContact C-O 3.59Å; T61-V201 VanDerWaalsContact CA-O 3.26Å; T61-V201 WeakPolarHBondContact CA-O 3.47Å; T61-V201 HydrophobicContact CG2-CB 4.31Å; T61-V201 HydrophobicContact CG2-CG1 4.27Å
62	L	95.2	Very high	92.9	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.1	177	178.6	69	0	0	0	109.1	T77 V79 I200 V201 I202 F207 I215 L242	L62-T77 HydrophobicContact CD1-CG2 4.07Å; L62-V79 HydrophobicContact CD1-CG1 3.7Å; L62-I200 HydrophobicContact CB-CG2 3.65Å; L62-V201 PolarHBondContact N-O 2.8Å; L62-I202 HydrophobicContact CB-CG1 4.27Å; L62-I202 HydrophobicContact CD2-CD1 4.16Å; L62-F207 HydrophobicContact CD2-CE2 4.14Å; L62-F207 HydrophobicContact CG-CE2 4.35Å; L62-I215 HydrophobicContact CD2-CD1 3.58Å; L62-L242 HydrophobicContact CD2-CD2 4.25Å
63	S	92.7	Very high	92.8	Very high	20 Å²	20	37 Å²	37	14%	0.14	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-55.8	173.8	172.7	0	0	0	0	110.2	N78 F207	S63-N78 WeakPolarHBondContact CB-O 3.42Å; S63-N78 PolarHBondContact N-O 2.85Å; S63-F207 WeakPolarHBondContact O-CD2 3.43Å
64	N	92.1	Very high	92.7	Very high	44 Å²	44	34.7 Å²	34.7	24%	0.235	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	140.6	-179.6	-69.9	-27.7	0	0	0	111.4	N78 T208	N64-N78 HydrophobicContact CB-CB 4.33Å; N64-N78 PolarHBondContact N-O 3.49Å; N64-N78 PolarHBondContact O-N 3.13Å; N64-T208 VanDerWaalsContact CG-OG1 3.27Å; N64-T208 PolarHBondContact OD1-N 2.99Å; N64-T208 PolarHBondContact OD1-OG1 2.94Å
65	L	93.6	Very high	92.7	Very high	9 Å²	9	34.3 Å²	34.3	5%	0.047	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	100.1	164	-168.8	159.1	0	0	0	108.4	L75 N210 W213 I215 I244	L65-L75 HydrophobicContact CD1-CD1 4.44Å; L65-L75 HydrophobicContact CD2-CD1 4.32Å; L65-L75 HydrophobicContact CG-CD1 4.22Å; L65-N210 HydrophobicContact CD2-CB 4.38Å; L65-N210 VanDerWaalsContact CD2-ND2 3.32Å; L65-N210 WeakPolarHBondContact CD2-ND2 3.23Å; L65-N210 PolarHBondContact O-ND2 3.15Å; L65-W213 HydrophobicContact CD2-CB 4.36Å; L65-I215 HydrophobicContact CD1-CD1 4.43Å; L65-I215 HydrophobicContact CD1-CG1 4.31Å; L65-I244 HydrophobicContact CD1-CD1 4.4Å; L65-I244 HydrophobicContact CD1-CG2 3.88Å
66	I	91.9	Very high	92.6	Very high	85 Å²	85	32.1 Å²	32.1	44%	0.436	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	-57.5	-170.3	-58.8	174.3	0	0	0	110.5	L76 N78 I148 N210	I66-L76 HydrophobicContact CB-CB 4Å; I66-L76 HydrophobicContact CG2-CB 4.43Å; I66-L76 PolarHBondContact N-O 3.24Å; I66-N78 HydrophobicContact CD1-CB 4.3Å; I66-I148 HydrophobicContact CD1-CG2 4.33Å; I66-N210 PolarHBondContact O-ND2 2.78Å
67	S	91.6	Very high	92.5	Very high	35 Å²	35	32.1 Å²	32.1	25%	0.245	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	154.4	177.8	57.7	0	0	0	0	111.4	L76	S67-L76 PolarHBondContact N-O 3.37Å; S67-L76 PolarHBondContact O-N 3.43Å; S67-L76 WeakPolarHBondContact OG-CD1 3.47Å
68	L	92.9	Very high	92.4	Very high	6 Å²	6	31.8 Å²	31.8	3%	0.031	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	114	163.3	-178.9	69.8	0	0	0	106.8	L75 C153 I155 Q165 W213 I244	L68-L75 HydrophobicContact CB-CD1 4.29Å; L68-L75 HydrophobicContact CD1-CB 3.68Å; L68-L75 HydrophobicContact CD1-CD1 4.06Å; L68-L75 HydrophobicContact CD1-CG 4.46Å; L68-C153 HydrophobicContact CD1-CB 4.44Å; L68-I155 HydrophobicContact CD1-CD1 3.96Å; L68-I155 HydrophobicContact CD2-CD1 3.69Å; L68-I155 HydrophobicContact CG-CD1 3.98Å; L68-Q165 HydrophobicContact CD2-CB 4.25Å; L68-Q165 HydrophobicContact CD2-CG 3.92Å; L68-W213 HydrophobicContact CB-CZ2 4.12Å; L68-W213 HydrophobicContact CD2-CH2 3.71Å; L68-W213 HydrophobicContact CD2-CZ2 3.49Å; L68-W213 VanDerWaalsContact CD2-CZ2 3.49Å; L68-W213 HydrophobicContact CD2-CZ3 4.4Å; L68-W213 HydrophobicContact CG-CZ2 4.29Å; L68-I244 HydrophobicContact CD2-CD1 3.95Å
69	K	90.4	Very high	92.3	Very high	98 Å²	98	31.7 Å²	31.7	43%	0.426	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	113	175.5	-65.3	-176	178.8	-177.4	0	109	D72 E73 T74	K69-D72 HydrophobicContact CB-CB 4.21Å; K69-D72 VanDerWaalsContact CD-OD2 3.25Å; K69-D72 WeakPolarHBondContact CD-OD2 3.5Å; K69-D72 IonicContact NZ-OD2 2.64Å; K69-E73 WeakPolarHBondContact O-CA 3.49Å; K69-E73 PolarHBondContact O-N 3.01Å; K69-T74 PolarHBondContact N-O 2.89Å; K69-T74 PolarHBondContact O-N 2.94Å
70	E	88.6	Confident	92.2	Very high	24 Å²	24	36.7 Å²	36.7	11%	0.112	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-36.7	-175.8	-57.7	85	168.4	0	0	112.5	D72 E73 I155 R246 P302	E70-D72 VanDerWaalsContact C-N 3.31Å; E70-D72 PolarHBondContact O-N 2.81Å; E70-E73 PolarHBondContact O-N 2.84Å; E70-I155 HydrophobicContact CB-CG1 4.42Å; E70-I155 HydrophobicContact CB-CG2 4.48Å; E70-I155 HydrophobicContact CG-CG2 4.29Å; E70-R246 IonicContact OE1-CZ 3.85Å; E70-R246 IonicContact OE1-NH1 3.97Å; E70-R246 PolarHBondContact OE1-NH1 2.85Å; E70-R246 IonicContact OE1-NH2 3.83Å; E70-R246 PolarHBondContact OE1-NH2 2.98Å; E70-P302 HydrophobicContact CB-CG 4.39Å; E70-P302 WeakPolarHBondContact O-CB 3.05Å
71	V	85.7	Confident	92.1	Very high	90 Å²	90	36.9 Å²	36.9	55%	0.545	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-40.7	179	-178.9	0	0	0	0	111.4
72	D	86.7	Confident	92.1	Very high	82 Å²	82	35.5 Å²	35.5	44%	0.439	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-6.4	-179.1	-60	-27.8	0	0	0	112.4	K69 E70 T74 N121	K69-D72 HydrophobicContact CB-CB 4.21Å; K69-D72 VanDerWaalsContact CD-OD2 3.25Å; K69-D72 WeakPolarHBondContact CD-OD2 3.5Å; K69-D72 IonicContact NZ-OD2 2.64Å; E70-D72 VanDerWaalsContact C-N 3.31Å; E70-D72 PolarHBondContact O-N 2.81Å; D72-T74 HydrophobicContact CB-CG2 4.16Å; D72-T74 WeakPolarHBondContact O-CG2 3.35Å; D72-T74 PolarHBondContact O-N 3.23Å; D72-N121 PolarHBondContact O-ND2 2.9Å
73	E	90.6	Very high	92.1	Very high	60 Å²	60	35.5 Å²	35.5	28%	0.28	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	41.9	-170.2	-61	-164.7	127.1	0	0	113.3	K69 E70 C153 I155	K69-E73 WeakPolarHBondContact O-CA 3.49Å; K69-E73 PolarHBondContact O-N 3.01Å; E70-E73 PolarHBondContact O-N 2.84Å; E73-C153 PolarHBondContact O-N 2.9Å; E73-I155 HydrophobicContact CG-CG1 4.19Å; E73-I155 PolarHBondContact OE1-N 2.9Å
74	T	92.1	Very high	92.2	Very high	11 Å²	11	34.9 Å²	34.9	7%	0.067	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.1	-176.8	52	0	0	0	0	113.4	K69 D72 N121 S151	K69-T74 PolarHBondContact N-O 2.89Å; K69-T74 PolarHBondContact O-N 2.94Å; D72-T74 HydrophobicContact CB-CG2 4.16Å; D72-T74 WeakPolarHBondContact O-CG2 3.35Å; D72-T74 PolarHBondContact O-N 3.23Å; T74-N121 HydrophobicContact CG2-CB 3.71Å; T74-N121 WeakPolarHBondContact CG2-ND2 3.43Å; T74-S151 WeakPolarHBondContact CA-O 3.48Å
75	L	94.3	Very high	92.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.4	170	173.4	68.4	0	0	0	110	L65 L68 T77 R150 S151 C153 C167 L242	L65-L75 HydrophobicContact CD1-CD1 4.44Å; L65-L75 HydrophobicContact CD2-CD1 4.32Å; L65-L75 HydrophobicContact CG-CD1 4.22Å; L68-L75 HydrophobicContact CB-CD1 4.29Å; L68-L75 HydrophobicContact CD1-CB 3.68Å; L68-L75 HydrophobicContact CD1-CD1 4.06Å; L68-L75 HydrophobicContact CD1-CG 4.46Å; L75-T77 HydrophobicContact CD1-CG2 4.14Å; L75-T77 HydrophobicContact CD2-CG2 3.97Å; L75-T77 HydrophobicContact CG-CG2 3.86Å; L75-R150 WeakPolarHBondContact O-CA 3.38Å; L75-S151 WeakPolarHBondContact CB-OG 3.47Å; L75-S151 PolarHBondContact N-O 3.04Å; L75-S151 PolarHBondContact O-N 2.7Å; L75-S151 PolarHBondContact O-OG 3.3Å; L75-C153 HydrophobicContact CB-CB 4.44Å; L75-C167 HydrophobicContact CD2-CB 3.59Å; L75-L242 HydrophobicContact CD2-CD1 4.13Å
76	L	93.3	Very high	92.5	Very high	22 Å²	22	36 Å²	36	12%	0.115	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	116.6	174.7	-63.7	-174.7	0	0	0	110.8	I66 S67 F149 R150	I66-L76 HydrophobicContact CB-CB 4Å; I66-L76 HydrophobicContact CG2-CB 4.43Å; I66-L76 PolarHBondContact N-O 3.24Å; S67-L76 PolarHBondContact N-O 3.37Å; S67-L76 PolarHBondContact O-N 3.43Å; S67-L76 WeakPolarHBondContact OG-CD1 3.47Å; L76-F149 WeakPolarHBondContact CA-O 3.43Å; L76-R150 HydrophobicContact CD2-CB 3.96Å; L76-R150 HydrophobicContact CD2-CG 3.34Å
77	T	93.4	Very high	92.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	142.6	179.7	50.1	0	0	0	0	111.1	L62 L75 I148 F149 L242	L62-T77 HydrophobicContact CD1-CG2 4.07Å; L75-T77 HydrophobicContact CD1-CG2 4.14Å; L75-T77 HydrophobicContact CD2-CG2 3.97Å; L75-T77 HydrophobicContact CG-CG2 3.86Å; T77-I148 CarbonylContact O-C 3.52Å; T77-I148 WeakPolarHBondContact O-CA 3.35Å; T77-F149 PolarHBondContact N-O 3.09Å; T77-F149 VanDerWaalsContact N-O 3.1Å; T77-F149 PolarHBondContact O-N 3.21Å; T77-L242 HydrophobicContact CG2-CD1 4.27Å
78	N	93.1	Very high	92.7	Very high	38 Å²	38	34.8 Å²	34.8	20%	0.203	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	113.3	167.5	-177.2	19.2	0	0	0	108.2	S63 N64 I66 A147	S63-N78 WeakPolarHBondContact CB-O 3.42Å; S63-N78 PolarHBondContact N-O 2.85Å; N64-N78 HydrophobicContact CB-CB 4.33Å; N64-N78 PolarHBondContact N-O 3.49Å; N64-N78 PolarHBondContact O-N 3.13Å; I66-N78 HydrophobicContact CD1-CB 4.3Å; N78-A147 PolarHBondContact OD1-O 3.46Å
79	V	93.7	Very high	92.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	153.8	-171.4	-60.3	0	0	0	0	110.9	L60 T61 L62 I81 P146 A147 F149	L60-V79 HydrophobicContact CD1-CB 3.77Å; L60-V79 HydrophobicContact CD1-CG1 4.29Å; L60-V79 HydrophobicContact CD1-CG2 3.84Å; L60-V79 HydrophobicContact CD2-CG1 4.27Å; L60-V79 HydrophobicContact CG-CB 4.2Å; L60-V79 HydrophobicContact CG-CG1 4.32Å; T61-V79 CarbonylContact O-C 3.53Å; T61-V79 VanDerWaalsContact O-CA 3.29Å; T61-V79 WeakPolarHBondContact O-CA 3.43Å; L62-V79 HydrophobicContact CD1-CG1 3.7Å; V79-I81 HydrophobicContact CG2-CG1 4.3Å; V79-P146 WeakPolarHBondContact O-CA 3.26Å; V79-A147 HydrophobicContact CG2-CB 4.08Å; V79-A147 PolarHBondContact N-O 2.99Å; V79-A147 PolarHBondContact O-N 3.36Å; V79-F149 HydrophobicContact CG2-CD2 3.46Å; V79-F149 VanDerWaalsContact CG2-CD2 3.46Å; V79-F149 HydrophobicContact CG2-CE2 3.67Å
80	W	94.1	Very high	93	Very high	109 Å²	109	31.7 Å²	31.7	41%	0.413	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.7	170.4	-61.4	52.6	0	0	0	106.4	T61 L144 P146	T61-W80 PolarHBondContact N-O 3.45Å; T61-W80 PolarHBondContact O-N 3.35Å; W80-L144 HydrophobicContact CB-CD1 4.07Å; W80-L144 HydrophobicContact CB-CG 4.31Å; W80-L144 HydrophobicContact CE3-CD2 3.58Å; W80-L144 HydrophobicContact CE3-CG 3.83Å; W80-L144 HydrophobicContact CZ3-CD2 4.08Å; W80-P146 HydrophobicContact CD2-CB 4.37Å
81	I	93.8	Very high	93.2	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	114.4	-176.2	-46.2	170.5	0	0	0	107.3	L58 L60 V79 H83 L144 P145 A147 F149 F171	L58-I81 HydrophobicContact CD1-CG2 3.55Å; L58-I81 HydrophobicContact CG-CG2 4.4Å; L60-I81 HydrophobicContact CD1-CG1 3.98Å; V79-I81 HydrophobicContact CG2-CG1 4.3Å; I81-H83 WeakPolarHBondContact CG2-CE1 3.36Å; I81-H83 PolarHBondContact O-ND1 3.05Å; I81-L144 WeakPolarHBondContact O-CA 3.44Å; I81-P145 PolarHBondContact N-O 3.48Å; I81-P145 VanDerWaalsContact O-CD 3.26Å; I81-P145 WeakPolarHBondContact O-CD 3.29Å; I81-A147 HydrophobicContact CD1-CB 4.05Å; I81-A147 HydrophobicContact CG1-CB 4.43Å; I81-F149 HydrophobicContact CD1-CE2 3.47Å; I81-F149 VanDerWaalsContact CD1-CE2 3.47Å; I81-F149 HydrophobicContact CD1-CZ 3.49Å; I81-F149 VanDerWaalsContact CD1-CZ 3.49Å; I81-F149 HydrophobicContact CG1-CE2 4.1Å; I81-F171 HydrophobicContact CD1-CE1 4.02Å; I81-F171 HydrophobicContact CD1-CZ 4.43Å
82	D	94.6	Very high	93.6	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.032	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.9	177.1	-177.4	-11.9	0	0	0	108.5	L58 A59 Y142 L144 K186	L58-D82 CarbonylContact C-O 3.33Å; L58-D82 VanDerWaalsContact CA-O 3.28Å; L58-D82 WeakPolarHBondContact CA-O 3.28Å; A59-D82 HydrophobicContact CB-CB 3.95Å; A59-D82 PolarHBondContact N-O 3.04Å; A59-D82 PolarHBondContact O-N 2.86Å; D82-Y142 VanDerWaalsContact CG-CE2 3.42Å; D82-Y142 WeakPolarHBondContact OD1-CE2 3.37Å; D82-Y142 WeakPolarHBondContact OD2-CE2 3.43Å; D82-L144 HydrophobicContact CB-CD1 3.76Å; D82-K186 WeakPolarHBondContact OD2-CD 3.39Å; D82-K186 WeakPolarHBondContact OD2-CE 3.45Å; D82-K186 IonicContact OD2-NZ 3.61Å; D82-K186 PolarHBondContact OD2-NZ 2.74Å
83	H	94.5	Very high	93.9	Very high	2 Å²	2	29 Å²	29	1%	0.009	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.3	171.5	-56.4	84.7	0	0	0	109.2	F57 I81 W85 Y142 W143	F57-H83 WeakPolarHBondContact O-CA 3.44Å; I81-H83 WeakPolarHBondContact CG2-CE1 3.36Å; I81-H83 PolarHBondContact O-ND1 3.05Å; H83-W85 HydrophobicContact CB-CE3 4.24Å; H83-W85 HydrophobicContact CB-CZ3 3.96Å; H83-Y142 WeakPolarHBondContact O-CA 3.49Å; H83-W143 HydrophobicContact CB-CB 4.28Å; H83-W143 HydrophobicContact CB-CE3 4.23Å; H83-W143 AromaticContact CE1-CE3 3.89Å; H83-W143 AromaticContact CE1-CZ3 3.85Å; H83-W143 AromaticContact CG-CE3 3.85Å; H83-W143 PolarHBondContact N-O 2.89Å; H83-W143 AromaticContact ND1-CE3 3.49Å; H83-W143 AromaticContact ND1-CZ3 3.94Å; H83-W143 PolarHBondContact O-N 3.46Å
84	A	95.4	Very high	94	Very high	7 Å²	7	26.6 Å²	26.6	6%	0.058	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133.8	170.1	0	0	0	0	0	111.4	V56 F57 F140 C141	V56-A84 WeakPolarHBondContact CA-O 2.96Å; F57-A84 HydrophobicContact CB-CB 4.17Å; F57-A84 PolarHBondContact N-O 3.47Å; F57-A84 PolarHBondContact O-N 2.64Å; A84-F140 HydrophobicContact CB-CE1 4.28Å; A84-F140 HydrophobicContact CB-CE2 3.93Å; A84-F140 HydrophobicContact CB-CZ 3.51Å; A84-C141 VanDerWaalsContact CA-O 3.29Å; A84-C141 WeakPolarHBondContact CA-O 3.26Å
85	W	95.9	Very high	94	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	171	175.3	70.2	95.4	0	0	0	109.4	V54 V56 H83 W111 L112 P113 V133 C141 W143	V54-W85 HydrophobicContact CG1-CB 4.39Å; V56-W85 HydrophobicContact CG2-CB 4.17Å; H83-W85 HydrophobicContact CB-CE3 4.24Å; H83-W85 HydrophobicContact CB-CZ3 3.96Å; W85-W111 AromaticContact CD1-CE3 3.99Å; W85-W111 AromaticContact CD1-CZ3 3.74Å; W85-W111 HydrophobicContact CG-CZ3 4.12Å; W85-W111 WeakPolarHBondContact CZ2-O 3.49Å; W85-W111 AromaticContact NE1-CE3 3.73Å; W85-W111 AromaticContact NE1-CZ3 3.92Å; W85-L112 HydrophobicContact CH2-CD2 3.64Å; W85-L112 HydrophobicContact CZ2-CD2 4.03Å; W85-P113 HydrophobicContact CE3-CG 4.23Å; W85-V133 HydrophobicContact CH2-CG1 3.89Å; W85-V133 HydrophobicContact CH2-CG2 4.34Å; W85-V133 HydrophobicContact CZ2-CG1 4.21Å; W85-C141 HydrophobicContact CD2-CB 3.78Å; W85-C141 HydrophobicContact CE3-CB 4.25Å; W85-C141 HydrophobicContact CG-CB 4.26Å; W85-C141 HydrophobicContact CH2-CB 4.08Å; W85-C141 HydrophobicContact CZ2-CB 3.58Å; W85-C141 HydrophobicContact CZ3-CB 4.38Å; W85-C141 PolarHBondContact N-O 2.67Å; W85-C141 PolarHBondContact O-N 3.44Å; W85-W143 HydrophobicContact CH2-CB 3.89Å; W85-W143 HydrophobicContact CZ3-CB 3.74Å
86	T	95.6	Very high	93.8	Very high	75 Å²	75	36.7 Å²	36.7	46%	0.46	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.5	177.2	-54	0	0	0	0	110.2
87	D	95.7	Very high	93.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.187	C	C	.	.			trans	-113.2	106.1	171.3	-168	-23.9	0	0	0	110.1	Y40 P46 R89 L90 G139	Y40-D87 VanDerWaalsContact CE2-OD2 3.27Å; Y40-D87 WeakPolarHBondContact CE2-OD2 3.38Å; Y40-D87 PolarHBondContact OH-OD2 2.82Å; P46-D87 HydrophobicContact CB-CB 3.85Å; P46-D87 VanDerWaalsContact CB-OD1 3.31Å; P46-D87 WeakPolarHBondContact CB-OD1 3.43Å; P46-D87 HydrophobicContact CG-CB 4.35Å; D87-R89 PolarHBondContact O-N 3.15Å; D87-R89 VanDerWaalsContact O-N 3.11Å; D87-R89 VanDerWaalsContact OD1-CB 3.29Å; D87-R89 WeakPolarHBondContact OD1-CB 3.29Å; D87-R89 IonicContact OD1-CZ 3.93Å; D87-R89 PolarHBondContact OD1-N 3.25Å; D87-R89 IonicContact OD1-NE 3.18Å; D87-R89 PolarHBondContact OD1-NE 2.99Å; D87-R89 IonicContact OD1-NH2 2.69Å; D87-R89 IonicContact OD2-CZ 3.84Å; D87-R89 IonicContact OD2-NE 2.68Å; D87-R89 PolarHBondContact OD2-NE 3.45Å; D87-R89 IonicContact OD2-NH2 2.9Å; D87-R89 PolarHBondContact OD2-NH2 2.83Å; D87-L90 HydrophobicContact CB-CB 4.39Å; D87-L90 HydrophobicContact CB-CD1 4.08Å; D87-L90 HydrophobicContact CB-CG 4.23Å; D87-L90 PolarHBondContact O-N 2.78Å; D87-L90 VanDerWaalsContact O-N 3.13Å; D87-G139 PolarHBondContact N-O 3.35Å; D87-G139 WeakPolarHBondContact O-CA 3.47Å
88	Y	93.3	Very high	93.3	Very high	95 Å²	95	42.9 Å²	42.9	37%	0.373	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-62.9	-19.1	-179	78.1	-87.5	0	0	0	113.7	V47 K48 L90 S91	V47-Y88 VanDerWaalsContact C-CE1 3.42Å; V47-Y88 WeakPolarHBondContact O-CE1 3.27Å; V47-Y88 PolarHBondContact O-OH 3.22Å; K48-Y88 HydrophobicContact CG-CD1 4.06Å; K48-Y88 HydrophobicContact CG-CD2 4.16Å; K48-Y88 HydrophobicContact CG-CE1 3.98Å; K48-Y88 HydrophobicContact CG-CE2 4.07Å; K48-Y88 HydrophobicContact CG-CG 4.14Å; Y88-L90 VanDerWaalsContact C-N 3.33Å; Y88-S91 PolarHBondContact O-OG 3.48Å
89	R	93.8	Very high	93.2	Very high	39 Å²	39	43.2 Å²	43.2	15%	0.147	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-77.4	-27.5	-179.9	-58.7	170.6	-67.9	-179.8	0.8	111.2	Y40 N41 L44 D87 S91	Y40-R89 HydrophobicContact CD2-CB 3.92Å; Y40-R89 HydrophobicContact CE2-CB 4.06Å; Y40-R89 PolarHBondContact OH-NH2 3.05Å; N41-R89 PolarHBondContact O-NH1 2.73Å; L44-R89 PolarHBondContact O-NH1 2.76Å; L44-R89 PolarHBondContact O-NH2 2.85Å; D87-R89 PolarHBondContact O-N 3.15Å; D87-R89 VanDerWaalsContact O-N 3.11Å; D87-R89 VanDerWaalsContact OD1-CB 3.29Å; D87-R89 WeakPolarHBondContact OD1-CB 3.29Å; D87-R89 IonicContact OD1-CZ 3.93Å; D87-R89 PolarHBondContact OD1-N 3.25Å; D87-R89 IonicContact OD1-NE 3.18Å; D87-R89 PolarHBondContact OD1-NE 2.99Å; D87-R89 IonicContact OD1-NH2 2.69Å; D87-R89 IonicContact OD2-CZ 3.84Å; D87-R89 IonicContact OD2-NE 2.68Å; D87-R89 PolarHBondContact OD2-NE 3.45Å; D87-R89 IonicContact OD2-NH2 2.9Å; D87-R89 PolarHBondContact OD2-NH2 2.83Å; R89-S91 VanDerWaalsContact C-N 3.29Å; R89-S91 PolarHBondContact O-N 2.9Å
90	L	94.1	Very high	93	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-90.5	16.9	179.7	-60.3	177.1	0	0	0	112.7	F35 Y40 D87 Y88 W92 V110 V135	F35-L90 HydrophobicContact CZ-CD2 4.28Å; Y40-L90 HydrophobicContact CD2-CD2 3.85Å; Y40-L90 HydrophobicContact CD2-CG 4.32Å; Y40-L90 HydrophobicContact CE2-CD1 4.19Å; Y40-L90 HydrophobicContact CE2-CD2 3.73Å; Y40-L90 HydrophobicContact CE2-CG 3.77Å; D87-L90 HydrophobicContact CB-CB 4.39Å; D87-L90 HydrophobicContact CB-CD1 4.08Å; D87-L90 HydrophobicContact CB-CG 4.23Å; D87-L90 PolarHBondContact O-N 2.78Å; D87-L90 VanDerWaalsContact O-N 3.13Å; Y88-L90 VanDerWaalsContact C-N 3.33Å; L90-W92 WeakPolarHBondContact O-CZ3 3.29Å; L90-V110 HydrophobicContact CD1-CG1 3.94Å; L90-V135 HydrophobicContact CB-CG1 3.94Å; L90-V135 HydrophobicContact CD1-CG1 4.43Å; L90-V135 HydrophobicContact CD1-CG2 4.34Å
91	S	93.8	Very high	92.9	Very high	42 Å²	42	45.4 Å²	45.4	29%	0.294	25%	0.251	S	S	.	.			trans	-85.4	140.2	171.9	66.2	0	0	0	0	111.6	K38 Y88 R89 Q137	K38-S91 PolarHBondContact NZ-O 2.8Å; Y88-S91 PolarHBondContact O-OG 3.48Å; R89-S91 VanDerWaalsContact C-N 3.29Å; R89-S91 PolarHBondContact O-N 2.9Å; S91-Q137 VanDerWaalsContact CA-O 3.31Å; S91-Q137 WeakPolarHBondContact CA-O 3.43Å
92	W	93.9	Very high	92.9	Very high	21 Å²	21	50.6 Å²	50.6	8%	0.08	28%	0.276	C	S	.	.			trans	-140.4	168.1	172.9	66.9	93.3	0	0	0	111.2	L30 L34 L90 F97 I100 L103 V135 Q137	L30-W92 HydrophobicContact CD1-CB 3.78Å; L30-W92 HydrophobicContact CD1-CD2 3.91Å; L30-W92 HydrophobicContact CD1-CE3 4.41Å; L30-W92 HydrophobicContact CD1-CG 3.59Å; L30-W92 HydrophobicContact CD2-CD2 3.86Å; L30-W92 HydrophobicContact CD2-CE3 4.42Å; L30-W92 HydrophobicContact CD2-CG 4.16Å; L30-W92 HydrophobicContact CD2-CZ2 4.03Å; L30-W92 HydrophobicContact CG-CD2 4.44Å; L34-W92 HydrophobicContact CD1-CE3 3.87Å; L34-W92 HydrophobicContact CD1-CZ3 4.17Å; L34-W92 HydrophobicContact CD2-CE3 4.47Å; L90-W92 WeakPolarHBondContact O-CZ3 3.29Å; W92-F97 HydrophobicContact CB-CD2 4.46Å; W92-F97 HydrophobicContact CB-CE2 4.38Å; W92-I100 HydrophobicContact CZ2-CG2 4.36Å; W92-I100 PolarHBondContact NE1-O 2.68Å; W92-L103 HydrophobicContact CH2-CB 3.72Å; W92-L103 HydrophobicContact CZ2-CB 4.19Å; W92-L103 HydrophobicContact CZ3-CB 4.46Å; W92-V135 HydrophobicContact CH2-CB 4.43Å; W92-V135 HydrophobicContact CH2-CG1 4.18Å; W92-V135 WeakPolarHBondContact CH2-O 3.13Å; W92-V135 HydrophobicContact CZ3-CB 4.45Å; W92-V135 HydrophobicContact CZ3-CG1 3.82Å; W92-Q137 HydrophobicContact CD2-CB 4.5Å; W92-Q137 HydrophobicContact CZ2-CB 4.23Å; W92-Q137 PolarHBondContact N-O 3.34Å; W92-Q137 VanDerWaalsContact N-O 3.11Å
93	N	94.2	Very high	92.9	Very high	75 Å²	75	50.4 Å²	50.4	40%	0.401	28%	0.275	S	S	.	.			trans	-95.4	112.5	174	-176.6	3.1	0	0	0	108.9	S95 E96	N93-S95 PolarHBondContact O-N 3.15Å; N93-S95 VanDerWaalsContact O-N 3.14Å; N93-S95 PolarHBondContact OD1-N 2.93Å; N93-E96 HydrophobicContact CB-CG 4.25Å; N93-E96 PolarHBondContact ND2-OE1 2.84Å; N93-E96 PolarHBondContact O-N 3.02Å
94	A	91.9	Very high	92.9	Very high	10 Å²	10	59 Å²	59	8%	0.083	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-57.6	-31.3	-177.1	0	0	0	0	0	112.8	E96 F97 G99 I100	A94-E96 PolarHBondContact O-N 2.95Å; A94-E96 VanDerWaalsContact O-N 3.17Å; A94-F97 CarbonylContact O-C 3.49Å; A94-F97 PolarHBondContact O-N 3.11Å; A94-F97 VanDerWaalsContact O-N 3.16Å; A94-G99 VanDerWaalsContact O-CA 3.26Å; A94-G99 WeakPolarHBondContact O-CA 3.46Å; A94-G99 PolarHBondContact O-N 3.1Å; A94-I100 WeakPolarHBondContact CB-O 3.43Å
95	S	91.4	Very high	92.8	Very high	110 Å²	110	58.7 Å²	58.7	77%	0.769	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-63.2	-22.4	178.9	-62.3	0	0	0	0	113.8	N93	N93-S95 PolarHBondContact O-N 3.15Å; N93-S95 VanDerWaalsContact O-N 3.14Å; N93-S95 PolarHBondContact OD1-N 2.93Å
96	E	90.3	Very high	92.8	Very high	114 Å²	114	60.4 Å²	60.4	53%	0.533	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-85.9	-19.9	179.7	-69.5	169.6	-151.6	0	0	112.9	R29 N93 A94	R29-E96 PolarHBondContact NH2-O 3.28Å; N93-E96 HydrophobicContact CB-CG 4.25Å; N93-E96 PolarHBondContact ND2-OE1 2.84Å; N93-E96 PolarHBondContact O-N 3.02Å; A94-E96 PolarHBondContact O-N 2.95Å; A94-E96 VanDerWaalsContact O-N 3.17Å
97	F	88.7	Confident	92.6	Very high	10 Å²	10	57.5 Å²	57.5	4%	0.044	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	53.9	-173.6	-60.3	-86.5	0	0	0	110.8	R29 L30 H33 W92 A94 G99 I100	R29-F97 HydrophobicContact CG-CE1 4.32Å; L30-F97 HydrophobicContact CB-CD1 3.78Å; L30-F97 HydrophobicContact CB-CE1 4.18Å; L30-F97 HydrophobicContact CB-CG 4.19Å; L30-F97 HydrophobicContact CD1-CD1 4.04Å; L30-F97 HydrophobicContact CD1-CD2 3.8Å; L30-F97 HydrophobicContact CD1-CE1 4.08Å; L30-F97 HydrophobicContact CD1-CE2 3.86Å; L30-F97 HydrophobicContact CD1-CG 3.9Å; L30-F97 HydrophobicContact CD1-CZ 4Å; L30-F97 HydrophobicContact CG-CD1 4.47Å; L30-F97 HydrophobicContact CG-CG 4.48Å; H33-F97 HydrophobicContact CB-CE1 4.27Å; H33-F97 HydrophobicContact CB-CZ 4.1Å; H33-F97 AromaticContact CD2-CZ 3.71Å; H33-F97 AromaticContact CG-CZ 3.86Å; W92-F97 HydrophobicContact CB-CD2 4.46Å; W92-F97 HydrophobicContact CB-CE2 4.38Å; A94-F97 CarbonylContact O-C 3.49Å; A94-F97 PolarHBondContact O-N 3.11Å; A94-F97 VanDerWaalsContact O-N 3.16Å; F97-G99 PolarHBondContact O-N 3.43Å; F97-G99 VanDerWaalsContact O-N 3.08Å; F97-I100 HydrophobicContact CB-CD1 4.38Å; F97-I100 VanDerWaalsContact O-CD1 3.32Å; F97-I100 WeakPolarHBondContact O-CD1 3.4Å; F97-I100 WeakPolarHBondContact O-CG1 3.45Å; F97-I100 PolarHBondContact O-N 3.45Å; F97-I100 VanDerWaalsContact O-N 3.12Å
98	D	87.8	Confident	92.5	Very high	141 Å²	141	61.2 Å²	61.2	75%	0.754	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	30.7	173	-158.2	34.2	0	0	0	115.3	E26 I100	E26-D98 HydrophobicContact CB-CB 4.24Å; E26-D98 HydrophobicContact CG-CB 3.99Å; D98-I100 PolarHBondContact O-N 3.48Å
99	G	90.1	Very high	92.4	Very high	45 Å²	45	61.1 Å²	61.1	46%	0.464	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	20.7	178.3	0	0	0	0	0	114.7	A94 F97 E101	A94-G99 VanDerWaalsContact O-CA 3.26Å; A94-G99 WeakPolarHBondContact O-CA 3.46Å; A94-G99 PolarHBondContact O-N 3.1Å; F97-G99 PolarHBondContact O-N 3.43Å; F97-G99 VanDerWaalsContact O-N 3.08Å; G99-E101 PolarHBondContact O-N 2.77Å; G99-E101 VanDerWaalsContact O-N 3.08Å
100	I	91.2	Very high	92.5	Very high	26 Å²	26	59.5 Å²	59.5	13%	0.133	32%	0.323	C	S	.	.			trans	-65.7	109	176.9	-64.2	163.5	0	0	0	109.9	E26 E27 L30 W92 A94 F97 D98	E26-I100 HydrophobicContact CB-CD1 3.97Å; E27-I100 HydrophobicContact CG-CD1 3.84Å; L30-I100 HydrophobicContact CD2-CB 4.46Å; L30-I100 HydrophobicContact CD2-CD1 4.5Å; L30-I100 HydrophobicContact CD2-CG2 4.06Å; W92-I100 HydrophobicContact CZ2-CG2 4.36Å; W92-I100 PolarHBondContact NE1-O 2.68Å; A94-I100 WeakPolarHBondContact CB-O 3.43Å; F97-I100 HydrophobicContact CB-CD1 4.38Å; F97-I100 VanDerWaalsContact O-CD1 3.32Å; F97-I100 WeakPolarHBondContact O-CD1 3.4Å; F97-I100 WeakPolarHBondContact O-CG1 3.45Å; F97-I100 PolarHBondContact O-N 3.45Å; F97-I100 VanDerWaalsContact O-N 3.12Å; D98-I100 PolarHBondContact O-N 3.48Å
101	E	91.5	Very high	92.5	Very high	130 Å²	130	59.7 Å²	59.7	61%	0.607	32%	0.324	S	S	*	.			trans	-87.9	-36	176.8	-66	-178.4	170.3	0	0	112.4	G99 D136 Q137	G99-E101 PolarHBondContact O-N 2.77Å; G99-E101 VanDerWaalsContact O-N 3.08Å; E101-D136 CarbonylContact O-C 3.43Å; E101-D136 WeakPolarHBondContact O-CA 3.35Å; E101-Q137 PolarHBondContact O-N 2.87Å
102	M	93.1	Very high	92.5	Very high	112 Å²	112	59.3 Å²	59.3	55%	0.552	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	138.1	-178	-70.6	-140	-64.9	0	0	112.3	V135	M102-V135 CarbonylContact C-O 3.59Å; M102-V135 WeakPolarHBondContact CA-O 3.35Å
103	L	94	Very high	92.3	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138.9	179.2	-171.5	64.8	0	0	0	110.4	E27 L30 I31 L34 W92 L105 V135	E27-L103 HydrophobicContact CB-CD1 4.27Å; E27-L103 HydrophobicContact CG-CD1 4.38Å; L30-L103 HydrophobicContact CD2-CD1 4.45Å; L30-L103 HydrophobicContact CD2-CD2 4.05Å; L30-L103 HydrophobicContact CG-CD2 4.27Å; I31-L103 HydrophobicContact CD1-CD1 4.28Å; I31-L103 HydrophobicContact CG1-CD1 4.17Å; I31-L103 HydrophobicContact CG1-CD2 3.97Å; L34-L103 HydrophobicContact CD1-CD2 4.01Å; W92-L103 HydrophobicContact CH2-CB 3.72Å; W92-L103 HydrophobicContact CZ2-CB 4.19Å; W92-L103 HydrophobicContact CZ3-CB 4.46Å; L103-L105 HydrophobicContact CD2-CD1 4.09Å; L103-L105 HydrophobicContact CD2-CD2 3.82Å; L103-L105 HydrophobicContact CD2-CG 4.03Å; L103-L105 HydrophobicContact CG-CD2 4.01Å; L103-L105 HydrophobicContact CG-CG 4.08Å; L103-V135 PolarHBondContact N-O 2.88Å; L103-V135 PolarHBondContact O-N 2.96Å
104	R	94.9	Very high	92	Very high	182 Å²	182	59.5 Å²	59.5	69%	0.687	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	115.6	175.5	-74.7	172.7	-178.1	-177.8	1	109.9	V133 L134	R104-V133 WeakPolarHBondContact CA-O 3.47Å; R104-L134 HydrophobicContact CG-CD2 3.41Å; R104-L134 VanDerWaalsContact CG-CD2 3.41Å
105	L	94.4	Very high	92	Very high	1 Å²	1	60 Å²	60	1%	0.005	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.8	-179.5	-63.3	174.3	0	0	0	110.7	I31 F35 L103 V110 N132 V133 V135	I31-L105 HydrophobicContact CD1-CD2 4.19Å; I31-L105 HydrophobicContact CG1-CD2 3.95Å; F35-L105 HydrophobicContact CE2-CD1 3.9Å; F35-L105 HydrophobicContact CE2-CD2 3.89Å; F35-L105 HydrophobicContact CZ-CD1 3.87Å; F35-L105 HydrophobicContact CZ-CD2 4.41Å; L103-L105 HydrophobicContact CD2-CD1 4.09Å; L103-L105 HydrophobicContact CD2-CD2 3.82Å; L103-L105 HydrophobicContact CD2-CG 4.03Å; L103-L105 HydrophobicContact CG-CD2 4.01Å; L103-L105 HydrophobicContact CG-CG 4.08Å; L105-V110 HydrophobicContact CB-CG1 4.1Å; L105-V110 HydrophobicContact CD1-CG1 3.88Å; L105-N132 CarbonylContact O-C 3.6Å; L105-N132 WeakPolarHBondContact O-CA 3.26Å; L105-V133 PolarHBondContact N-O 2.83Å; L105-V133 PolarHBondContact O-N 2.87Å; L105-V135 HydrophobicContact CD1-CG2 3.91Å
106	P	94.8	Very high	92	Very high	38 Å²	38	55.6 Å²	55.6	25%	0.247	29%	0.287	C	S	.	.			trans	-67.4	143.5	173.4	28.9	-33.5	0	0	0	110.2	S108 M109	P106-S108 PolarHBondContact O-N 3.31Å; P106-S108 VanDerWaalsContact O-N 3.07Å; P106-M109 HydrophobicContact CG-CB 4.3Å; P106-M109 HydrophobicContact CG-CE 3.77Å; P106-M109 HydrophobicContact CG-CG 3.77Å; P106-M109 HydrophobicContact CG-SD 3.47Å; P106-M109 WeakPolarHBondContact CG-SD 3.22Å; P106-M109 PolarHBondContact O-N 3.29Å; P106-M109 VanDerWaalsContact O-N 3.09Å
107	P	92.7	Very high	92.1	Very high	14 Å²	14	50.1 Å²	50.1	9%	0.091	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.8	-177.2	20.4	-30.1	0	0	0	113.2	M109 L112 Y130 S131 V133	P107-M109 VanDerWaalsContact C-N 3.26Å; P107-M109 PolarHBondContact O-N 3.2Å; P107-L112 HydrophobicContact CB-CD1 3.72Å; P107-L112 HydrophobicContact CB-CD2 4.45Å; P107-Y130 HydrophobicContact CG-CD1 4.42Å; P107-S131 WeakPolarHBondContact CD-O 3.37Å; P107-S131 WeakPolarHBondContact CG-O 3.46Å; P107-V133 HydrophobicContact CB-CG2 4.29Å
108	S	92	Very high	92.1	Very high	77 Å²	77	52.6 Å²	52.6	54%	0.538	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.7	178.2	57.4	0	0	0	0	114.5	K42 P106	K42-S108 VanDerWaalsContact CD-O 3.28Å; K42-S108 WeakPolarHBondContact CD-O 3.36Å; K42-S108 PolarHBondContact NZ-O 3.1Å; P106-S108 PolarHBondContact O-N 3.31Å; P106-S108 VanDerWaalsContact O-N 3.07Å
109	M	92.6	Very high	92.2	Very high	94 Å²	94	47.3 Å²	47.3	46%	0.463	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-24.6	-179.1	-68.9	-179.8	-175	0	0	113.1	F35 Y40 P106 P107	F35-M109 HydrophobicContact CE1-CB 4.08Å; F35-M109 WeakPolarHBondContact CE1-O 3.48Å; F35-M109 HydrophobicContact CZ-CB 4.08Å; Y40-M109 WeakPolarHBondContact CE1-O 3.42Å; P106-M109 HydrophobicContact CG-CB 4.3Å; P106-M109 HydrophobicContact CG-CE 3.77Å; P106-M109 HydrophobicContact CG-CG 3.77Å; P106-M109 HydrophobicContact CG-SD 3.47Å; P106-M109 WeakPolarHBondContact CG-SD 3.22Å; P106-M109 PolarHBondContact O-N 3.29Å; P106-M109 VanDerWaalsContact O-N 3.09Å; P107-M109 VanDerWaalsContact C-N 3.26Å; P107-M109 PolarHBondContact O-N 3.2Å
110	V	94.8	Very high	92.1	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.03	23%	0.229	C	C	.	.	S	Bend	trans	-105.2	157.3	-175.7	-63.4	0	0	0	0	111.7	F35 L90 L105 L112 V133	F35-V110 HydrophobicContact CZ-CG1 4.07Å; L90-V110 HydrophobicContact CD1-CG1 3.94Å; L105-V110 HydrophobicContact CB-CG1 4.1Å; L105-V110 HydrophobicContact CD1-CG1 3.88Å; V110-L112 HydrophobicContact CG2-CD2 4.16Å; V110-V133 HydrophobicContact CG2-CB 4.29Å; V110-V133 HydrophobicContact CG2-CG2 3.81Å
111	W	95.2	Very high	91.6	Very high	4 Å²	4	49 Å²	49	2%	0.015	24%	0.244	C	C	.	.			trans	-67.1	139.3	168.3	175.5	85.5	0	0	0	110	Y40 K42 R45 P46 V54 W85 P113 Y176 I181	Y40-W111 WeakPolarHBondContact OH-CB 3.45Å; Y40-W111 PolarHBondContact OH-N 3.2Å; K42-W111 WeakPolarHBondContact O-CB 3.45Å; K42-W111 VanDerWaalsContact O-CD1 3.23Å; R45-W111 HydrophobicContact CB-CZ2 4.16Å; P46-W111 VanDerWaalsContact CD-CD2 3.46Å; P46-W111 VanDerWaalsContact CD-CE3 3.47Å; P46-W111 HydrophobicContact CG-CD2 4.26Å; P46-W111 HydrophobicContact CG-CE3 3.77Å; P46-W111 HydrophobicContact CG-CZ3 3.91Å; V54-W111 HydrophobicContact CB-CH2 4.48Å; V54-W111 HydrophobicContact CG1-CH2 4.09Å; V54-W111 HydrophobicContact CG1-CZ3 4.19Å; W85-W111 AromaticContact CD1-CE3 3.99Å; W85-W111 AromaticContact CD1-CZ3 3.74Å; W85-W111 HydrophobicContact CG-CZ3 4.12Å; W85-W111 WeakPolarHBondContact CZ2-O 3.49Å; W85-W111 AromaticContact NE1-CE3 3.73Å; W85-W111 AromaticContact NE1-CZ3 3.92Å; W111-P113 HydrophobicContact CH2-CB 3.92Å; W111-P113 HydrophobicContact CH2-CG 4.47Å; W111-P113 HydrophobicContact CZ3-CB 4.31Å; W111-P113 HydrophobicContact CZ3-CG 4.37Å; W111-Y176 HydrophobicContact CZ2-CD2 4.48Å; W111-Y176 AromaticContact CZ2-CE2 3.88Å; W111-Y176 HydrophobicContact CZ2-CE2 3.88Å; W111-Y176 AromaticContact NE1-CE2 3.94Å; W111-Y176 AromaticContact NE1-CZ 3.54Å; W111-Y176 PolarHBondContact NE1-OH 3.49Å; W111-I181 HydrophobicContact CH2-CD1 3.8Å; W111-I181 HydrophobicContact CH2-CG1 4.49Å; W111-I181 HydrophobicContact CZ2-CD1 3.75Å
112	L	93.3	Very high	90.9	Very high	34 Å²	34	45.7 Å²	45.7	18%	0.178	23%	0.23	C	C	.	.			trans	-128.3	138.6	178.3	-63.3	169.4	0	0	0	110.2	W85 P107 V110 E114 V133 W143	W85-L112 HydrophobicContact CH2-CD2 3.64Å; W85-L112 HydrophobicContact CZ2-CD2 4.03Å; P107-L112 HydrophobicContact CB-CD1 3.72Å; P107-L112 HydrophobicContact CB-CD2 4.45Å; V110-L112 HydrophobicContact CG2-CD2 4.16Å; L112-E114 PolarHBondContact O-N 2.87Å; L112-V133 HydrophobicContact CD2-CG2 4.07Å; L112-W143 HydrophobicContact CD1-CH2 4.5Å; L112-W143 HydrophobicContact CD2-CD2 4.25Å; L112-W143 HydrophobicContact CD2-CE3 4.15Å; L112-W143 HydrophobicContact CD2-CZ3 4.46Å
113	P	90.5	Very high	89.6	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	24%	0.243	C	C	.	.			trans	-71.7	109.9	166.2	29.6	-30.7	0	0	0	108.3	V56 W85 W111 I115 I181	V56-P113 HydrophobicContact CG1-CB 4.19Å; V56-P113 HydrophobicContact CG1-CG 3.87Å; V56-P113 HydrophobicContact CG2-CB 3.92Å; V56-P113 HydrophobicContact CG2-CG 4.1Å; W85-P113 HydrophobicContact CE3-CG 4.23Å; W111-P113 HydrophobicContact CH2-CB 3.92Å; W111-P113 HydrophobicContact CH2-CG 4.47Å; W111-P113 HydrophobicContact CZ3-CB 4.31Å; W111-P113 HydrophobicContact CZ3-CG 4.37Å; P113-I115 HydrophobicContact CB-CD1 4.21Å; P113-I115 HydrophobicContact CB-CG1 4.38Å; P113-I115 HydrophobicContact CG-CD1 4.41Å; P113-I115 PolarHBondContact O-N 2.75Å; P113-I181 HydrophobicContact CB-CD1 4.17Å
114	E	87.6	Confident	88.4	Confident	99 Å²	99	51.3 Å²	51.3	46%	0.463	27%	0.272	S	S	.	.			trans	-71	78.3	178.8	-65.2	-179.1	162.7	0	0	111.4	L112 L174 T175	L112-E114 PolarHBondContact O-N 2.87Å; E114-L174 PolarHBondContact O-N 3.08Å; E114-T175 WeakPolarHBondContact OE2-CB 3.41Å; E114-T175 WeakPolarHBondContact OE2-CG2 3.08Å; E114-T175 PolarHBondContact OE2-OG1 2.97Å
115	I	91.3	Very high	87	Confident	20 Å²	20	47.1 Å²	47.1	10%	0.103	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.7	176.6	-67.5	166.3	0	0	0	108.8	V56 L58 P113 F171	V56-I115 HydrophobicContact CG1-CD1 3.7Å; L58-I115 HydrophobicContact CD1-CD1 4.26Å; L58-I115 HydrophobicContact CD1-CG2 4.47Å; P113-I115 HydrophobicContact CB-CD1 4.21Å; P113-I115 HydrophobicContact CB-CG1 4.38Å; P113-I115 HydrophobicContact CG-CD1 4.41Å; P113-I115 PolarHBondContact O-N 2.75Å; I115-F171 HydrophobicContact CG2-CB 3.91Å; I115-F171 HydrophobicContact CG2-CD1 3.99Å; I115-F171 HydrophobicContact CG2-CG 4.36Å
116	V	91.2	Very high	85.8	Confident	18 Å²	18	53.2 Å²	53.2	11%	0.109	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156	-175.9	-61.1	0	0	0	0	111	E118 F125 F171 S172 L174	V116-E118 PolarHBondContact O-N 2.95Å; V116-F125 HydrophobicContact CB-CB 4.28Å; V116-F125 HydrophobicContact CG1-CB 4.19Å; V116-F171 WeakPolarHBondContact O-CA 3.21Å; V116-S172 PolarHBondContact N-O 3.41Å; V116-S172 PolarHBondContact O-N 2.85Å; V116-L174 HydrophobicContact CG1-CB 4.24Å; V116-L174 HydrophobicContact CG1-CD2 4.44Å; V116-L174 HydrophobicContact CG2-CB 3.95Å; V116-L174 HydrophobicContact CG2-CD1 4.38Å
117	L	91.8	Very high	84.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	110.9	169.7	-175.5	75.2	0	0	0	109.5	N119 N120 F125 F149 L169 K170 F171	L117-N119 VanDerWaalsContact CD1-OD1 3.29Å; L117-N119 WeakPolarHBondContact CD1-OD1 3.41Å; L117-N120 HydrophobicContact CD2-CB 4.11Å; L117-N120 HydrophobicContact CG-CB 4.42Å; L117-F125 WeakPolarHBondContact O-CD1 3.42Å; L117-F149 HydrophobicContact CB-CD1 4.11Å; L117-F149 HydrophobicContact CB-CE1 4Å; L117-F149 HydrophobicContact CB-CZ 4.45Å; L117-F149 HydrophobicContact CD2-CB 3.86Å; L117-F149 HydrophobicContact CD2-CD1 3.75Å; L117-F149 HydrophobicContact CD2-CE1 4.47Å; L117-F149 HydrophobicContact CD2-CG 3.84Å; L117-L169 HydrophobicContact CD1-CB 4.07Å; L117-L169 HydrophobicContact CD1-CD2 3.97Å; L117-L169 HydrophobicContact CD2-CD2 4.44Å; L117-K170 CarbonylContact C-O 3.58Å; L117-K170 WeakPolarHBondContact CA-O 3.49Å; L117-F171 HydrophobicContact CB-CE1 4.36Å; L117-F171 HydrophobicContact CD1-CE1 4.35Å; L117-F171 HydrophobicContact CD1-CE2 4.4Å; L117-F171 HydrophobicContact CD1-CZ 4.22Å
118	E	89.3	Confident	83.8	Confident	61 Å²	61	54.8 Å²	54.8	29%	0.285	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-42	-178.1	-169.3	-176.7	-177.6	0	0	111.4	V116 N120 K170 K234	V116-E118 PolarHBondContact O-N 2.95Å; E118-N120 PolarHBondContact O-N 3.12Å; E118-N120 VanDerWaalsContact O-N 3.1Å; E118-K170 HydrophobicContact CB-CD 4.44Å; E118-K170 PolarHBondContact N-O 2.8Å; E118-K170 WeakPolarHBondContact OE2-CD 3.41Å; E118-K170 WeakPolarHBondContact OE2-CE 3.32Å; E118-K170 IonicContact OE2-NZ 3.48Å; E118-K170 PolarHBondContact OE2-NZ 3.2Å; E118-K234 IonicContact OE1-NZ 3.72Å
119	N	91.1	Very high	83.5	Confident	30 Å²	30	58.1 Å²	58.1	16%	0.16	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	42.2	-177.9	71.2	-49.6	0	0	0	112.8	L117 S151 S152 T168 K170	L117-N119 VanDerWaalsContact CD1-OD1 3.29Å; L117-N119 WeakPolarHBondContact CD1-OD1 3.41Å; N119-S151 CarbonylContact O-C 3.58Å; N119-S151 WeakPolarHBondContact O-CA 3.36Å; N119-S152 PolarHBondContact ND2-O 2.83Å; N119-S152 PolarHBondContact O-N 3.02Å; N119-T168 PolarHBondContact ND2-O 2.82Å; N119-K170 HydrophobicContact CB-CB 4.49Å; N119-K170 WeakPolarHBondContact OD1-CB 3.5Å; N119-K170 PolarHBondContact OD1-N 2.88Å
120	N	87.6	Confident	83.2	Confident	23 Å²	23	58.3 Å²	58.3	12%	0.123	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-79.9	137.7	174.9	-165.8	4.8	0	0	0	110.7	L117 E118 D122 Q124 F125 R150	L117-N120 HydrophobicContact CD2-CB 4.11Å; L117-N120 HydrophobicContact CG-CB 4.42Å; E118-N120 PolarHBondContact O-N 3.12Å; E118-N120 VanDerWaalsContact O-N 3.1Å; N120-D122 VanDerWaalsContact CG-O 3.29Å; N120-D122 PolarHBondContact ND2-O 3.36Å; N120-D122 VanDerWaalsContact ND2-O 3.15Å; N120-D122 PolarHBondContact OD1-N 2.8Å; N120-D122 VanDerWaalsContact OD1-N 3.11Å; N120-Q124 PolarHBondContact ND2-O 3.01Å; N120-F125 HydrophobicContact CB-CD1 4.34Å; N120-F125 HydrophobicContact CB-CE1 4.14Å; N120-R150 PolarHBondContact OD1-O 2.86Å
121	N	80.9	Confident	83.1	Confident	85 Å²	85	59 Å²	59	46%	0.455	31%	0.307	S	S	.	.	S	Bend	trans	-86.5	-22.7	172.4	-155.7	-5.1	0	0	0	111.7	D72 T74 R150	D72-N121 PolarHBondContact O-ND2 2.9Å; T74-N121 HydrophobicContact CG2-CB 3.71Å; T74-N121 WeakPolarHBondContact CG2-ND2 3.43Å; N121-R150 PolarHBondContact N-O 2.91Å
122	D	76.6	Confident	83.1	Confident	59 Å²	59	62.9 Å²	62.9	32%	0.316	33%	0.328	S	S	.	.	S	Bend	trans	-88.8	155.8	175.3	-83.9	-4.4	0	0	0	112.3	N120 Q124 R150	N120-D122 VanDerWaalsContact CG-O 3.29Å; N120-D122 PolarHBondContact ND2-O 3.36Å; N120-D122 VanDerWaalsContact ND2-O 3.15Å; N120-D122 PolarHBondContact OD1-N 2.8Å; N120-D122 VanDerWaalsContact OD1-N 3.11Å; D122-Q124 PolarHBondContact O-N 3.02Å; D122-Q124 VanDerWaalsContact O-N 3.14Å; D122-R150 IonicContact OD1-NH1 2.63Å; D122-R150 WeakPolarHBondContact OD2-CD 3.49Å; D122-R150 WeakPolarHBondContact OD2-CG 3.46Å; D122-R150 IonicContact OD2-CZ 3.63Å; D122-R150 IonicContact OD2-NE 3.4Å; D122-R150 PolarHBondContact OD2-NE 2.8Å; D122-R150 IonicContact OD2-NH1 2.98Å; D122-R150 PolarHBondContact OD2-NH1 2.9Å
123	A	65.8	Low	83.2	Confident	100 Å²	100	61.3 Å²	61.3	83%	0.826	32%	0.32	S	S	*	.	S	Bend	trans	-72.7	3.1	174.7	0	0	0	0	0	114.5
124	Q	68	Low	83.5	Confident	133 Å²	133	63.4 Å²	63.4	62%	0.621	33%	0.33	S	S	*	.			trans	-107	99.7	-175.8	-172.3	164.3	0.5	0	0	111.5	N120 D122	N120-Q124 PolarHBondContact ND2-O 3.01Å; D122-Q124 PolarHBondContact O-N 3.02Å; D122-Q124 VanDerWaalsContact O-N 3.14Å
125	F	66.1	Low	83.9	Confident	94 Å²	94	58.7 Å²	58.7	41%	0.412	31%	0.308	S	S	.	.			trans	-85.6	-4.8	-179.1	-61.2	-81.3	0	0	0	114.5	V116 L117 N120	V116-F125 HydrophobicContact CB-CB 4.28Å; V116-F125 HydrophobicContact CG1-CB 4.19Å; L117-F125 WeakPolarHBondContact O-CD1 3.42Å; N120-F125 HydrophobicContact CB-CD1 4.34Å; N120-F125 HydrophobicContact CB-CE1 4.14Å
126	Q	68.1	Low	84	Confident	128 Å²	128	59.9 Å²	59.9	60%	0.598	32%	0.315	S	S	*	.	S	Bend	trans	-94.5	154.2	-173.5	-69	-171.6	4.2	0	0	112.9	Y130	Q126-Y130 WeakPolarHBondContact CB-OH 3.34Å; Q126-Y130 VanDerWaalsContact CD-OH 3.22Å; Q126-Y130 WeakPolarHBondContact CG-OH 3.46Å; Q126-Y130 PolarHBondContact OE1-OH 2.86Å
127	V	71.6	Confident	84.2	Confident	16 Å²	16	62.4 Å²	62.4	10%	0.097	33%	0.326	C	S	.	.			trans	-67.4	149.3	178.7	-167.5	0	0	0	0	111	W143 P145 P146 A147	V127-W143 HydrophobicContact CG2-CH2 4.4Å; V127-P145 HydrophobicContact CB-CB 4.44Å; V127-P145 HydrophobicContact CG1-CB 3.65Å; V127-P145 HydrophobicContact CG1-CG 4.11Å; V127-P145 HydrophobicContact CG2-CG 4.36Å; V127-P146 WeakPolarHBondContact CG1-O 3.47Å; V127-A147 HydrophobicContact CG1-CB 3.73Å
128	A	75.1	Confident	84.2	Confident	70 Å²	70	65.6 Å²	65.6	58%	0.579	35%	0.348	S	S	*	.	S	Bend	trans	-69.1	-34.2	-175.7	0	0	0	0	0	112.9
129	Y	84.8	Confident	84.4	Confident	146 Å²	146	62.7 Å²	62.7	57%	0.573	33%	0.334	S	S	*	.			trans	-141	125.4	178.1	179.9	-106.6	0	0	0	111.3	S131 P145 P146	Y129-S131 PolarHBondContact O-N 2.85Å; Y129-P145 WeakPolarHBondContact O-CB 3.18Å; Y129-P146 HydrophobicContact CD1-CG 4.24Å; Y129-P146 PolarHBondContact N-O 3.07Å
130	Y	86.4	Confident	84.6	Confident	98 Å²	98	65 Å²	65	38%	0.384	34%	0.343	S	S	.	.			trans	-86.1	88.4	175.7	-72.6	-86.9	0	0	0	109.6	P107 Q126 W143	P107-Y130 HydrophobicContact CG-CD1 4.42Å; Q126-Y130 WeakPolarHBondContact CB-OH 3.34Å; Q126-Y130 VanDerWaalsContact CD-OH 3.22Å; Q126-Y130 WeakPolarHBondContact CG-OH 3.46Å; Q126-Y130 PolarHBondContact OE1-OH 2.86Å; Y130-W143 HydrophobicContact CD1-CH2 4.24Å; Y130-W143 AromaticContact CD1-CZ2 3.78Å; Y130-W143 HydrophobicContact CD1-CZ2 3.78Å; Y130-W143 HydrophobicContact CE1-CH2 4.3Å; Y130-W143 HydrophobicContact CE1-CZ2 4.29Å
131	S	92.2	Very high	85	Confident	20 Å²	20	63.9 Å²	63.9	14%	0.14	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-69.2	160.3	174.3	61.4	0	0	0	0	111.8	P107 Y129 W143 L144 P145	P107-S131 WeakPolarHBondContact CD-O 3.37Å; P107-S131 WeakPolarHBondContact CG-O 3.46Å; Y129-S131 PolarHBondContact O-N 2.85Å; S131-W143 PolarHBondContact O-NE1 2.94Å; S131-L144 PolarHBondContact OG-O 3.23Å; S131-P145 WeakPolarHBondContact OG-CA 3.46Å
132	N	95.4	Very high	85.7	Confident	86 Å²	86	63 Å²	63	46%	0.46	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-62.4	146.5	173.2	-66.4	-12.3	0	0	0	111.3	L105	L105-N132 CarbonylContact O-C 3.6Å; L105-N132 WeakPolarHBondContact O-CA 3.26Å
133	V	96	Very high	86.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	131.9	171.8	-176	0	0	0	0	108.1	W85 R104 L105 P107 V110 L112 V135 C141 W143	W85-V133 HydrophobicContact CH2-CG1 3.89Å; W85-V133 HydrophobicContact CH2-CG2 4.34Å; W85-V133 HydrophobicContact CZ2-CG1 4.21Å; R104-V133 WeakPolarHBondContact CA-O 3.47Å; L105-V133 PolarHBondContact N-O 2.83Å; L105-V133 PolarHBondContact O-N 2.87Å; P107-V133 HydrophobicContact CB-CG2 4.29Å; V110-V133 HydrophobicContact CG2-CB 4.29Å; V110-V133 HydrophobicContact CG2-CG2 3.81Å; L112-V133 HydrophobicContact CD2-CG2 4.07Å; V133-V135 HydrophobicContact CG1-CG2 4.16Å; V133-C141 HydrophobicContact CG1-CB 4.1Å; V133-W143 HydrophobicContact CG1-CB 4.33Å; V133-W143 HydrophobicContact CG2-CB 4.06Å; V133-W143 HydrophobicContact CG2-CG 3.86Å
134	L	96.1	Very high	88	Confident	45 Å²	45	58.1 Å²	58.1	24%	0.236	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	126.8	170.5	-71	167	0	0	0	108.1	R104 C141 Y142	R104-L134 HydrophobicContact CG-CD2 3.41Å; R104-L134 VanDerWaalsContact CG-CD2 3.41Å; L134-C141 CarbonylContact O-C 3.47Å; L134-C141 WeakPolarHBondContact O-CA 3.19Å; L134-Y142 HydrophobicContact CD1-CD1 4.11Å; L134-Y142 PolarHBondContact N-O 3.36Å; L134-Y142 PolarHBondContact O-N 3.28Å
135	V	96.1	Very high	89.2	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129	177.2	-174	0	0	0	0	108	L90 W92 M102 L103 L105 V133 F140	L90-V135 HydrophobicContact CB-CG1 3.94Å; L90-V135 HydrophobicContact CD1-CG1 4.43Å; L90-V135 HydrophobicContact CD1-CG2 4.34Å; W92-V135 HydrophobicContact CH2-CB 4.43Å; W92-V135 HydrophobicContact CH2-CG1 4.18Å; W92-V135 WeakPolarHBondContact CH2-O 3.13Å; W92-V135 HydrophobicContact CZ3-CB 4.45Å; W92-V135 HydrophobicContact CZ3-CG1 3.82Å; M102-V135 CarbonylContact C-O 3.59Å; M102-V135 WeakPolarHBondContact CA-O 3.35Å; L103-V135 PolarHBondContact N-O 2.88Å; L103-V135 PolarHBondContact O-N 2.96Å; L105-V135 HydrophobicContact CD1-CG2 3.91Å; V133-V135 HydrophobicContact CG1-CG2 4.16Å; V135-F140 WeakPolarHBondContact CA-O 3.31Å
136	D	95.1	Very high	90.5	Very high	46 Å²	46	48.8 Å²	48.8	25%	0.246	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	158.8	173.8	176.7	41.1	0	0	0	111	E101 S138 G139 F140	E101-D136 CarbonylContact O-C 3.43Å; E101-D136 WeakPolarHBondContact O-CA 3.35Å; D136-S138 PolarHBondContact O-N 3.21Å; D136-S138 WeakPolarHBondContact OD2-CB 3.28Å; D136-S138 PolarHBondContact OD2-OG 2.88Å; D136-G139 PolarHBondContact O-N 2.81Å; D136-F140 HydrophobicContact CB-CB 4.19Å; D136-F140 PolarHBondContact N-O 2.94Å
137	Q	93.4	Very high	91.6	Very high	70 Å²	70	42.7 Å²	42.7	33%	0.327	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-28.5	179.4	63.7	177.6	-21.1	0	0	113.6	S91 W92 E101 G139	S91-Q137 VanDerWaalsContact CA-O 3.31Å; S91-Q137 WeakPolarHBondContact CA-O 3.43Å; W92-Q137 HydrophobicContact CD2-CB 4.5Å; W92-Q137 HydrophobicContact CZ2-CB 4.23Å; W92-Q137 PolarHBondContact N-O 3.34Å; W92-Q137 VanDerWaalsContact N-O 3.11Å; E101-Q137 PolarHBondContact O-N 2.87Å; Q137-G139 PolarHBondContact O-N 2.98Å
138	S	93.1	Very high	92.6	Very high	67 Å²	67	46.7 Å²	46.7	47%	0.469	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-12.7	176.3	64.3	0	0	0	0	113.7	D136 F140	D136-S138 PolarHBondContact O-N 3.21Å; D136-S138 WeakPolarHBondContact OD2-CB 3.28Å; D136-S138 PolarHBondContact OD2-OG 2.88Å; S138-F140 WeakPolarHBondContact OG-CB 3.46Å; S138-F140 PolarHBondContact OG-N 2.92Å
139	G	93.1	Very high	93.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	87.3	5.2	-168.7	0	0	0	0	0	113.6	D87 D136 Q137 C141	D87-G139 PolarHBondContact N-O 3.35Å; D87-G139 WeakPolarHBondContact O-CA 3.47Å; D136-G139 PolarHBondContact O-N 2.81Å; Q137-G139 PolarHBondContact O-N 2.98Å; G139-C141 PolarHBondContact O-N 3.19Å; G139-C141 PolarHBondContact O-SG 3.32Å
140	F	95.3	Very high	93.7	Very high	78 Å²	78	42.2 Å²	42.2	34%	0.342	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	121.1	172.5	-176	-99	0	0	0	110.2	A84 V135 D136 S138	A84-F140 HydrophobicContact CB-CE1 4.28Å; A84-F140 HydrophobicContact CB-CE2 3.93Å; A84-F140 HydrophobicContact CB-CZ 3.51Å; V135-F140 WeakPolarHBondContact CA-O 3.31Å; D136-F140 HydrophobicContact CB-CB 4.19Å; D136-F140 PolarHBondContact N-O 2.94Å; S138-F140 WeakPolarHBondContact OG-CB 3.46Å; S138-F140 PolarHBondContact OG-N 2.92Å
141	C	96.2	Very high	94	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.4	-177.7	-62.6	0	0	0	0	109.4	A84 W85 V133 L134 G139	A84-C141 VanDerWaalsContact CA-O 3.29Å; A84-C141 WeakPolarHBondContact CA-O 3.26Å; W85-C141 HydrophobicContact CD2-CB 3.78Å; W85-C141 HydrophobicContact CE3-CB 4.25Å; W85-C141 HydrophobicContact CG-CB 4.26Å; W85-C141 HydrophobicContact CH2-CB 4.08Å; W85-C141 HydrophobicContact CZ2-CB 3.58Å; W85-C141 HydrophobicContact CZ3-CB 4.38Å; W85-C141 PolarHBondContact N-O 2.67Å; W85-C141 PolarHBondContact O-N 3.44Å; V133-C141 HydrophobicContact CG1-CB 4.1Å; L134-C141 CarbonylContact O-C 3.47Å; L134-C141 WeakPolarHBondContact O-CA 3.19Å; G139-C141 PolarHBondContact O-N 3.19Å; G139-C141 PolarHBondContact O-SG 3.32Å
142	Y	95.8	Very high	94	Very high	67 Å²	67	39 Å²	39	26%	0.263	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.6	179	-179.7	-94.5	0	0	0	109.9	D82 H83 L134 L144	D82-Y142 VanDerWaalsContact CG-CE2 3.42Å; D82-Y142 WeakPolarHBondContact OD1-CE2 3.37Å; D82-Y142 WeakPolarHBondContact OD2-CE2 3.43Å; H83-Y142 WeakPolarHBondContact O-CA 3.49Å; L134-Y142 HydrophobicContact CD1-CD1 4.11Å; L134-Y142 PolarHBondContact N-O 3.36Å; L134-Y142 PolarHBondContact O-N 3.28Å; Y142-L144 HydrophobicContact CE1-CB 3.78Å; Y142-L144 HydrophobicContact CE1-CD2 4.41Å
143	W	95.6	Very high	93.9	Very high	12 Å²	12	35.1 Å²	35.1	5%	0.045	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	119.9	-177.6	-175.9	48.1	0	0	0	110.8	H83 W85 L112 V127 Y130 S131 V133 P145	H83-W143 HydrophobicContact CB-CB 4.28Å; H83-W143 HydrophobicContact CB-CE3 4.23Å; H83-W143 AromaticContact CE1-CE3 3.89Å; H83-W143 AromaticContact CE1-CZ3 3.85Å; H83-W143 AromaticContact CG-CE3 3.85Å; H83-W143 PolarHBondContact N-O 2.89Å; H83-W143 AromaticContact ND1-CE3 3.49Å; H83-W143 AromaticContact ND1-CZ3 3.94Å; H83-W143 PolarHBondContact O-N 3.46Å; W85-W143 HydrophobicContact CH2-CB 3.89Å; W85-W143 HydrophobicContact CZ3-CB 3.74Å; L112-W143 HydrophobicContact CD1-CH2 4.5Å; L112-W143 HydrophobicContact CD2-CD2 4.25Å; L112-W143 HydrophobicContact CD2-CE3 4.15Å; L112-W143 HydrophobicContact CD2-CZ3 4.46Å; V127-W143 HydrophobicContact CG2-CH2 4.4Å; Y130-W143 HydrophobicContact CD1-CH2 4.24Å; Y130-W143 AromaticContact CD1-CZ2 3.78Å; Y130-W143 HydrophobicContact CD1-CZ2 3.78Å; Y130-W143 HydrophobicContact CE1-CH2 4.3Å; Y130-W143 HydrophobicContact CE1-CZ2 4.29Å; S131-W143 PolarHBondContact O-NE1 2.94Å; V133-W143 HydrophobicContact CG1-CB 4.33Å; V133-W143 HydrophobicContact CG2-CB 4.06Å; V133-W143 HydrophobicContact CG2-CG 3.86Å; W143-P145 VanDerWaalsContact C-CD 3.4Å; W143-P145 HydrophobicContact CD2-CB 4.49Å; W143-P145 HydrophobicContact CD2-CG 3.82Å; W143-P145 HydrophobicContact CE3-CG 4.04Å; W143-P145 HydrophobicContact CG-CG 4.49Å; W143-P145 HydrophobicContact CH2-CB 4.39Å; W143-P145 HydrophobicContact CH2-CG 3.82Å; W143-P145 HydrophobicContact CZ2-CB 3.73Å; W143-P145 HydrophobicContact CZ2-CG 3.57Å; W143-P145 HydrophobicContact CZ3-CG 4.05Å; W143-P145 WeakPolarHBondContact O-CD 3.36Å
144	L	94.5	Very high	93.6	Very high	44 Å²	44	39.5 Å²	39.5	23%	0.23	21%	0.208	C	C	.	.			trans	-123.9	69.4	-174.7	-170.5	73.7	0	0	0	111.8	W80 I81 D82 S131 Y142	W80-L144 HydrophobicContact CB-CD1 4.07Å; W80-L144 HydrophobicContact CB-CG 4.31Å; W80-L144 HydrophobicContact CE3-CD2 3.58Å; W80-L144 HydrophobicContact CE3-CG 3.83Å; W80-L144 HydrophobicContact CZ3-CD2 4.08Å; I81-L144 WeakPolarHBondContact O-CA 3.44Å; D82-L144 HydrophobicContact CB-CD1 3.76Å; S131-L144 PolarHBondContact OG-O 3.23Å; Y142-L144 HydrophobicContact CE1-CB 3.78Å; Y142-L144 HydrophobicContact CE1-CD2 4.41Å
145	P	94.3	Very high	93.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.201	C	C	.	.			trans	-78.4	138.7	178.5	35.2	-41.7	0	0	0	111.8	I81 V127 Y129 S131 W143	I81-P145 PolarHBondContact N-O 3.48Å; I81-P145 VanDerWaalsContact O-CD 3.26Å; I81-P145 WeakPolarHBondContact O-CD 3.29Å; V127-P145 HydrophobicContact CB-CB 4.44Å; V127-P145 HydrophobicContact CG1-CB 3.65Å; V127-P145 HydrophobicContact CG1-CG 4.11Å; V127-P145 HydrophobicContact CG2-CG 4.36Å; Y129-P145 WeakPolarHBondContact O-CB 3.18Å; S131-P145 WeakPolarHBondContact OG-CA 3.46Å; W143-P145 VanDerWaalsContact C-CD 3.4Å; W143-P145 HydrophobicContact CD2-CB 4.49Å; W143-P145 HydrophobicContact CD2-CG 3.82Å; W143-P145 HydrophobicContact CE3-CG 4.04Å; W143-P145 HydrophobicContact CG-CG 4.49Å; W143-P145 HydrophobicContact CH2-CB 4.39Å; W143-P145 HydrophobicContact CH2-CG 3.82Å; W143-P145 HydrophobicContact CZ2-CB 3.73Å; W143-P145 HydrophobicContact CZ2-CG 3.57Å; W143-P145 HydrophobicContact CZ3-CG 4.05Å; W143-P145 WeakPolarHBondContact O-CD 3.36Å
146	P	93.2	Very high	93.2	Very high	32 Å²	32	41.5 Å²	41.5	21%	0.208	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	136	172	32.5	-32.6	0	0	0	111.1	V79 W80 V127 Y129	V79-P146 WeakPolarHBondContact O-CA 3.26Å; W80-P146 HydrophobicContact CD2-CB 4.37Å; V127-P146 WeakPolarHBondContact CG1-O 3.47Å; Y129-P146 HydrophobicContact CD1-CG 4.24Å; Y129-P146 PolarHBondContact N-O 3.07Å
147	A	91.3	Very high	92.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	141.7	-177.7	0	0	0	0	0	111.5	N78 V79 I81 V127 F149	N78-A147 PolarHBondContact OD1-O 3.46Å; V79-A147 HydrophobicContact CG2-CB 4.08Å; V79-A147 PolarHBondContact N-O 2.99Å; V79-A147 PolarHBondContact O-N 3.36Å; I81-A147 HydrophobicContact CD1-CB 4.05Å; I81-A147 HydrophobicContact CG1-CB 4.43Å; V127-A147 HydrophobicContact CG1-CB 3.73Å; A147-F149 HydrophobicContact CB-CD2 4.02Å; A147-F149 HydrophobicContact CB-CE1 4.16Å; A147-F149 HydrophobicContact CB-CE2 3.54Å; A147-F149 HydrophobicContact CB-CZ 3.62Å
148	I	91.5	Very high	92.8	Very high	100 Å²	100	38.5 Å²	38.5	51%	0.513	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	109.4	166.6	-58.6	175.5	0	0	0	107	I66 T77	I66-I148 HydrophobicContact CD1-CG2 4.33Å; T77-I148 CarbonylContact O-C 3.52Å; T77-I148 WeakPolarHBondContact O-CA 3.35Å
149	F	91.4	Very high	92.7	Very high	7 Å²	7	38.6 Å²	38.6	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	141.8	-177.3	-73.9	-52.2	0	0	0	112.6	L76 T77 V79 I81 L117 A147 L169 F171	L76-F149 WeakPolarHBondContact CA-O 3.43Å; T77-F149 PolarHBondContact N-O 3.09Å; T77-F149 VanDerWaalsContact N-O 3.1Å; T77-F149 PolarHBondContact O-N 3.21Å; V79-F149 HydrophobicContact CG2-CD2 3.46Å; V79-F149 VanDerWaalsContact CG2-CD2 3.46Å; V79-F149 HydrophobicContact CG2-CE2 3.67Å; I81-F149 HydrophobicContact CD1-CE2 3.47Å; I81-F149 VanDerWaalsContact CD1-CE2 3.47Å; I81-F149 HydrophobicContact CD1-CZ 3.49Å; I81-F149 VanDerWaalsContact CD1-CZ 3.49Å; I81-F149 HydrophobicContact CG1-CE2 4.1Å; L117-F149 HydrophobicContact CB-CD1 4.11Å; L117-F149 HydrophobicContact CB-CE1 4Å; L117-F149 HydrophobicContact CB-CZ 4.45Å; L117-F149 HydrophobicContact CD2-CB 3.86Å; L117-F149 HydrophobicContact CD2-CD1 3.75Å; L117-F149 HydrophobicContact CD2-CE1 4.47Å; L117-F149 HydrophobicContact CD2-CG 3.84Å; A147-F149 HydrophobicContact CB-CD2 4.02Å; A147-F149 HydrophobicContact CB-CE1 4.16Å; A147-F149 HydrophobicContact CB-CE2 3.54Å; A147-F149 HydrophobicContact CB-CZ 3.62Å; F149-L169 HydrophobicContact CB-CD2 4.33Å; F149-F171 HydrophobicContact CD2-CZ 4.16Å; F149-F171 AromaticContact CE2-CE1 3.64Å; F149-F171 HydrophobicContact CE2-CE1 3.64Å; F149-F171 AromaticContact CE2-CZ 3.59Å; F149-F171 HydrophobicContact CE2-CZ 3.59Å; F149-F171 AromaticContact CZ-CE1 3.78Å; F149-F171 HydrophobicContact CZ-CE1 3.78Å; F149-F171 HydrophobicContact CZ-CZ 4.21Å
150	R	92.3	Very high	92.6	Very high	114 Å²	114	39 Å²	39	43%	0.43	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	74.1	171.1	-52.8	-143.3	175.9	131.7	-5.6	109.9	L75 L76 N120 N121 D122	L75-R150 WeakPolarHBondContact O-CA 3.38Å; L76-R150 HydrophobicContact CD2-CB 3.96Å; L76-R150 HydrophobicContact CD2-CG 3.34Å; N120-R150 PolarHBondContact OD1-O 2.86Å; N121-R150 PolarHBondContact N-O 2.91Å; D122-R150 IonicContact OD1-NH1 2.63Å; D122-R150 WeakPolarHBondContact OD2-CD 3.49Å; D122-R150 WeakPolarHBondContact OD2-CG 3.46Å; D122-R150 IonicContact OD2-CZ 3.63Å; D122-R150 IonicContact OD2-NE 3.4Å; D122-R150 PolarHBondContact OD2-NE 2.8Å; D122-R150 IonicContact OD2-NH1 2.98Å; D122-R150 PolarHBondContact OD2-NH1 2.9Å
151	S	93.1	Very high	92.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	140.7	-179.5	53.6	0	0	0	0	112	T74 L75 N119	T74-S151 WeakPolarHBondContact CA-O 3.48Å; L75-S151 WeakPolarHBondContact CB-OG 3.47Å; L75-S151 PolarHBondContact N-O 3.04Å; L75-S151 PolarHBondContact O-N 2.7Å; L75-S151 PolarHBondContact O-OG 3.3Å; N119-S151 CarbonylContact O-C 3.58Å; N119-S151 WeakPolarHBondContact O-CA 3.36Å
152	S	92.2	Very high	92.3	Very high	50 Å²	50	36.9 Å²	36.9	35%	0.35	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	126.3	168.5	178.4	0	0	0	0	109.4	N119	N119-S152 PolarHBondContact ND2-O 2.83Å; N119-S152 PolarHBondContact O-N 3.02Å
153	C	93.1	Very high	92.2	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.034	18%	0.177	C	C	.	.			trans	-137.1	116	179.2	175.3	0	0	0	0	109.6	L68 E73 L75 I155 C167	L68-C153 HydrophobicContact CD1-CB 4.44Å; E73-C153 PolarHBondContact O-N 2.9Å; L75-C153 HydrophobicContact CB-CB 4.44Å; C153-I155 PolarHBondContact O-N 3.19Å; C153-C167 HydrophobicContact CB-CB 3.72Å; C153-C167 WeakPolarHBondContact CB-SG 3.5Å; C153-C167 WeakPolarHBondContact SG-CA 3.28Å; C153-C167 WeakPolarHBondContact SG-CB 3.49Å; C153-C167 CovalentContact SG-SG 2.04Å; C153-C167 PolarHBondContact SG-SG 2.88Å
154	S	90.1	Very high	92.2	Very high	93 Å²	93	36.4 Å²	36.4	65%	0.65	19%	0.187	S	C	*	.			trans	-67.1	128.1	177.1	62.1	0	0	0	0	110.9
155	I	91.3	Very high	92.2	Very high	15 Å²	15	34.4 Å²	34.4	8%	0.077	18%	0.176	C	C	.	.			trans	-93.6	124.7	-175	-55.4	-59.7	0	0	0	110.7	L68 E70 E73 C153 V157 Q165	L68-I155 HydrophobicContact CD1-CD1 3.96Å; L68-I155 HydrophobicContact CD2-CD1 3.69Å; L68-I155 HydrophobicContact CG-CD1 3.98Å; E70-I155 HydrophobicContact CB-CG1 4.42Å; E70-I155 HydrophobicContact CB-CG2 4.48Å; E70-I155 HydrophobicContact CG-CG2 4.29Å; E73-I155 HydrophobicContact CG-CG1 4.19Å; E73-I155 PolarHBondContact OE1-N 2.9Å; C153-I155 PolarHBondContact O-N 3.19Å; I155-V157 HydrophobicContact CG2-CG1 3.88Å; I155-V157 PolarHBondContact O-N 3.32Å; I155-Q165 HydrophobicContact CD1-CG 4.47Å
156	N	90.6	Very high	92.3	Very high	71 Å²	71	37.6 Å²	37.6	38%	0.38	19%	0.193	S	C	.	.			trans	-85.7	101.6	170.1	-171.1	-9.8	0	0	0	110.3	N158 Q165	N156-N158 VanDerWaalsContact OD1-CB 3.32Å; N156-N158 WeakPolarHBondContact OD1-CB 3.28Å; N156-N158 PolarHBondContact OD1-N 3.1Å; N156-N158 PolarHBondContact OD1-ND2 2.92Å; N156-Q165 PolarHBondContact O-NE2 3.35Å
157	V	90.4	Very high	92.4	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.018	18%	0.184	C	C	.	.			trans	-84.9	-5.2	-176.7	-60.8	0	0	0	0	114.5	I155 Y159 F160 P302 S307 P309	I155-V157 HydrophobicContact CG2-CG1 3.88Å; I155-V157 PolarHBondContact O-N 3.32Å; V157-Y159 VanDerWaalsContact C-N 3.26Å; V157-Y159 PolarHBondContact O-N 2.91Å; V157-Y159 VanDerWaalsContact O-N 3.08Å; V157-F160 WeakPolarHBondContact O-CB 3.34Å; V157-F160 PolarHBondContact O-N 2.72Å; V157-F160 VanDerWaalsContact O-N 3.11Å; V157-P302 HydrophobicContact CG1-CG 3.94Å; V157-S307 WeakPolarHBondContact CG2-O 3.38Å; V157-S307 WeakPolarHBondContact CG2-OG 3.48Å; V157-P309 HydrophobicContact CB-CG 4.01Å; V157-P309 HydrophobicContact CG2-CG 3.99Å; V157-P309 VanDerWaalsContact O-CA 3.24Å; V157-P309 WeakPolarHBondContact O-CA 3.43Å; V157-P309 WeakPolarHBondContact O-CB 3.49Å
158	N	90.2	Very high	92.6	Very high	51 Å²	51	38.1 Å²	38.1	27%	0.273	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-43.4	-172.1	-86.8	-62.8	0	0	0	114.5	N156 S307 L310	N156-N158 VanDerWaalsContact OD1-CB 3.32Å; N156-N158 WeakPolarHBondContact OD1-CB 3.28Å; N156-N158 PolarHBondContact OD1-N 3.1Å; N156-N158 PolarHBondContact OD1-ND2 2.92Å; N158-S307 PolarHBondContact ND2-OG 2.95Å; N158-S307 WeakPolarHBondContact OD1-CB 3.24Å; N158-S307 PolarHBondContact OD1-OG 3.31Å; N158-L310 WeakPolarHBondContact O-CB 3.24Å; N158-L310 PolarHBondContact O-N 3.39Å
159	Y	92.3	Very high	92.8	Very high	69 Å²	69	33.4 Å²	33.4	27%	0.271	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	11.4	-174.5	-68.4	-71.6	0	0	0	113.7	V157 F162 M495 N499	V157-Y159 VanDerWaalsContact C-N 3.26Å; V157-Y159 PolarHBondContact O-N 2.91Å; V157-Y159 VanDerWaalsContact O-N 3.08Å; Y159-F162 CarbonylContact O-C 3.56Å; Y159-F162 VanDerWaalsContact O-CA 3.31Å; Y159-F162 WeakPolarHBondContact O-CA 3.34Å; Y159-F162 PolarHBondContact O-N 2.95Å; Y159-M495 HydrophobicContact CE1-CE 3.72Å; Y159-M495 HydrophobicContact CE1-CG 3.96Å; Y159-M495 HydrophobicContact CE1-SD 4.29Å; Y159-M495 VanDerWaalsContact OH-CE 3.3Å; Y159-M495 WeakPolarHBondContact OH-CE 3.49Å; Y159-N499 VanDerWaalsContact CB-ND2 3.33Å; Y159-N499 WeakPolarHBondContact CB-ND2 3.45Å; Y159-N499 HydrophobicContact CD1-CB 4.03Å; Y159-N499 HydrophobicContact CD2-CB 4.15Å; Y159-N499 VanDerWaalsContact CD2-CG 3.5Å; Y159-N499 HydrophobicContact CG-CB 3.83Å
160	F	90.6	Very high	92.9	Very high	8 Å²	8	35 Å²	35	4%	0.035	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	132.5	178.6	-179.1	-82.6	0	0	0	111.3	V157 Y251 L301 P309 I311	V157-F160 WeakPolarHBondContact O-CB 3.34Å; V157-F160 PolarHBondContact O-N 2.72Å; V157-F160 VanDerWaalsContact O-N 3.11Å; F160-Y251 HydrophobicContact CE1-CD1 4.15Å; F160-Y251 AromaticContact CE1-CE1 4Å; F160-Y251 HydrophobicContact CE1-CE1 4Å; F160-Y251 HydrophobicContact CE2-CE1 4.47Å; F160-Y251 HydrophobicContact CZ-CD1 4.05Å; F160-Y251 AromaticContact CZ-CE1 3.47Å; F160-Y251 HydrophobicContact CZ-CE1 3.47Å; F160-Y251 VanDerWaalsContact CZ-CE1 3.47Å; F160-Y251 HydrophobicContact CZ-CE2 4.39Å; F160-Y251 AromaticContact CZ-CZ 3.67Å; F160-L301 HydrophobicContact CD1-CD2 3.62Å; F160-L301 HydrophobicContact CD2-CD2 4.24Å; F160-L301 HydrophobicContact CE1-CD2 3.72Å; F160-L301 HydrophobicContact CE2-CD2 4.31Å; F160-L301 HydrophobicContact CG-CD2 3.89Å; F160-L301 HydrophobicContact CZ-CD2 4.05Å; F160-P309 HydrophobicContact CB-CB 4.31Å; F160-I311 HydrophobicContact CD1-CG2 3.81Å; F160-I311 HydrophobicContact CE1-CG2 4.3Å; F160-I311 PolarHBondContact O-N 2.83Å
161	P	92.1	Very high	93	Very high	4 Å²	4	29.6 Å²	29.6	3%	0.026	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.7	11.6	6.5	38.2	-38.3	0	0	0	115.1	D163 R246 P248 Y251	P161-D163 VanDerWaalsContact C-OD1 3.23Å; P161-D163 WeakPolarHBondContact CA-OD1 3.48Å; P161-D163 PolarHBondContact O-N 2.75Å; P161-R246 WeakPolarHBondContact O-CD 3.22Å; P161-P248 HydrophobicContact CB-CB 4.46Å; P161-P248 HydrophobicContact CG-CB 4.46Å; P161-Y251 HydrophobicContact CB-CD1 4.34Å; P161-Y251 HydrophobicContact CB-CD2 3.7Å; P161-Y251 HydrophobicContact CB-CE2 4.41Å; P161-Y251 HydrophobicContact CB-CG 3.66Å; P161-Y251 HydrophobicContact CG-CG 4.18Å
162	F	93.1	Very high	93	Very high	29 Å²	29	30.1 Å²	30.1	13%	0.127	16%	0.162	C	C	.	.	S	Bend	trans	-93.9	34.4	175.3	-56.1	-82.9	0	0	0	111.3	Y159 P248 I252 I256 L310 F493 G496 I497 N499	Y159-F162 CarbonylContact O-C 3.56Å; Y159-F162 VanDerWaalsContact O-CA 3.31Å; Y159-F162 WeakPolarHBondContact O-CA 3.34Å; Y159-F162 PolarHBondContact O-N 2.95Å; F162-P248 HydrophobicContact CD1-CB 4.02Å; F162-P248 HydrophobicContact CD1-CG 3.86Å; F162-P248 HydrophobicContact CE1-CB 3.93Å; F162-P248 HydrophobicContact CE1-CG 3.76Å; F162-I252 HydrophobicContact CE1-CD1 4.17Å; F162-I252 HydrophobicContact CZ-CD1 4.29Å; F162-I252 HydrophobicContact CZ-CG1 4.29Å; F162-I256 HydrophobicContact CE2-CD1 4.12Å; F162-I256 HydrophobicContact CZ-CD1 4.15Å; F162-L310 HydrophobicContact CD2-CD2 4.31Å; F162-F493 HydrophobicContact CE2-CD1 4.13Å; F162-G496 VanDerWaalsContact CB-O 3.28Å; F162-G496 WeakPolarHBondContact CB-O 3.33Å; F162-I497 HydrophobicContact CE1-CG1 4.26Å; F162-N499 PolarHBondContact O-ND2 3.33Å
163	D	93.8	Very high	93	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.011	15%	0.146	C	C	.	.			trans	-86	154.6	-176.3	56.1	-56.2	0	0	0	112.4	P161 Q165 R246	P161-D163 VanDerWaalsContact C-OD1 3.23Å; P161-D163 WeakPolarHBondContact CA-OD1 3.48Å; P161-D163 PolarHBondContact O-N 2.75Å; D163-Q165 PolarHBondContact OD2-NE2 2.76Å; D163-R246 PolarHBondContact O-N 2.67Å; D163-R246 VanDerWaalsContact O-N 3.08Å; D163-R246 IonicContact OD1-CZ 3.58Å; D163-R246 IonicContact OD1-NE 3.88Å; D163-R246 PolarHBondContact OD1-NE 3.02Å; D163-R246 IonicContact OD1-NH2 3.72Å; D163-R246 IonicContact OD2-CZ 2.81Å; D163-R246 IonicContact OD2-NE 2.77Å; D163-R246 PolarHBondContact OD2-NE 2.7Å; D163-R246 IonicContact OD2-NH2 3.71Å; D163-R246 PolarHBondContact OD2-NH2 3.24Å
164	W	95.1	Very high	92.6	Very high	67 Å²	67	32.1 Å²	32.1	25%	0.254	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.7	163.8	57.5	-92.4	0	0	0	107.1	N166 V243 I244 K245 N499 P501	W164-N166 HydrophobicContact CZ3-CB 4.31Å; W164-V243 HydrophobicContact CE3-CG1 4.2Å; W164-I244 CarbonylContact C-O 3.51Å; W164-I244 WeakPolarHBondContact CA-O 3.45Å; W164-I244 WeakPolarHBondContact CB-O 3.11Å; W164-K245 HydrophobicContact CB-CB 4.48Å; W164-N499 PolarHBondContact NE1-OD1 3.36Å; W164-P501 HydrophobicContact CB-CB 4.27Å; W164-P501 HydrophobicContact CD2-CB 4.16Å; W164-P501 HydrophobicContact CG-CB 4Å
165	Q	95.3	Very high	92.5	Very high	3 Å²	3	31.2 Å²	31.2	1%	0.014	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.2	-176.2	-55.3	-57.8	-23	0	0	109.3	L68 I155 N156 D163 W213 V243 I244	L68-Q165 HydrophobicContact CD2-CB 4.25Å; L68-Q165 HydrophobicContact CD2-CG 3.92Å; I155-Q165 HydrophobicContact CD1-CG 4.47Å; N156-Q165 PolarHBondContact O-NE2 3.35Å; D163-Q165 PolarHBondContact OD2-NE2 2.76Å; Q165-W213 HydrophobicContact CG-CH2 3.74Å; Q165-W213 HydrophobicContact CG-CZ3 3.9Å; Q165-V243 WeakPolarHBondContact O-CA 3.43Å; Q165-I244 HydrophobicContact CB-CD1 4.45Å; Q165-I244 HydrophobicContact CB-CG1 4.01Å; Q165-I244 PolarHBondContact N-O 3.04Å; Q165-I244 PolarHBondContact O-N 2.98Å
166	N	95.1	Very high	92.5	Very high	67 Å²	67	32.2 Å²	32.2	36%	0.358	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	90.2	173.9	-176.8	1.7	0	0	0	108	W164	W164-N166 HydrophobicContact CZ3-CB 4.31Å
167	C	95.9	Very high	92.6	Very high	1 Å²	1	31 Å²	31	1%	0.007	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	148.1	178.9	-65.4	0	0	0	0	110.8	L75 C153 Y241 L242	L75-C167 HydrophobicContact CD2-CB 3.59Å; C153-C167 HydrophobicContact CB-CB 3.72Å; C153-C167 WeakPolarHBondContact CB-SG 3.5Å; C153-C167 WeakPolarHBondContact SG-CA 3.28Å; C153-C167 WeakPolarHBondContact SG-CB 3.49Å; C153-C167 CovalentContact SG-SG 2.04Å; C153-C167 PolarHBondContact SG-SG 2.88Å; C167-Y241 CarbonylContact O-C 3.57Å; C167-Y241 WeakPolarHBondContact O-CA 2.93Å; C167-L242 PolarHBondContact N-O 2.85Å; C167-L242 PolarHBondContact O-N 3.23Å
168	T	96	Very high	92.6	Very high	42 Å²	42	31.7 Å²	31.7	26%	0.258	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	146.7	-176.1	62.2	0	0	0	0	110.8	N119 T239 F240 Y241	N119-T168 PolarHBondContact ND2-O 2.82Å; T168-T239 HydrophobicContact CG2-CG2 4.15Å; T168-F240 CarbonylContact C-O 3.54Å; T168-F240 WeakPolarHBondContact CA-O 3.43Å; T168-Y241 HydrophobicContact CG2-CD1 3.38Å; T168-Y241 HydrophobicContact CG2-CE1 3.57Å; T168-Y241 HydrophobicContact CG2-CG 4.24Å
169	L	95.1	Very high	92.7	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	101.3	171.5	-68.5	150.7	0	0	0	106.1	L60 L117 F149 F171 T239 F240 L242	L60-L169 HydrophobicContact CD2-CD1 3.95Å; L117-L169 HydrophobicContact CD1-CB 4.07Å; L117-L169 HydrophobicContact CD1-CD2 3.97Å; L117-L169 HydrophobicContact CD2-CD2 4.44Å; F149-L169 HydrophobicContact CB-CD2 4.33Å; L169-F171 HydrophobicContact CB-CE2 3.97Å; L169-T239 WeakPolarHBondContact O-CA 3.26Å; L169-F240 HydrophobicContact CB-CB 4.27Å; L169-F240 PolarHBondContact N-O 2.04Å; L169-F240 PolarHBondContact O-N 3.43Å; L169-L242 HydrophobicContact CD1-CD1 4.03Å
170	K	94.4	Very high	92.7	Very high	39 Å²	39	33.7 Å²	33.7	17%	0.17	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	112.4	-174.2	-173.6	-179.2	-175.1	-158.1	0	110.3	L117 E118 N119 D237	L117-K170 CarbonylContact C-O 3.58Å; L117-K170 WeakPolarHBondContact CA-O 3.49Å; E118-K170 HydrophobicContact CB-CD 4.44Å; E118-K170 PolarHBondContact N-O 2.8Å; E118-K170 WeakPolarHBondContact OE2-CD 3.41Å; E118-K170 WeakPolarHBondContact OE2-CE 3.32Å; E118-K170 IonicContact OE2-NZ 3.48Å; E118-K170 PolarHBondContact OE2-NZ 3.2Å; N119-K170 HydrophobicContact CB-CB 4.49Å; N119-K170 WeakPolarHBondContact OD1-CB 3.5Å; N119-K170 PolarHBondContact OD1-N 2.88Å; K170-D237 VanDerWaalsContact CE-CG 3.41Å; K170-D237 WeakPolarHBondContact CE-OD2 3.03Å; K170-D237 HydrophobicContact CG-CB 4.12Å
171	F	94.3	Very high	92.8	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	132.7	177.1	-67.4	-84.9	0	0	0	111.4	L58 L60 I81 I115 V116 L117 F149 L169 D237 I238 F240	L58-F171 HydrophobicContact CD2-CB 4Å; L58-F171 HydrophobicContact CD2-CD2 4.39Å; L58-F171 HydrophobicContact CD2-CG 4.2Å; L60-F171 HydrophobicContact CD1-CE2 4.28Å; L60-F171 HydrophobicContact CD1-CZ 4.17Å; L60-F171 HydrophobicContact CD2-CE2 4.46Å; I81-F171 HydrophobicContact CD1-CE1 4.02Å; I81-F171 HydrophobicContact CD1-CZ 4.43Å; I115-F171 HydrophobicContact CG2-CB 3.91Å; I115-F171 HydrophobicContact CG2-CD1 3.99Å; I115-F171 HydrophobicContact CG2-CG 4.36Å; V116-F171 WeakPolarHBondContact O-CA 3.21Å; L117-F171 HydrophobicContact CB-CE1 4.36Å; L117-F171 HydrophobicContact CD1-CE1 4.35Å; L117-F171 HydrophobicContact CD1-CE2 4.4Å; L117-F171 HydrophobicContact CD1-CZ 4.22Å; F149-F171 HydrophobicContact CD2-CZ 4.16Å; F149-F171 AromaticContact CE2-CE1 3.64Å; F149-F171 HydrophobicContact CE2-CE1 3.64Å; F149-F171 AromaticContact CE2-CZ 3.59Å; F149-F171 HydrophobicContact CE2-CZ 3.59Å; F149-F171 AromaticContact CZ-CE1 3.78Å; F149-F171 HydrophobicContact CZ-CE1 3.78Å; F149-F171 HydrophobicContact CZ-CZ 4.21Å; L169-F171 HydrophobicContact CB-CE2 3.97Å; F171-D237 WeakPolarHBondContact O-CA 3.45Å; F171-D237 WeakPolarHBondContact O-CB 3.31Å; F171-I238 PolarHBondContact N-O 3.12Å; F171-I238 PolarHBondContact O-N 2.69Å; F171-F240 AromaticContact CD2-CD2 3.53Å; F171-F240 HydrophobicContact CD2-CD2 3.53Å; F171-F240 AromaticContact CD2-CE2 3.6Å; F171-F240 HydrophobicContact CD2-CE2 3.6Å; F171-F240 AromaticContact CE2-CD2 3.59Å; F171-F240 HydrophobicContact CE2-CD2 3.59Å; F171-F240 AromaticContact CE2-CE2 3.84Å; F171-F240 HydrophobicContact CE2-CE2 3.84Å
172	S	92.2	Very high	92.9	Very high	12 Å²	12	37.4 Å²	37.4	8%	0.084	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	154.8	176.3	60.2	0	0	0	0	110.7	V116	V116-S172 PolarHBondContact N-O 3.41Å; V116-S172 PolarHBondContact O-N 2.85Å
173	S	91.3	Very high	93	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	130.5	168.9	49.7	0	0	0	0	110.4	Y176	S173-Y176 PolarHBondContact OG-O 3.45Å
174	L	85.2	Confident	93	Very high	96 Å²	96	37.3 Å²	37.3	50%	0.503	19%	0.186	S	C	.	.	S	Bend	trans	-76.2	-48.4	179.2	-175.2	62	0	0	0	111.4	E114 V116 N233	E114-L174 PolarHBondContact O-N 3.08Å; V116-L174 HydrophobicContact CG1-CB 4.24Å; V116-L174 HydrophobicContact CG1-CD2 4.44Å; V116-L174 HydrophobicContact CG2-CB 3.95Å; V116-L174 HydrophobicContact CG2-CD1 4.38Å; L174-N233 PolarHBondContact O-ND2 3.02Å; L174-N233 VanDerWaalsContact O-ND2 3.12Å
175	T	88.7	Confident	93	Very high	73 Å²	73	34.7 Å²	34.7	45%	0.448	18%	0.177	S	C	.	.	S	Bend	trans	-97	-32.9	-170.4	37	0	0	0	0	114.4	E114	E114-T175 WeakPolarHBondContact OE2-CB 3.41Å; E114-T175 WeakPolarHBondContact OE2-CG2 3.08Å; E114-T175 PolarHBondContact OE2-OG1 2.97Å
176	Y	91.4	Very high	92.8	Very high	37 Å²	37	37.7 Å²	37.7	15%	0.145	19%	0.19	C	C	.	.			trans	-99.9	149.7	-172.5	-62.7	-73	0	0	0	113.4	W111 S173 E180 I181	W111-Y176 HydrophobicContact CZ2-CD2 4.48Å; W111-Y176 AromaticContact CZ2-CE2 3.88Å; W111-Y176 HydrophobicContact CZ2-CE2 3.88Å; W111-Y176 AromaticContact NE1-CE2 3.94Å; W111-Y176 AromaticContact NE1-CZ 3.54Å; W111-Y176 PolarHBondContact NE1-OH 3.49Å; S173-Y176 PolarHBondContact OG-O 3.45Å; Y176-E180 WeakPolarHBondContact CA-OE2 3.43Å; Y176-E180 HydrophobicContact CD1-CB 4.24Å; Y176-I181 HydrophobicContact CD1-CD1 4.19Å; Y176-I181 HydrophobicContact CD1-CG1 4.44Å; Y176-I181 HydrophobicContact CD2-CD1 3.26Å; Y176-I181 HydrophobicContact CD2-CG1 4.29Å; Y176-I181 HydrophobicContact CE2-CD1 3.99Å; Y176-I181 HydrophobicContact CG-CD1 3.36Å; Y176-I181 HydrophobicContact CG-CG1 3.91Å
177	N	91.9	Very high	92.6	Very high	44 Å²	44	37.8 Å²	37.8	24%	0.235	19%	0.189	C	C	.	.			trans	-97.5	168.9	177.5	-65.1	-37	0	0	0	112.6	K179 E180 I181 E231 N233	N177-K179 PolarHBondContact O-N 2.9Å; N177-K179 VanDerWaalsContact O-N 3.13Å; N177-E180 PolarHBondContact N-OE2 2.92Å; N177-E180 PolarHBondContact O-N 3.5Å; N177-I181 PolarHBondContact O-N 2.78Å; N177-E231 PolarHBondContact ND2-O 3.44Å; N177-E231 PolarHBondContact OD1-O 3.15Å; N177-N233 PolarHBondContact OD1-N 3.18Å
178	A	91.4	Very high	92	Very high	19 Å²	19	42.1 Å²	42.1	16%	0.157	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.8	179	0	0	0	0	0	114.3	I181 M230 H235 Q236	A178-I181 WeakPolarHBondContact CA-O 3.16Å; A178-M230 HydrophobicContact CB-CB 4.47Å; A178-M230 PolarHBondContact N-O 3.21Å; A178-H235 HydrophobicContact CB-CB 4.12Å; A178-Q236 HydrophobicContact CB-CG 4.05Å
179	K	91	Very high	91.1	Very high	106 Å²	106	41.7 Å²	41.7	46%	0.461	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-16.5	171.9	-67.4	-176	177.8	177.4	0	113.4	V53 N177 M230 E231	V53-K179 WeakPolarHBondContact CG2-O 3.49Å; N177-K179 PolarHBondContact O-N 2.9Å; N177-K179 VanDerWaalsContact O-N 3.13Å; K179-M230 HydrophobicContact CG-CB 4Å; K179-E231 HydrophobicContact CD-CG 4.17Å; K179-E231 IonicContact NZ-OE1 3.64Å; K179-E231 PolarHBondContact NZ-OE1 3.24Å
180	E	92.5	Very high	89.7	Confident	56 Å²	56	48.7 Å²	48.7	26%	0.262	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-41.2	-174	-62.6	172.6	136.8	0	0	111.3	V53 V54 Y176 N177	V53-E180 WeakPolarHBondContact CA-O 3.46Å; V53-E180 WeakPolarHBondContact CG1-O 3.4Å; V54-E180 PolarHBondContact N-O 2.7Å; Y176-E180 WeakPolarHBondContact CA-OE2 3.43Å; Y176-E180 HydrophobicContact CD1-CB 4.24Å; N177-E180 PolarHBondContact N-OE2 2.92Å; N177-E180 PolarHBondContact O-N 3.5Å
181	I	93.7	Very high	88.4	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	136.8	177.4	-60.4	-175.2	0	0	0	109.2	V54 V56 W111 P113 Y176 N177 A178 M183 Q236	V54-I181 HydrophobicContact CB-CG1 4.47Å; V54-I181 CarbonylContact O-C 3.59Å; V54-I181 WeakPolarHBondContact O-CA 3.34Å; V56-I181 HydrophobicContact CB-CG2 4.02Å; V56-I181 HydrophobicContact CG2-CG2 3.52Å; W111-I181 HydrophobicContact CH2-CD1 3.8Å; W111-I181 HydrophobicContact CH2-CG1 4.49Å; W111-I181 HydrophobicContact CZ2-CD1 3.75Å; P113-I181 HydrophobicContact CB-CD1 4.17Å; Y176-I181 HydrophobicContact CD1-CD1 4.19Å; Y176-I181 HydrophobicContact CD1-CG1 4.44Å; Y176-I181 HydrophobicContact CD2-CD1 3.26Å; Y176-I181 HydrophobicContact CD2-CG1 4.29Å; Y176-I181 HydrophobicContact CE2-CD1 3.99Å; Y176-I181 HydrophobicContact CG-CD1 3.36Å; Y176-I181 HydrophobicContact CG-CG1 3.91Å; N177-I181 PolarHBondContact O-N 2.78Å; A178-I181 WeakPolarHBondContact CA-O 3.16Å; I181-M183 HydrophobicContact CG2-CG 4.49Å; I181-Q236 PolarHBondContact O-NE2 3.47Å
182	K	94.3	Very high	87	Confident	89 Å²	89	56 Å²	56	39%	0.387	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	113.1	171.4	-174.2	-175.7	178.7	-156.9	0	108.1	V53 V54 D55 V56 L184	V53-K182 HydrophobicContact CG1-CB 3.79Å; V54-K182 PolarHBondContact O-N 3.33Å; D55-K182 WeakPolarHBondContact OD1-CB 3.49Å; D55-K182 WeakPolarHBondContact OD1-CD 3.37Å; V56-K182 PolarHBondContact N-O 3.36Å; K182-L184 HydrophobicContact CD-CD1 4.42Å; K182-L184 HydrophobicContact CD-CD2 4.42Å; K182-L184 HydrophobicContact CD-CG 4.49Å; K182-L184 HydrophobicContact CG-CD2 4.34Å; K182-L184 HydrophobicContact CG-CG 4.29Å
183	M	94.4	Very high	86.1	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.2	176.5	-64	-171.7	-73.1	0	0	109.5	V56 I181 K222 Q236 I238	V56-M183 WeakPolarHBondContact O-CA 3.17Å; I181-M183 HydrophobicContact CG2-CG 4.49Å; M183-K222 VanDerWaalsContact O-CD 3.28Å; M183-K222 WeakPolarHBondContact O-CD 3.45Å; M183-K222 WeakPolarHBondContact O-CE 3.35Å; M183-K222 PolarHBondContact O-NZ 3Å; M183-Q236 HydrophobicContact CE-CB 4.24Å; M183-Q236 HydrophobicContact CE-CG 3.63Å; M183-Q236 WeakPolarHBondContact CE-O 3.37Å; M183-I238 HydrophobicContact CB-CD1 3.79Å; M183-I238 HydrophobicContact CB-CG1 4.11Å
184	L	94.5	Very high	85.6	Confident	27 Å²	27	64.6 Å²	64.6	14%	0.141	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	153.5	179.4	-66.8	174.3	0	0	0	109.5	D55 V56 F57 L58 K182 I238	D55-L184 HydrophobicContact CB-CD1 4.24Å; V56-L184 PolarHBondContact O-N 3.48Å; F57-L184 CarbonylContact C-O 3.45Å; F57-L184 WeakPolarHBondContact CA-O 3.4Å; F57-L184 HydrophobicContact CD1-CB 3.81Å; F57-L184 HydrophobicContact CD1-CD1 4.43Å; F57-L184 HydrophobicContact CE1-CB 4Å; F57-L184 HydrophobicContact CE1-CD1 3.79Å; F57-L184 HydrophobicContact CZ-CD1 4.09Å; L58-L184 PolarHBondContact N-O 3.49Å; K182-L184 HydrophobicContact CD-CD1 4.42Å; K182-L184 HydrophobicContact CD-CD2 4.42Å; K182-L184 HydrophobicContact CD-CG 4.49Å; K182-L184 HydrophobicContact CG-CD2 4.34Å; K182-L184 HydrophobicContact CG-CG 4.29Å; L184-I238 WeakPolarHBondContact O-CD1 3.35Å
185	L	94.4	Very high	85.7	Confident	13 Å²	13	61.6 Å²	61.6	7%	0.068	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	149.4	168.8	-71	167.9	0	0	0	108.7	F57 L58 E187 E198 A220 I238 F240	F57-L185 WeakPolarHBondContact CD1-O 3.5Å; L58-L185 WeakPolarHBondContact O-CA 3.47Å; L185-E187 PolarHBondContact O-N 3.24Å; L185-E198 HydrophobicContact CD1-CG 4.27Å; L185-A220 HydrophobicContact CD1-CB 4.38Å; L185-A220 HydrophobicContact CD2-CB 3.81Å; L185-I238 HydrophobicContact CD2-CD1 4.49Å; L185-I238 HydrophobicContact CD2-CG2 3.64Å; L185-F240 HydrophobicContact CD2-CE1 4.36Å; L185-F240 HydrophobicContact CD2-CZ 4.38Å
186	K	92.1	Very high	85.7	Confident	66 Å²	66	59.1 Å²	59.1	29%	0.287	32%	0.321	S	S	.	.			trans	-54.1	138.1	175.2	-176.2	174.9	-177.3	171.2	0	110.7	L58 A59 D82 V197	L58-K186 PolarHBondContact O-N 3.1Å; A59-K186 HydrophobicContact CB-CB 3.62Å; A59-K186 HydrophobicContact CB-CD 3.84Å; A59-K186 HydrophobicContact CB-CG 4.4Å; D82-K186 WeakPolarHBondContact OD2-CD 3.39Å; D82-K186 WeakPolarHBondContact OD2-CE 3.45Å; D82-K186 IonicContact OD2-NZ 3.61Å; D82-K186 PolarHBondContact OD2-NZ 2.74Å; K186-V197 HydrophobicContact CB-CB 4.41Å; K186-V197 HydrophobicContact CB-CG2 4.4Å; K186-V197 HydrophobicContact CG-CG2 4.48Å; K186-V197 PolarHBondContact O-N 2.96Å
187	E	90.1	Very high	85.7	Confident	69 Å²	69	57.7 Å²	57.7	32%	0.322	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.9	173.5	-62.5	176.2	-174.3	0	0	107.8	F57 L185 Q194 H195 T196 L521	F57-E187 HydrophobicContact CE1-CG 4.27Å; L185-E187 PolarHBondContact O-N 3.24Å; E187-Q194 HydrophobicContact CB-CG 4.37Å; E187-Q194 PolarHBondContact OE2-NE2 3.13Å; E187-H195 CarbonylContact C-O 3.6Å; E187-H195 WeakPolarHBondContact CA-O 3.22Å; E187-T196 HydrophobicContact CG-CG2 4.13Å; E187-L521 HydrophobicContact CB-CD1 4.44Å; E187-L521 HydrophobicContact CG-CD1 3.92Å
188	D	83.6	Confident	85.7	Confident	91 Å²	91	57.1 Å²	57.1	49%	0.487	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.8	178.7	-161.1	5.6	0	0	0	110.4	Q194 H195 V197	D188-Q194 CarbonylContact O-C 3.54Å; D188-Q194 WeakPolarHBondContact O-CA 3.43Å; D188-H195 PolarHBondContact N-O 2.84Å; D188-H195 PolarHBondContact O-CE1 2.91Å; D188-H195 PolarHBondContact O-N 3.34Å; D188-H195 PolarHBondContact O-ND1 2.78Å; D188-V197 HydrophobicContact CB-CG2 4.02Å
189	G	75.8	Confident	85.9	Confident	33 Å²	33	56.7 Å²	56.7	34%	0.34	31%	0.307	S	S	.	.	S	Bend	trans	120.4	157.9	176.8	0	0	0	0	0	115.6
190	N	66.8	Low	86.1	Confident	149 Å²	149	51.7 Å²	51.7	80%	0.797	29%	0.285	S	S	*	.	S	Bend	trans	-88.7	111.3	177.4	-73.3	-17.5	0	0	0	109.8	T192 H193	N190-T192 VanDerWaalsContact C-N 3.32Å; N190-T192 PolarHBondContact O-N 2.92Å; N190-H193 PolarHBondContact O-N 3.11Å; N190-H193 VanDerWaalsContact O-N 3.08Å
191	G	67.1	Low	86.1	Confident	69 Å²	69	51 Å²	51	71%	0.711	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	47.2	-77.2	164.2	0	0	0	0	0	117
192	T	64	Low	86.1	Confident	124 Å²	124	51.8 Å²	51.8	76%	0.761	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-80.1	-13.3	-178.3	56.7	0	0	0	0	114.8	N190	N190-T192 VanDerWaalsContact C-N 3.32Å; N190-T192 PolarHBondContact O-N 2.92Å
193	H	73.6	Confident	85.8	Confident	114 Å²	114	50.8 Å²	50.8	53%	0.528	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-126.1	40.6	180	-65.1	-69.4	0	0	0	112.4	N190 H195 L520	N190-H193 PolarHBondContact O-N 3.11Å; N190-H193 VanDerWaalsContact O-N 3.08Å; H193-H195 PolarHBondContact O-N 3.14Å; H193-H195 PolarHBondContact O-ND1 2.8Å; H193-L520 HydrophobicContact CB-CD2 4.3Å
194	Q	82.1	Confident	85.4	Confident	80 Å²	80	56.4 Å²	56.4	37%	0.374	32%	0.324	S	S	.	.			trans	-69.1	130.6	174.9	-159.1	169.5	-15.6	0	0	109.1	E187 D188 L521	E187-Q194 HydrophobicContact CB-CG 4.37Å; E187-Q194 PolarHBondContact OE2-NE2 3.13Å; D188-Q194 CarbonylContact O-C 3.54Å; D188-Q194 WeakPolarHBondContact O-CA 3.43Å; Q194-L521 HydrophobicContact CB-CD1 4.45Å; Q194-L521 HydrophobicContact CG-CD1 3.97Å; Q194-L521 WeakPolarHBondContact O-CB 3.42Å; Q194-L521 PolarHBondContact O-N 2.92Å
195	H	85.9	Confident	84.9	Confident	33 Å²	33	59.5 Å²	59.5	15%	0.153	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	151.8	178.4	57.1	-91.1	0	0	0	110.5	E187 D188 H193 W199 P518 R519 L520	E187-H195 CarbonylContact C-O 3.6Å; E187-H195 WeakPolarHBondContact CA-O 3.22Å; D188-H195 PolarHBondContact N-O 2.84Å; D188-H195 PolarHBondContact O-CE1 2.91Å; D188-H195 PolarHBondContact O-N 3.34Å; D188-H195 PolarHBondContact O-ND1 2.78Å; H193-H195 PolarHBondContact O-N 3.14Å; H193-H195 PolarHBondContact O-ND1 2.8Å; H195-W199 AromaticContact CD2-CH2 3.89Å; H195-P518 HydrophobicContact CB-CB 3.88Å; H195-R519 WeakPolarHBondContact CA-O 3.17Å; H195-R519 VanDerWaalsContact CB-O 3.23Å; H195-R519 WeakPolarHBondContact CB-O 3.48Å; H195-L520 HydrophobicContact CB-CD2 4.47Å
196	T	88.7	Confident	84.3	Confident	20 Å²	20	62 Å²	62	12%	0.123	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	133.8	172.2	43.2	0	0	0	0	110.1	E187 E198 L521	E187-T196 HydrophobicContact CG-CG2 4.13Å; T196-E198 VanDerWaalsContact C-N 3.31Å; T196-E198 PolarHBondContact O-N 2.83Å; T196-E198 WeakPolarHBondContact OG1-CG 3.19Å; T196-E198 PolarHBondContact OG1-OE1 2.72Å; T196-L521 HydrophobicContact CG2-CD1 3.93Å; T196-L521 HydrophobicContact CG2-CD2 3.92Å; T196-L521 HydrophobicContact CG2-CG 4.11Å
197	V	91.6	Very high	84.2	Confident	8 Å²	8	60.9 Å²	60.9	5%	0.048	37%	0.368	C	S	.	.			trans	-77.3	87.1	170.8	-176.6	0	0	0	0	107.7	K186 D188 W199 V201	K186-V197 HydrophobicContact CB-CB 4.41Å; K186-V197 HydrophobicContact CB-CG2 4.4Å; K186-V197 HydrophobicContact CG-CG2 4.48Å; K186-V197 PolarHBondContact O-N 2.96Å; D188-V197 HydrophobicContact CB-CG2 4.02Å; V197-W199 HydrophobicContact CG1-CD2 4.15Å; V197-W199 HydrophobicContact CG1-CG 4.37Å; V197-W199 HydrophobicContact CG1-CZ2 4.17Å; V197-W199 PolarHBondContact O-N 2.96Å; V197-V201 HydrophobicContact CG1-CG2 3.97Å
198	E	92.8	Very high	84.1	Confident	32 Å²	32	61.7 Å²	61.7	15%	0.15	38%	0.377	C	S	.	.			trans	-89.1	27.6	178.8	-51.3	-167.4	150.2	0	0	112.4	L185 T196 P219 A220 H511 Y513 R519	L185-E198 HydrophobicContact CD1-CG 4.27Å; T196-E198 VanDerWaalsContact C-N 3.31Å; T196-E198 PolarHBondContact O-N 2.83Å; T196-E198 WeakPolarHBondContact OG1-CG 3.19Å; T196-E198 PolarHBondContact OG1-OE1 2.72Å; E198-P219 CarbonylContact O-C 3.58Å; E198-P219 WeakPolarHBondContact O-CA 3.29Å; E198-A220 PolarHBondContact O-N 3.03Å; E198-H511 IonicContact OE2-CD2 3.73Å; E198-H511 IonicContact OE2-NE2 2.71Å; E198-Y513 HydrophobicContact CB-CD1 3.61Å; E198-Y513 HydrophobicContact CB-CE1 4.03Å; E198-Y513 WeakPolarHBondContact O-CD1 3.38Å; E198-Y513 VanDerWaalsContact OE2-CE1 3.22Å; E198-Y513 WeakPolarHBondContact OE2-CE1 3.49Å; E198-R519 IonicContact OE2-CZ 3.87Å; E198-R519 IonicContact OE2-NH1 2.9Å; E198-R519 PolarHBondContact OE2-NH1 2.95Å
199	W	94.3	Very high	84.2	Confident	9 Å²	9	64.3 Å²	64.3	3%	0.034	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-141.1	161.3	178.4	57.3	90.5	0	0	0	112.3	H195 V197 R218 Y513 E515 P518	H195-W199 AromaticContact CD2-CH2 3.89Å; V197-W199 HydrophobicContact CG1-CD2 4.15Å; V197-W199 HydrophobicContact CG1-CG 4.37Å; V197-W199 HydrophobicContact CG1-CZ2 4.17Å; V197-W199 PolarHBondContact O-N 2.96Å; W199-R218 CarbonylContact C-O 3.59Å; W199-R218 VanDerWaalsContact CA-O 3.26Å; W199-R218 WeakPolarHBondContact CA-O 3.28Å; W199-Y513 WeakPolarHBondContact CB-O 3.3Å; W199-E515 HydrophobicContact CD2-CB 4.28Å; W199-E515 HydrophobicContact CZ2-CB 3.9Å; W199-E515 HydrophobicContact CZ2-CG 3.78Å; W199-P518 HydrophobicContact CH2-CB 3.91Å; W199-P518 HydrophobicContact CZ3-CB 4.1Å
200	I	95.3	Very high	85	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	38%	0.379	C	S	.	.			trans	-75.6	124.5	167.2	-56.2	167.3	0	0	0	107.4	L60 L62 R218 F240 L242	L60-I200 HydrophobicContact CB-CG2 4.47Å; L60-I200 HydrophobicContact CD2-CD1 4.5Å; L60-I200 HydrophobicContact CD2-CG1 4.34Å; L60-I200 HydrophobicContact CD2-CG2 4.31Å; L60-I200 HydrophobicContact CG-CG2 4.46Å; L60-I200 WeakPolarHBondContact O-CG2 3.25Å; L62-I200 HydrophobicContact CB-CG2 3.65Å; I200-R218 HydrophobicContact CB-CB 4.11Å; I200-R218 HydrophobicContact CB-CG 4.48Å; I200-R218 HydrophobicContact CD1-CB 4.2Å; I200-R218 HydrophobicContact CG1-CB 4.4Å; I200-R218 PolarHBondContact N-O 3.08Å; I200-R218 WeakPolarHBondContact O-CD 3.3Å; I200-R218 PolarHBondContact O-NE 2.96Å; I200-F240 HydrophobicContact CD1-CB 3.9Å; I200-F240 HydrophobicContact CG1-CB 3.89Å; I200-F240 HydrophobicContact CG1-CD1 3.71Å; I200-F240 HydrophobicContact CG1-CG 4.2Å; I200-L242 HydrophobicContact CD1-CD1 4.31Å; I200-L242 HydrophobicContact CD1-CD2 3.5Å; I200-L242 VanDerWaalsContact CD1-CD2 3.5Å; I200-L242 HydrophobicContact CD1-CG 3.59Å
201	V	93.9	Very high	86.1	Confident	42 Å²	42	60.4 Å²	60.4	26%	0.255	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-73.9	134.5	178.1	-177.7	0	0	0	0	108.7	L60 T61 L62 V197	L60-V201 PolarHBondContact O-N 2.85Å; T61-V201 CarbonylContact C-O 3.59Å; T61-V201 VanDerWaalsContact CA-O 3.26Å; T61-V201 WeakPolarHBondContact CA-O 3.47Å; T61-V201 HydrophobicContact CG2-CB 4.31Å; T61-V201 HydrophobicContact CG2-CG1 4.27Å; L62-V201 PolarHBondContact N-O 2.8Å; V197-V201 HydrophobicContact CG1-CG2 3.97Å
202	I	92.9	Very high	87.3	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.087	35%	0.354	C	S	.	.			trans	-127.7	117.5	173.7	-60.7	-169.1	0	0	0	107	L62 P204 F207 I215	L62-I202 HydrophobicContact CB-CG1 4.27Å; L62-I202 HydrophobicContact CD2-CD1 4.16Å; I202-P204 WeakPolarHBondContact O-CD 3.32Å; I202-F207 HydrophobicContact CD1-CE2 4.23Å; I202-F207 HydrophobicContact CD1-CZ 4.39Å; I202-F207 HydrophobicContact CG2-CB 3.52Å; I202-F207 HydrophobicContact CG2-CD1 3.85Å; I202-F207 HydrophobicContact CG2-CD2 3.49Å; I202-F207 VanDerWaalsContact CG2-CD2 3.49Å; I202-F207 HydrophobicContact CG2-CE1 4.42Å; I202-F207 HydrophobicContact CG2-CE2 4.15Å; I202-F207 HydrophobicContact CG2-CG 3.34Å; I202-I215 HydrophobicContact CD1-CD1 3.92Å
203	D	88.9	Confident	88.7	Confident	68 Å²	68	54.5 Å²	54.5	36%	0.364	32%	0.319	S	S	.	.			trans	-79.8	114.2	173.7	168.7	19.7	0	0	0	109.2	A205 S206 F207	D203-A205 PolarHBondContact O-N 2.87Å; D203-A205 VanDerWaalsContact O-N 3.15Å; D203-A205 WeakPolarHBondContact OD1-CB 3.44Å; D203-A205 PolarHBondContact OD1-N 2.95Å; D203-S206 WeakPolarHBondContact CB-OG 3.4Å; D203-S206 VanDerWaalsContact CG-OG 3.3Å; D203-S206 PolarHBondContact O-N 2.8Å; D203-S206 WeakPolarHBondContact OD2-CB 3.45Å; D203-S206 PolarHBondContact OD2-OG 3.42Å; D203-F207 WeakPolarHBondContact O-CB 3.33Å; D203-F207 PolarHBondContact O-N 2.92Å
204	P	84.4	Confident	89.7	Confident	119 Å²	119	53.1 Å²	53.1	77%	0.773	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-20	-176.2	27.9	-35.9	0	0	0	113.4	I202	I202-P204 WeakPolarHBondContact O-CD 3.32Å
205	A	84.4	Confident	90.2	Very high	93 Å²	93	51.2 Å²	51.2	77%	0.769	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-33.1	179.9	0	0	0	0	0	112.9	D203	D203-A205 PolarHBondContact O-N 2.87Å; D203-A205 VanDerWaalsContact O-N 3.15Å; D203-A205 WeakPolarHBondContact OD1-CB 3.44Å; D203-A205 PolarHBondContact OD1-N 2.95Å
206	S	83.3	Confident	90.6	Very high	64 Å²	64	52.4 Å²	52.4	45%	0.448	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-10.3	-177.4	60	0	0	0	0	114.2	D203	D203-S206 WeakPolarHBondContact CB-OG 3.4Å; D203-S206 VanDerWaalsContact CG-OG 3.3Å; D203-S206 PolarHBondContact O-N 2.8Å; D203-S206 WeakPolarHBondContact OD2-CB 3.45Å; D203-S206 PolarHBondContact OD2-OG 3.42Å
207	F	88.9	Confident	90.9	Very high	44 Å²	44	52.5 Å²	52.5	19%	0.193	31%	0.31	C	S	.	.			trans	-75.7	127	179.5	-176.9	-108.8	0	0	0	112.1	L62 S63 I202 D203 E209 I215	L62-F207 HydrophobicContact CD2-CE2 4.14Å; L62-F207 HydrophobicContact CG-CE2 4.35Å; S63-F207 WeakPolarHBondContact O-CD2 3.43Å; I202-F207 HydrophobicContact CD1-CE2 4.23Å; I202-F207 HydrophobicContact CD1-CZ 4.39Å; I202-F207 HydrophobicContact CG2-CB 3.52Å; I202-F207 HydrophobicContact CG2-CD1 3.85Å; I202-F207 HydrophobicContact CG2-CD2 3.49Å; I202-F207 VanDerWaalsContact CG2-CD2 3.49Å; I202-F207 HydrophobicContact CG2-CE1 4.42Å; I202-F207 HydrophobicContact CG2-CE2 4.15Å; I202-F207 HydrophobicContact CG2-CG 3.34Å; D203-F207 WeakPolarHBondContact O-CB 3.33Å; D203-F207 PolarHBondContact O-N 2.92Å; F207-E209 HydrophobicContact CD1-CG 4.19Å; F207-E209 HydrophobicContact CE1-CB 4.41Å; F207-E209 HydrophobicContact CE1-CG 3.67Å; F207-I215 HydrophobicContact CE2-CD1 4.13Å; F207-I215 HydrophobicContact CZ-CD1 3.65Å
208	T	87.3	Confident	91	Very high	85 Å²	85	55.7 Å²	55.7	52%	0.521	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-104.9	119.7	168.5	59.6	0	0	0	0	110.4	N64	N64-T208 VanDerWaalsContact CG-OG1 3.27Å; N64-T208 PolarHBondContact OD1-N 2.99Å; N64-T208 PolarHBondContact OD1-OG1 2.94Å
209	E	87.2	Confident	91.2	Very high	147 Å²	147	54.2 Å²	54.2	69%	0.687	32%	0.315	S	S	*	.			trans	-64.2	140.1	175.6	-79.8	-174.3	-157.2	0	0	111.5	F207 K247	F207-E209 HydrophobicContact CD1-CG 4.19Å; F207-E209 HydrophobicContact CE1-CB 4.41Å; F207-E209 HydrophobicContact CE1-CG 3.67Å; E209-K247 IonicContact OE2-NZ 2.73Å
210	N	91.4	Very high	91.3	Very high	32 Å²	32	53.8 Å²	53.8	17%	0.171	31%	0.313	C	S	.	.			trans	-74	142.1	173.9	-164.4	-30.8	0	0	0	110.5	L65 I66 E212 W213 K247	L65-N210 HydrophobicContact CD2-CB 4.38Å; L65-N210 VanDerWaalsContact CD2-ND2 3.32Å; L65-N210 WeakPolarHBondContact CD2-ND2 3.23Å; L65-N210 PolarHBondContact O-ND2 3.15Å; I66-N210 PolarHBondContact O-ND2 2.78Å; N210-E212 VanDerWaalsContact C-N 3.31Å; N210-E212 PolarHBondContact O-N 2.84Å; N210-E212 PolarHBondContact OD1-N 3.08Å; N210-E212 VanDerWaalsContact OD1-N 3.08Å; N210-W213 HydrophobicContact CB-CB 4.34Å; N210-K247 PolarHBondContact O-NZ 3.11Å; N210-K247 VanDerWaalsContact O-NZ 3.08Å
211	G	90.5	Very high	91.2	Very high	67 Å²	67	57.2 Å²	57.2	69%	0.691	33%	0.328	S	S	*	.	S	Bend	trans	-69.5	-25.6	176.6	0	0	0	0	0	113.7	K247	G211-K247 WeakPolarHBondContact O-CD 3.5Å
212	E	91.3	Very high	91.2	Very high	64 Å²	64	57.6 Å²	57.6	30%	0.299	33%	0.326	S	S	.	.	S	Bend	trans	-103.5	-27.1	-178.2	-174.6	166.6	-164.1	0	0	113.7	N210 R246 K247 Y251	N210-E212 VanDerWaalsContact C-N 3.31Å; N210-E212 PolarHBondContact O-N 2.84Å; N210-E212 PolarHBondContact OD1-N 3.08Å; N210-E212 VanDerWaalsContact OD1-N 3.08Å; E212-R246 HydrophobicContact CG-CG 4.21Å; E212-R246 CarbonylContact O-C 3.59Å; E212-R246 IonicContact OE1-CZ 3.78Å; E212-R246 IonicContact OE1-NH1 3.02Å; E212-R246 PolarHBondContact OE1-NH1 3.32Å; E212-K247 WeakPolarHBondContact O-CB 3.44Å; E212-K247 PolarHBondContact O-N 2.87Å; E212-Y251 PolarHBondContact OE1-OH 3.33Å
213	W	94.2	Very high	91.2	Very high	6 Å²	6	58 Å²	58	2%	0.023	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134.8	-171.6	-64.2	98.5	0	0	0	111.9	L65 L68 Q165 N210 I244 R246	L65-W213 HydrophobicContact CD2-CB 4.36Å; L68-W213 HydrophobicContact CB-CZ2 4.12Å; L68-W213 HydrophobicContact CD2-CH2 3.71Å; L68-W213 HydrophobicContact CD2-CZ2 3.49Å; L68-W213 VanDerWaalsContact CD2-CZ2 3.49Å; L68-W213 HydrophobicContact CD2-CZ3 4.4Å; L68-W213 HydrophobicContact CG-CZ2 4.29Å; Q165-W213 HydrophobicContact CG-CH2 3.74Å; Q165-W213 HydrophobicContact CG-CZ3 3.9Å; N210-W213 HydrophobicContact CB-CB 4.34Å; W213-I244 HydrophobicContact CD2-CD1 3.97Å; W213-I244 HydrophobicContact CE3-CB 4.11Å; W213-I244 HydrophobicContact CE3-CD1 3.78Å; W213-I244 HydrophobicContact CE3-CG1 3.89Å; W213-I244 HydrophobicContact CG-CD1 4.35Å; W213-I244 HydrophobicContact CZ3-CD1 4.24Å; W213-I244 HydrophobicContact CZ3-CG1 4.22Å; W213-R246 HydrophobicContact CE3-CB 4.1Å; W213-R246 HydrophobicContact CH2-CB 4.1Å; W213-R246 HydrophobicContact CH2-CG 4.4Å; W213-R246 VanDerWaalsContact CH2-CZ 3.4Å; W213-R246 HydrophobicContact CZ3-CB 3.74Å; W213-R246 HydrophobicContact CZ3-CG 4.41Å
214	E	93.8	Very high	91.4	Very high	85 Å²	85	59.2 Å²	59.2	40%	0.397	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.3	172.3	-175.8	-178.3	-173.5	0	0	109.1	I216 I244 K245	E214-I216 HydrophobicContact CG-CD1 4Å; E214-I244 CarbonylContact O-C 3.58Å; E214-I244 WeakPolarHBondContact O-CA 2.9Å; E214-K245 PolarHBondContact N-O 2.73Å; E214-K245 PolarHBondContact O-N 3.22Å
215	I	94.3	Very high	91.7	Very high	40 Å²	40	57.1 Å²	57.1	21%	0.205	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.9	176.2	-56.3	175.3	0	0	0	108.4	L62 L65 I202 F207 R218 L242 I244	L62-I215 HydrophobicContact CD2-CD1 3.58Å; L65-I215 HydrophobicContact CD1-CD1 4.43Å; L65-I215 HydrophobicContact CD1-CG1 4.31Å; I202-I215 HydrophobicContact CD1-CD1 3.92Å; F207-I215 HydrophobicContact CE2-CD1 4.13Å; F207-I215 HydrophobicContact CZ-CD1 3.65Å; I215-R218 HydrophobicContact CG2-CB 4.27Å; I215-L242 HydrophobicContact CG2-CD2 4.21Å; I215-I244 HydrophobicContact CB-CG2 4.5Å; I215-I244 HydrophobicContact CG1-CG2 4.02Å
216	I	93.4	Very high	92	Very high	58 Å²	58	62.3 Å²	62.3	30%	0.297	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-56.3	-179.1	-54.5	-65.3	0	0	0	109.9	E214 V243 K245 P501	E214-I216 HydrophobicContact CG-CD1 4Å; I216-V243 PolarHBondContact N-O 2.92Å; I216-K245 HydrophobicContact CD1-CB 4.03Å; I216-K245 HydrophobicContact CD1-CD 4.27Å; I216-K245 HydrophobicContact CG1-CB 3.72Å; I216-P501 HydrophobicContact CB-CG 4.42Å; I216-P501 HydrophobicContact CG1-CG 4.08Å; I216-P501 HydrophobicContact CG2-CG 3.98Å
217	H	94.5	Very high	92.3	Very high	22 Å²	22	66.3 Å²	66.3	10%	0.102	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	144.6	178.2	-57.1	-64.8	0	0	0	110.6	V243 P502 R503 P505 D512	H217-V243 HydrophobicContact CB-CB 3.85Å; H217-V243 HydrophobicContact CB-CG2 3.92Å; H217-V243 PolarHBondContact N-O 3.41Å; H217-V243 PolarHBondContact O-N 3.01Å; H217-P502 PolarHBondContact NE2-O 3.1Å; H217-R503 PolarHBondContact CE1-O 2.81Å; H217-R503 PolarHBondContact NE2-O 2.85Å; H217-P505 HydrophobicContact CB-CB 4.06Å; H217-D512 IonicContact CE1-OD1 3.46Å
218	R	95	Very high	92.3	Very high	74 Å²	74	65.9 Å²	65.9	28%	0.279	33%	0.327	S	S	.	.			trans	-138.1	49.9	-177.1	63.6	-176.9	-171.7	-131.1	2.4	114.1	W199 I200 I215 Y241 L242 E515	W199-R218 CarbonylContact C-O 3.59Å; W199-R218 VanDerWaalsContact CA-O 3.26Å; W199-R218 WeakPolarHBondContact CA-O 3.28Å; I200-R218 HydrophobicContact CB-CB 4.11Å; I200-R218 HydrophobicContact CB-CG 4.48Å; I200-R218 HydrophobicContact CD1-CB 4.2Å; I200-R218 HydrophobicContact CG1-CB 4.4Å; I200-R218 PolarHBondContact N-O 3.08Å; I200-R218 WeakPolarHBondContact O-CD 3.3Å; I200-R218 PolarHBondContact O-NE 2.96Å; I215-R218 HydrophobicContact CG2-CB 4.27Å; R218-Y241 CarbonylContact C-O 3.55Å; R218-Y241 WeakPolarHBondContact CA-O 3.44Å; R218-L242 HydrophobicContact CB-CD2 4.22Å; R218-E515 IonicContact NH2-OE2 3.92Å
219	P	96.1	Very high	92.5	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.006	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-77.1	154.9	-173.3	34.6	-37.4	0	0	0	112.5	E198 Y241 P505 F506 Y513	E198-P219 CarbonylContact O-C 3.58Å; E198-P219 WeakPolarHBondContact O-CA 3.29Å; P219-Y241 WeakPolarHBondContact CD-O 3.38Å; P219-Y241 HydrophobicContact CG-CD2 4.33Å; P219-Y241 HydrophobicContact CG-CG 4.39Å; P219-Y241 PolarHBondContact O-N 3.01Å; P219-P505 HydrophobicContact CB-CG 4.43Å; P219-P505 HydrophobicContact CG-CB 3.84Å; P219-P505 HydrophobicContact CG-CG 4.18Å; P219-F506 HydrophobicContact CB-CE2 3.74Å; P219-F506 HydrophobicContact CB-CZ 4.13Å; P219-F506 HydrophobicContact CG-CE2 3.72Å; P219-F506 HydrophobicContact CG-CZ 3.73Å; P219-Y513 HydrophobicContact CB-CD1 3.89Å; P219-Y513 HydrophobicContact CB-CD2 4.29Å; P219-Y513 HydrophobicContact CB-CG 3.66Å
220	A	95.4	Very high	92.5	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.9	171.9	0	0	0	0	0	109.1	L185 E198 F240	L185-A220 HydrophobicContact CD1-CB 4.38Å; L185-A220 HydrophobicContact CD2-CB 3.81Å; E198-A220 PolarHBondContact O-N 3.03Å; A220-F240 HydrophobicContact CB-CD1 3.35Å; A220-F240 HydrophobicContact CB-CE1 3.46Å; A220-F240 VanDerWaalsContact CB-CE1 3.46Å; A220-F240 HydrophobicContact CB-CG 4.34Å
221	K	93.6	Very high	92.3	Very high	73 Å²	73	68.4 Å²	68.4	32%	0.317	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	135.4	179.9	-166.9	173.4	-176.7	168.6	0	111.5	T239 Y241	K221-T239 PolarHBondContact N-O 2.87Å; K221-T239 PolarHBondContact O-N 3.37Å; K221-Y241 HydrophobicContact CB-CE2 4.22Å
222	K	93.8	Very high	92.2	Very high	51 Å²	51	66.8 Å²	66.8	22%	0.222	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	119.6	163.5	-179.1	-179.7	179.9	165	0	109.4	M183 I224	M183-K222 VanDerWaalsContact O-CD 3.28Å; M183-K222 WeakPolarHBondContact O-CD 3.45Å; M183-K222 WeakPolarHBondContact O-CE 3.35Å; M183-K222 PolarHBondContact O-NZ 3Å; K222-I224 HydrophobicContact CD-CD1 4.48Å; K222-I224 HydrophobicContact CG-CG1 4.36Å
223	N	93.2	Very high	91.9	Very high	25 Å²	25	66.2 Å²	66.2	13%	0.134	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	137.7	175.4	-66.5	-38.7	0	0	0	109.4	Q236 D237 T239 Y241	N223-Q236 WeakPolarHBondContact O-CA 3.15Å; N223-D237 WeakPolarHBondContact CB-OD1 3.33Å; N223-D237 PolarHBondContact N-O 3.32Å; N223-D237 PolarHBondContact ND2-OD2 2.85Å; N223-D237 VanDerWaalsContact ND2-OD2 3.1Å; N223-D237 PolarHBondContact O-N 3.19Å; N223-D237 VanDerWaalsContact O-N 3.11Å; N223-T239 PolarHBondContact ND2-OG1 3.39Å; N223-Y241 PolarHBondContact ND2-OH 2.76Å
224	I	92.7	Very high	91.5	Very high	93 Å²	93	71 Å²	71	48%	0.477	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	117.6	177.2	-57.4	174.6	0	0	0	108.2	K222 K226	K222-I224 HydrophobicContact CD-CD1 4.48Å; K222-I224 HydrophobicContact CG-CG1 4.36Å; I224-K226 PolarHBondContact O-N 3.03Å
225	Y	91.8	Very high	91.3	Very high	76 Å²	76	67.8 Å²	67.8	30%	0.298	32%	0.323	S	S	.	.			trans	-93.2	92.6	-178.2	-63	-66.5	0	0	0	110.8	H227 I228 K234 H235 D237	Y225-H227 AromaticContact CD1-CE1 3.68Å; Y225-H227 AromaticContact CG-CE1 3.9Å; Y225-H227 PolarHBondContact O-N 2.68Å; Y225-I228 HydrophobicContact CD2-CD1 4.28Å; Y225-I228 HydrophobicContact CG-CD1 4.21Å; Y225-I228 PolarHBondContact O-N 2.74Å; Y225-K234 VanDerWaalsContact CD2-O 3.3Å; Y225-K234 WeakPolarHBondContact CD2-O 3.27Å; Y225-H235 PolarHBondContact N-O 3.28Å; Y225-H235 PolarHBondContact O-ND1 3.06Å; Y225-D237 WeakPolarHBondContact CE2-OD1 3.08Å
226	K	89.7	Confident	91.3	Very high	201 Å²	201	66.3 Å²	66.3	87%	0.874	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.1	-179.4	-63.6	-175.8	-178.8	179.3	0	114.7	I224 I228	I224-K226 PolarHBondContact O-N 3.03Å; K226-I228 VanDerWaalsContact C-N 3.31Å
227	H	90.4	Very high	91.4	Very high	149 Å²	149	63.6 Å²	63.6	69%	0.69	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-16.6	178.7	66	-83.9	0	0	0	113.1	Y225	Y225-H227 AromaticContact CD1-CE1 3.68Å; Y225-H227 AromaticContact CG-CE1 3.9Å; Y225-H227 PolarHBondContact O-N 2.68Å
228	I	88.9	Confident	91.4	Very high	34 Å²	34	62.6 Å²	62.6	17%	0.174	30%	0.297	C	S	.	.	S	Bend	trans	-97.6	136.1	179.3	-58.5	-179.8	0	0	0	107.8	Y225 K226 K234 H235	Y225-I228 HydrophobicContact CD2-CD1 4.28Å; Y225-I228 HydrophobicContact CG-CD1 4.21Å; Y225-I228 PolarHBondContact O-N 2.74Å; K226-I228 VanDerWaalsContact C-N 3.31Å; I228-K234 HydrophobicContact CD1-CB 4.05Å; I228-K234 WeakPolarHBondContact CD1-O 3.28Å; I228-H235 HydrophobicContact CG2-CB 4.32Å; I228-H235 PolarHBondContact O-CE1 2.87Å; I228-H235 PolarHBondContact O-ND1 3.28Å
229	P	91.3	Very high	91.5	Very high	83 Å²	83	59.3 Å²	59.3	54%	0.539	29%	0.285	S	S	.	.			trans	-65.7	150.4	175.6	27.7	-34.9	0	0	0	111.6	E231 S232	P229-E231 PolarHBondContact O-N 2.97Å; P229-S232 PolarHBondContact O-N 3.3Å
230	M	86.9	Confident	91.5	Very high	109 Å²	109	59.3 Å²	59.3	54%	0.537	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-14.2	179.2	-67.9	-179.2	165.6	0	0	114.4	A178 K179 S232	A178-M230 HydrophobicContact CB-CB 4.47Å; A178-M230 PolarHBondContact N-O 3.21Å; K179-M230 HydrophobicContact CG-CB 4Å; M230-S232 VanDerWaalsContact C-N 3.27Å
231	E	87.5	Confident	91.5	Very high	126 Å²	126	61.2 Å²	61.2	59%	0.589	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-5.9	176.3	-71.6	162.3	-166.8	0	0	113	N177 K179 P229	N177-E231 PolarHBondContact ND2-O 3.44Å; N177-E231 PolarHBondContact OD1-O 3.15Å; K179-E231 HydrophobicContact CD-CG 4.17Å; K179-E231 IonicContact NZ-OE1 3.64Å; K179-E231 PolarHBondContact NZ-OE1 3.24Å; P229-E231 PolarHBondContact O-N 2.97Å
232	S	88.3	Confident	91.6	Very high	32 Å²	32	57.8 Å²	57.8	22%	0.224	28%	0.278	C	S	.	.	S	Bend	trans	-94.8	138.6	170.9	-179	0	0	0	0	110.1	P229 M230 K234 H235	P229-S232 PolarHBondContact O-N 3.3Å; M230-S232 VanDerWaalsContact C-N 3.27Å; S232-K234 PolarHBondContact O-N 3.04Å; S232-K234 PolarHBondContact OG-N 2.99Å; S232-H235 WeakPolarHBondContact O-CB 3.47Å; S232-H235 PolarHBondContact O-N 3.4Å; S232-H235 VanDerWaalsContact O-N 3.15Å
233	N	84.3	Confident	91.7	Very high	52 Å²	52	55.6 Å²	55.6	28%	0.278	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-60.2	-18.8	169.8	60.4	-8	0	0	0	113.2	L174 N177 H235	L174-N233 PolarHBondContact O-ND2 3.02Å; L174-N233 VanDerWaalsContact O-ND2 3.12Å; N177-N233 PolarHBondContact OD1-N 3.18Å; N233-H235 VanDerWaalsContact C-N 3.34Å
234	K	86.6	Confident	91.8	Very high	108 Å²	108	54.4 Å²	54.4	47%	0.47	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-85.4	1.9	176.8	-62	-170.1	176	-165.7	0	114.5	E118 Y225 I228 S232 Q236	E118-K234 IonicContact OE1-NZ 3.72Å; Y225-K234 VanDerWaalsContact CD2-O 3.3Å; Y225-K234 WeakPolarHBondContact CD2-O 3.27Å; I228-K234 HydrophobicContact CD1-CB 4.05Å; I228-K234 WeakPolarHBondContact CD1-O 3.28Å; S232-K234 PolarHBondContact O-N 3.04Å; S232-K234 PolarHBondContact OG-N 2.99Å; K234-Q236 VanDerWaalsContact C-N 3.31Å; K234-Q236 PolarHBondContact O-N 2.96Å
235	H	90.6	Very high	91.9	Very high	17 Å²	17	52.9 Å²	52.9	8%	0.079	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-66.9	-32.5	-177.5	-178	76	0	0	0	113.3	A178 Y225 I228 S232 N233	A178-H235 HydrophobicContact CB-CB 4.12Å; Y225-H235 PolarHBondContact N-O 3.28Å; Y225-H235 PolarHBondContact O-ND1 3.06Å; I228-H235 HydrophobicContact CG2-CB 4.32Å; I228-H235 PolarHBondContact O-CE1 2.87Å; I228-H235 PolarHBondContact O-ND1 3.28Å; S232-H235 WeakPolarHBondContact O-CB 3.47Å; S232-H235 PolarHBondContact O-N 3.4Å; S232-H235 VanDerWaalsContact O-N 3.15Å; N233-H235 VanDerWaalsContact C-N 3.34Å
236	Q	93.4	Very high	92.1	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.037	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	147.4	-178.8	55.1	170.2	8.1	0	0	110.2	A178 I181 M183 N223 K234	A178-Q236 HydrophobicContact CB-CG 4.05Å; I181-Q236 PolarHBondContact O-NE2 3.47Å; M183-Q236 HydrophobicContact CE-CB 4.24Å; M183-Q236 HydrophobicContact CE-CG 3.63Å; M183-Q236 WeakPolarHBondContact CE-O 3.37Å; N223-Q236 WeakPolarHBondContact O-CA 3.15Å; K234-Q236 VanDerWaalsContact C-N 3.31Å; K234-Q236 PolarHBondContact O-N 2.96Å
237	D	94.6	Very high	92.3	Very high	2 Å²	2	43 Å²	43	1%	0.011	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	156.9	173.2	63	-70.8	0	0	0	109.5	K170 F171 N223 Y225 T239	K170-D237 VanDerWaalsContact CE-CG 3.41Å; K170-D237 WeakPolarHBondContact CE-OD2 3.03Å; K170-D237 HydrophobicContact CG-CB 4.12Å; F171-D237 WeakPolarHBondContact O-CA 3.45Å; F171-D237 WeakPolarHBondContact O-CB 3.31Å; N223-D237 WeakPolarHBondContact CB-OD1 3.33Å; N223-D237 PolarHBondContact N-O 3.32Å; N223-D237 PolarHBondContact ND2-OD2 2.85Å; N223-D237 VanDerWaalsContact ND2-OD2 3.1Å; N223-D237 PolarHBondContact O-N 3.19Å; N223-D237 VanDerWaalsContact O-N 3.11Å; Y225-D237 WeakPolarHBondContact CE2-OD1 3.08Å; D237-T239 PolarHBondContact OD2-OG1 3.07Å
238	I	96.1	Very high	92.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.6	166.2	-63.6	179	0	0	0	106.6	L58 F171 M183 L184 L185 F240	L58-I238 HydrophobicContact CB-CD1 3.78Å; L58-I238 HydrophobicContact CD2-CB 4.07Å; L58-I238 HydrophobicContact CD2-CD1 4.02Å; L58-I238 HydrophobicContact CD2-CG2 4.08Å; F171-I238 PolarHBondContact N-O 3.12Å; F171-I238 PolarHBondContact O-N 2.69Å; M183-I238 HydrophobicContact CB-CD1 3.79Å; M183-I238 HydrophobicContact CB-CG1 4.11Å; L184-I238 WeakPolarHBondContact O-CD1 3.35Å; L185-I238 HydrophobicContact CD2-CD1 4.49Å; L185-I238 HydrophobicContact CD2-CG2 3.64Å; I238-F240 HydrophobicContact CG2-CD2 4.29Å; I238-F240 HydrophobicContact CG2-CE2 3.68Å; I238-F240 HydrophobicContact CG2-CZ 3.84Å
239	T	96	Very high	92.5	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.037	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.1	177.2	-62.7	0	0	0	0	109.5	T168 L169 K221 N223 D237 Y241	T168-T239 HydrophobicContact CG2-CG2 4.15Å; L169-T239 WeakPolarHBondContact O-CA 3.26Å; K221-T239 PolarHBondContact N-O 2.87Å; K221-T239 PolarHBondContact O-N 3.37Å; N223-T239 PolarHBondContact ND2-OG1 3.39Å; D237-T239 PolarHBondContact OD2-OG1 3.07Å; T239-Y241 HydrophobicContact CG2-CD1 4.38Å; T239-Y241 HydrophobicContact CG2-CD2 3.99Å; T239-Y241 HydrophobicContact CG2-CE1 3.94Å; T239-Y241 HydrophobicContact CG2-CE2 3.52Å; T239-Y241 HydrophobicContact CG2-CG 4.38Å; T239-Y241 VanDerWaalsContact CG2-CZ 3.47Å
240	F	96.6	Very high	92.5	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.6	167.3	-59.5	-90.8	0	0	0	108.7	L58 L60 T168 L169 F171 L185 I200 A220 I238	L58-F240 HydrophobicContact CD2-CE2 3.76Å; L58-F240 HydrophobicContact CD2-CZ 4.08Å; L58-F240 HydrophobicContact CG-CE2 4.48Å; L58-F240 HydrophobicContact CG-CZ 4.39Å; L60-F240 HydrophobicContact CB-CD1 3.75Å; L60-F240 HydrophobicContact CB-CD2 4.2Å; L60-F240 HydrophobicContact CB-CE1 3.51Å; L60-F240 HydrophobicContact CB-CE2 3.97Å; L60-F240 HydrophobicContact CB-CG 4.1Å; L60-F240 HydrophobicContact CB-CZ 3.63Å; L60-F240 HydrophobicContact CD2-CB 4.05Å; L60-F240 HydrophobicContact CD2-CD1 4.2Å; L60-F240 HydrophobicContact CD2-CD2 4Å; L60-F240 HydrophobicContact CD2-CG 3.82Å; T168-F240 CarbonylContact C-O 3.54Å; T168-F240 WeakPolarHBondContact CA-O 3.43Å; L169-F240 HydrophobicContact CB-CB 4.27Å; L169-F240 PolarHBondContact N-O 2.04Å; L169-F240 PolarHBondContact O-N 3.43Å; F171-F240 AromaticContact CD2-CD2 3.53Å; F171-F240 HydrophobicContact CD2-CD2 3.53Å; F171-F240 AromaticContact CD2-CE2 3.6Å; F171-F240 HydrophobicContact CD2-CE2 3.6Å; F171-F240 AromaticContact CE2-CD2 3.59Å; F171-F240 HydrophobicContact CE2-CD2 3.59Å; F171-F240 AromaticContact CE2-CE2 3.84Å; F171-F240 HydrophobicContact CE2-CE2 3.84Å; L185-F240 HydrophobicContact CD2-CE1 4.36Å; L185-F240 HydrophobicContact CD2-CZ 4.38Å; I200-F240 HydrophobicContact CD1-CB 3.9Å; I200-F240 HydrophobicContact CG1-CB 3.89Å; I200-F240 HydrophobicContact CG1-CD1 3.71Å; I200-F240 HydrophobicContact CG1-CG 4.2Å; A220-F240 HydrophobicContact CB-CD1 3.35Å; A220-F240 HydrophobicContact CB-CE1 3.46Å; A220-F240 VanDerWaalsContact CB-CE1 3.46Å; A220-F240 HydrophobicContact CB-CG 4.34Å; I238-F240 HydrophobicContact CG2-CD2 4.29Å; I238-F240 HydrophobicContact CG2-CE2 3.68Å; I238-F240 HydrophobicContact CG2-CZ 3.84Å
241	Y	95.9	Very high	92.6	Very high	39 Å²	39	38.6 Å²	38.6	15%	0.153	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	139.3	179.2	-56	-104.4	0	0	0	109.2	C167 T168 R218 P219 K221 N223 T239 F506	C167-Y241 CarbonylContact O-C 3.57Å; C167-Y241 WeakPolarHBondContact O-CA 2.93Å; T168-Y241 HydrophobicContact CG2-CD1 3.38Å; T168-Y241 HydrophobicContact CG2-CE1 3.57Å; T168-Y241 HydrophobicContact CG2-CG 4.24Å; R218-Y241 CarbonylContact C-O 3.55Å; R218-Y241 WeakPolarHBondContact CA-O 3.44Å; P219-Y241 WeakPolarHBondContact CD-O 3.38Å; P219-Y241 HydrophobicContact CG-CD2 4.33Å; P219-Y241 HydrophobicContact CG-CG 4.39Å; P219-Y241 PolarHBondContact O-N 3.01Å; K221-Y241 HydrophobicContact CB-CE2 4.22Å; N223-Y241 PolarHBondContact ND2-OH 2.76Å; T239-Y241 HydrophobicContact CG2-CD1 4.38Å; T239-Y241 HydrophobicContact CG2-CD2 3.99Å; T239-Y241 HydrophobicContact CG2-CE1 3.94Å; T239-Y241 HydrophobicContact CG2-CE2 3.52Å; T239-Y241 HydrophobicContact CG2-CG 4.38Å; T239-Y241 VanDerWaalsContact CG2-CZ 3.47Å; Y241-F506 HydrophobicContact CD1-CE1 4.26Å; Y241-F506 HydrophobicContact CD2-CE1 4.05Å; Y241-F506 AromaticContact CD2-CZ 3.62Å; Y241-F506 HydrophobicContact CD2-CZ 3.62Å; Y241-F506 HydrophobicContact CE1-CE1 4.15Å; Y241-F506 AromaticContact CE2-CE1 3.91Å; Y241-F506 HydrophobicContact CE2-CE1 3.91Å; Y241-F506 AromaticContact CE2-CZ 3.7Å; Y241-F506 HydrophobicContact CE2-CZ 3.7Å; Y241-F506 HydrophobicContact CG-CE1 4.25Å; Y241-F506 HydrophobicContact CG-CZ 4.12Å; Y241-F506 AromaticContact CZ-CE1 3.98Å
242	L	95.6	Very high	92.8	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	103.2	172.6	-79.4	171.2	0	0	0	107.9	L62 L75 T77 C167 L169 I200 I215 R218 I244	L62-L242 HydrophobicContact CD2-CD2 4.25Å; L75-L242 HydrophobicContact CD2-CD1 4.13Å; T77-L242 HydrophobicContact CG2-CD1 4.27Å; C167-L242 PolarHBondContact N-O 2.85Å; C167-L242 PolarHBondContact O-N 3.23Å; L169-L242 HydrophobicContact CD1-CD1 4.03Å; I200-L242 HydrophobicContact CD1-CD1 4.31Å; I200-L242 HydrophobicContact CD1-CD2 3.5Å; I200-L242 VanDerWaalsContact CD1-CD2 3.5Å; I200-L242 HydrophobicContact CD1-CG 3.59Å; I215-L242 HydrophobicContact CG2-CD2 4.21Å; R218-L242 HydrophobicContact CB-CD2 4.22Å; L242-I244 HydrophobicContact CB-CG2 4.4Å
243	V	95.8	Very high	93	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.03	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	107.1	171.2	-173.5	0	0	0	0	107.6	W164 Q165 I216 H217 P501	W164-V243 HydrophobicContact CE3-CG1 4.2Å; Q165-V243 WeakPolarHBondContact O-CA 3.43Å; I216-V243 PolarHBondContact N-O 2.92Å; H217-V243 HydrophobicContact CB-CB 3.85Å; H217-V243 HydrophobicContact CB-CG2 3.92Å; H217-V243 PolarHBondContact N-O 3.41Å; H217-V243 PolarHBondContact O-N 3.01Å; V243-P501 HydrophobicContact CG1-CB 4.2Å
244	I	95.5	Very high	93.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.1	-174.6	54.8	173.3	0	0	0	110.5	L65 L68 W164 Q165 W213 E214 I215 L242	L65-I244 HydrophobicContact CD1-CD1 4.4Å; L65-I244 HydrophobicContact CD1-CG2 3.88Å; L68-I244 HydrophobicContact CD2-CD1 3.95Å; W164-I244 CarbonylContact C-O 3.51Å; W164-I244 WeakPolarHBondContact CA-O 3.45Å; W164-I244 WeakPolarHBondContact CB-O 3.11Å; Q165-I244 HydrophobicContact CB-CD1 4.45Å; Q165-I244 HydrophobicContact CB-CG1 4.01Å; Q165-I244 PolarHBondContact N-O 3.04Å; Q165-I244 PolarHBondContact O-N 2.98Å; W213-I244 HydrophobicContact CD2-CD1 3.97Å; W213-I244 HydrophobicContact CE3-CB 4.11Å; W213-I244 HydrophobicContact CE3-CD1 3.78Å; W213-I244 HydrophobicContact CE3-CG1 3.89Å; W213-I244 HydrophobicContact CG-CD1 4.35Å; W213-I244 HydrophobicContact CZ3-CD1 4.24Å; W213-I244 HydrophobicContact CZ3-CG1 4.22Å; E214-I244 CarbonylContact O-C 3.58Å; E214-I244 WeakPolarHBondContact O-CA 2.9Å; I215-I244 HydrophobicContact CB-CG2 4.5Å; I215-I244 HydrophobicContact CG1-CG2 4.02Å; L242-I244 HydrophobicContact CB-CG2 4.4Å
245	K	94.8	Very high	93.2	Very high	60 Å²	60	34.4 Å²	34.4	26%	0.261	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135.4	179.3	-177.7	-176.1	175.3	-171.5	0	109.5	W164 E214 I216	W164-K245 HydrophobicContact CB-CB 4.48Å; E214-K245 PolarHBondContact N-O 2.73Å; E214-K245 PolarHBondContact O-N 3.22Å; I216-K245 HydrophobicContact CD1-CB 4.03Å; I216-K245 HydrophobicContact CD1-CD 4.27Å; I216-K245 HydrophobicContact CG1-CB 3.72Å
246	R	94.3	Very high	93.1	Very high	3 Å²	3	34.4 Å²	34.4	1%	0.011	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	142.9	177.9	-165.7	-176.7	-58.8	-91	-1	111.2	E70 P161 D163 E212 W213 P248	E70-R246 IonicContact OE1-CZ 3.85Å; E70-R246 IonicContact OE1-NH1 3.97Å; E70-R246 PolarHBondContact OE1-NH1 2.85Å; E70-R246 IonicContact OE1-NH2 3.83Å; E70-R246 PolarHBondContact OE1-NH2 2.98Å; P161-R246 WeakPolarHBondContact O-CD 3.22Å; D163-R246 PolarHBondContact O-N 2.67Å; D163-R246 VanDerWaalsContact O-N 3.08Å; D163-R246 IonicContact OD1-CZ 3.58Å; D163-R246 IonicContact OD1-NE 3.88Å; D163-R246 PolarHBondContact OD1-NE 3.02Å; D163-R246 IonicContact OD1-NH2 3.72Å; D163-R246 IonicContact OD2-CZ 2.81Å; D163-R246 IonicContact OD2-NE 2.77Å; D163-R246 PolarHBondContact OD2-NE 2.7Å; D163-R246 IonicContact OD2-NH2 3.71Å; D163-R246 PolarHBondContact OD2-NH2 3.24Å; E212-R246 HydrophobicContact CG-CG 4.21Å; E212-R246 CarbonylContact O-C 3.59Å; E212-R246 IonicContact OE1-CZ 3.78Å; E212-R246 IonicContact OE1-NH1 3.02Å; E212-R246 PolarHBondContact OE1-NH1 3.32Å; W213-R246 HydrophobicContact CE3-CB 4.1Å; W213-R246 HydrophobicContact CH2-CB 4.1Å; W213-R246 HydrophobicContact CH2-CG 4.4Å; W213-R246 VanDerWaalsContact CH2-CZ 3.4Å; W213-R246 HydrophobicContact CZ3-CB 3.74Å; W213-R246 HydrophobicContact CZ3-CG 4.41Å; R246-P248 VanDerWaalsContact O-CD 3.28Å; R246-P248 WeakPolarHBondContact O-CD 3.49Å
247	K	94.1	Very high	93	Very high	68 Å²	68	38 Å²	38	30%	0.296	19%	0.19	S	C	.	.			trans	-89	100.3	165.7	-65	174.5	179.2	171	0	108.6	E209 N210 G211 E212 L249	E209-K247 IonicContact OE2-NZ 2.73Å; N210-K247 PolarHBondContact O-NZ 3.11Å; N210-K247 VanDerWaalsContact O-NZ 3.08Å; G211-K247 WeakPolarHBondContact O-CD 3.5Å; E212-K247 WeakPolarHBondContact O-CB 3.44Å; E212-K247 PolarHBondContact O-N 2.87Å; K247-L249 VanDerWaalsContact C-N 3.26Å; K247-L249 PolarHBondContact O-N 2.94Å; K247-L249 VanDerWaalsContact O-N 3.15Å
248	P	93	Very high	92.8	Very high	28 Å²	28	39.6 Å²	39.6	18%	0.182	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	2.3	-166.1	32.3	-38.3	0	0	0	115.2	P161 F162 R246 F250 Y251 I252	P161-P248 HydrophobicContact CB-CB 4.46Å; P161-P248 HydrophobicContact CG-CB 4.46Å; F162-P248 HydrophobicContact CD1-CB 4.02Å; F162-P248 HydrophobicContact CD1-CG 3.86Å; F162-P248 HydrophobicContact CE1-CB 3.93Å; F162-P248 HydrophobicContact CE1-CG 3.76Å; R246-P248 VanDerWaalsContact O-CD 3.28Å; R246-P248 WeakPolarHBondContact O-CD 3.49Å; P248-F250 VanDerWaalsContact C-N 3.31Å; P248-F250 PolarHBondContact O-N 2.8Å; P248-Y251 PolarHBondContact O-N 3.15Å; P248-I252 HydrophobicContact CB-CD1 4.13Å; P248-I252 HydrophobicContact CB-CG1 4.39Å; P248-I252 HydrophobicContact CG-CD1 3.96Å; P248-I252 WeakPolarHBondContact O-CG1 3.46Å; P248-I252 PolarHBondContact O-N 2.77Å
249	L	91.9	Very high	92.5	Very high	124 Å²	124	39.8 Å²	39.8	65%	0.649	20%	0.202	S	C	*	.	H	α-helix	trans	-57.5	-41.1	-166.7	-170	149.6	0	0	0	113.1	K247 Y251 I252 V253	K247-L249 VanDerWaalsContact C-N 3.26Å; K247-L249 PolarHBondContact O-N 2.94Å; K247-L249 VanDerWaalsContact O-N 3.15Å; L249-Y251 VanDerWaalsContact C-N 3.34Å; L249-Y251 PolarHBondContact O-N 3.07Å; L249-I252 PolarHBondContact O-N 3.3Å; L249-V253 HydrophobicContact CD2-CG2 4.25Å; L249-V253 PolarHBondContact O-N 3.32Å; L249-V253 VanDerWaalsContact O-N 3.07Å
250	F	90.9	Very high	92.2	Very high	107 Å²	107	42.4 Å²	42.4	47%	0.469	22%	0.217	S	C	.	.	H	α-helix	trans	-58.6	-44.5	177	177.4	-95.4	0	0	0	112.3	P248 N254	P248-F250 VanDerWaalsContact C-N 3.31Å; P248-F250 PolarHBondContact O-N 2.8Å; F250-N254 VanDerWaalsContact CD2-ND2 3.29Å; F250-N254 WeakPolarHBondContact CD2-ND2 3.06Å; F250-N254 WeakPolarHBondContact CE2-ND2 3.45Å; F250-N254 WeakPolarHBondContact CZ-ND2 3.5Å; F250-N254 WeakPolarHBondContact O-CB 3.38Å; F250-N254 PolarHBondContact O-N 3.27Å; F250-N254 VanDerWaalsContact O-N 3.08Å; F250-N254 PolarHBondContact O-ND2 3.08Å
251	Y	89.6	Confident	91.9	Very high	22 Å²	22	47.3 Å²	47.3	9%	0.086	24%	0.243	C	C	.	.	H	α-helix	trans	-72.4	-34.3	179.4	-61	-83.4	0	0	0	111.8	F160 P161 E212 P248 L249 I255 I256	F160-Y251 HydrophobicContact CE1-CD1 4.15Å; F160-Y251 AromaticContact CE1-CE1 4Å; F160-Y251 HydrophobicContact CE1-CE1 4Å; F160-Y251 HydrophobicContact CE2-CE1 4.47Å; F160-Y251 HydrophobicContact CZ-CD1 4.05Å; F160-Y251 AromaticContact CZ-CE1 3.47Å; F160-Y251 HydrophobicContact CZ-CE1 3.47Å; F160-Y251 VanDerWaalsContact CZ-CE1 3.47Å; F160-Y251 HydrophobicContact CZ-CE2 4.39Å; F160-Y251 AromaticContact CZ-CZ 3.67Å; P161-Y251 HydrophobicContact CB-CD1 4.34Å; P161-Y251 HydrophobicContact CB-CD2 3.7Å; P161-Y251 HydrophobicContact CB-CE2 4.41Å; P161-Y251 HydrophobicContact CB-CG 3.66Å; P161-Y251 HydrophobicContact CG-CG 4.18Å; E212-Y251 PolarHBondContact OE1-OH 3.33Å; P248-Y251 PolarHBondContact O-N 3.15Å; L249-Y251 VanDerWaalsContact C-N 3.34Å; L249-Y251 PolarHBondContact O-N 3.07Å; Y251-I255 HydrophobicContact CD1-CD1 3.73Å; Y251-I255 HydrophobicContact CE1-CD1 4.46Å; Y251-I255 WeakPolarHBondContact O-CA 3.08Å; Y251-I255 VanDerWaalsContact O-CB 3.26Å; Y251-I255 WeakPolarHBondContact O-CB 3.29Å; Y251-I255 PolarHBondContact O-N 2.82Å; Y251-I256 PolarHBondContact O-N 2.84Å
252	I	90.9	Very high	91.6	Very high	59 Å²	59	46.6 Å²	46.6	30%	0.303	24%	0.242	S	C	.	.	I	π-helix	trans	-60.6	-51.4	175.4	-67.8	168.2	0	0	0	110.4	F162 P248 L249 I256 I257	F162-I252 HydrophobicContact CE1-CD1 4.17Å; F162-I252 HydrophobicContact CZ-CD1 4.29Å; F162-I252 HydrophobicContact CZ-CG1 4.29Å; P248-I252 HydrophobicContact CB-CD1 4.13Å; P248-I252 HydrophobicContact CB-CG1 4.39Å; P248-I252 HydrophobicContact CG-CD1 3.96Å; P248-I252 WeakPolarHBondContact O-CG1 3.46Å; P248-I252 PolarHBondContact O-N 2.77Å; L249-I252 PolarHBondContact O-N 3.3Å; I252-I256 HydrophobicContact CG1-CD1 3.93Å; I252-I256 PolarHBondContact O-N 3.42Å; I252-I257 WeakPolarHBondContact O-CG1 3.3Å; I252-I257 PolarHBondContact O-N 3.14Å
253	V	92.1	Very high	91.3	Very high	74 Å²	74	46.7 Å²	46.7	45%	0.448	24%	0.243	S	C	.	.	I	π-helix	trans	-70.5	-45.7	-175.4	175.8	0	0	0	0	112.1	L249 P258	L249-V253 HydrophobicContact CD2-CG2 4.25Å; L249-V253 PolarHBondContact O-N 3.32Å; L249-V253 VanDerWaalsContact O-N 3.07Å; V253-P258 WeakPolarHBondContact O-CD 3.16Å
254	N	88.3	Confident	91	Very high	82 Å²	82	52.4 Å²	52.4	44%	0.439	27%	0.267	S	S	.	.	I	π-helix	trans	-89.9	-19.3	-170.6	-66.5	-39.8	0	0	0	114.4	F250	F250-N254 VanDerWaalsContact CD2-ND2 3.29Å; F250-N254 WeakPolarHBondContact CD2-ND2 3.06Å; F250-N254 WeakPolarHBondContact CE2-ND2 3.45Å; F250-N254 WeakPolarHBondContact CZ-ND2 3.5Å; F250-N254 WeakPolarHBondContact O-CB 3.38Å; F250-N254 PolarHBondContact O-N 3.27Å; F250-N254 VanDerWaalsContact O-N 3.08Å; F250-N254 PolarHBondContact O-ND2 3.08Å
255	I	87.8	Confident	90.8	Very high	16 Å²	16	56.1 Å²	56.1	8%	0.082	29%	0.286	C	S	.	.	I	π-helix	trans	-121.2	-54.8	-173.9	-53.2	-172.5	0	0	0	111.4	Y251 C259 I297 I311	Y251-I255 HydrophobicContact CD1-CD1 3.73Å; Y251-I255 HydrophobicContact CE1-CD1 4.46Å; Y251-I255 WeakPolarHBondContact O-CA 3.08Å; Y251-I255 VanDerWaalsContact O-CB 3.26Å; Y251-I255 WeakPolarHBondContact O-CB 3.29Å; Y251-I255 PolarHBondContact O-N 2.82Å; I255-C259 WeakPolarHBondContact O-CB 3.39Å; I255-C259 PolarHBondContact O-N 2.97Å; I255-I297 HydrophobicContact CD1-CG1 4.18Å; I255-I297 HydrophobicContact CG2-CD1 3.41Å; I255-I297 VanDerWaalsContact CG2-CD1 3.41Å; I255-I297 HydrophobicContact CG2-CG1 4.1Å; I255-I311 HydrophobicContact CG2-CD1 4.06Å; I255-I311 HydrophobicContact CG2-CG1 4.32Å
256	I	88.9	Confident	90.5	Very high	16 Å²	16	53.3 Å²	53.3	8%	0.082	27%	0.274	C	S	.	.	I	π-helix	trans	-68.9	-49.4	-172.8	-65.2	170.1	0	0	0	111	F162 Y251 I252 C259 V260 I311 F493	F162-I256 HydrophobicContact CE2-CD1 4.12Å; F162-I256 HydrophobicContact CZ-CD1 4.15Å; Y251-I256 PolarHBondContact O-N 2.84Å; I252-I256 HydrophobicContact CG1-CD1 3.93Å; I252-I256 PolarHBondContact O-N 3.42Å; I256-C259 PolarHBondContact O-N 2.67Å; I256-V260 HydrophobicContact CG2-CG2 4.21Å; I256-V260 WeakPolarHBondContact O-CG2 3.46Å; I256-V260 PolarHBondContact O-N 3.46Å; I256-I311 HydrophobicContact CG1-CD1 4.22Å; I256-F493 HydrophobicContact CB-CE1 4.46Å; I256-F493 HydrophobicContact CB-CZ 4.36Å; I256-F493 HydrophobicContact CD1-CD1 4.26Å; I256-F493 HydrophobicContact CD1-CE1 3.57Å; I256-F493 HydrophobicContact CD1-CZ 4.3Å; I256-F493 HydrophobicContact CG1-CE1 3.82Å; I256-F493 HydrophobicContact CG1-CZ 4.07Å; I256-F493 HydrophobicContact CG2-CE1 3.82Å; I256-F493 HydrophobicContact CG2-CE2 4.05Å; I256-F493 HydrophobicContact CG2-CZ 3.49Å; I256-F493 VanDerWaalsContact CG2-CZ 3.49Å
257	I	90.5	Very high	90.3	Very high	85 Å²	85	53.5 Å²	53.5	44%	0.436	28%	0.277	S	S	.	.	H	α-helix	trans	-58.4	-52.7	-178.5	-69	175.9	0	0	0	111.8	I252 C259 V260 L261	I252-I257 WeakPolarHBondContact O-CG1 3.3Å; I252-I257 PolarHBondContact O-N 3.14Å; I257-C259 VanDerWaalsContact C-N 3.3Å; I257-C259 PolarHBondContact O-N 3.06Å; I257-V260 PolarHBondContact O-N 3.44Å; I257-L261 HydrophobicContact CG2-CD1 4.01Å; I257-L261 HydrophobicContact CG2-CG 4.48Å; I257-L261 WeakPolarHBondContact O-CG 3.22Å; I257-L261 PolarHBondContact O-N 2.86Å
258	P	90.8	Very high	90.1	Very high	34 Å²	34	53.8 Å²	53.8	22%	0.221	28%	0.281	C	S	.	.	H	α-helix	trans	-58	-39.5	177	-27.1	35.9	0	0	0	113.4	V253 L261 I262 F293	V253-P258 WeakPolarHBondContact O-CD 3.16Å; P258-L261 PolarHBondContact O-N 3.16Å; P258-I262 VanDerWaalsContact O-CG1 3.27Å; P258-I262 WeakPolarHBondContact O-CG1 3.46Å; P258-I262 PolarHBondContact O-N 3.06Å; P258-F293 HydrophobicContact CB-CE1 4.15Å; P258-F293 HydrophobicContact CB-CZ 4Å
259	C	88.4	Confident	89.9	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.034	27%	0.272	C	S	.	.	H	α-helix	trans	-68.2	-39.7	-179.6	-170.8	0	0	0	0	112.6	I255 I256 I257 L261 I262 S263 Y314 L315	I255-C259 WeakPolarHBondContact O-CB 3.39Å; I255-C259 PolarHBondContact O-N 2.97Å; I256-C259 PolarHBondContact O-N 2.67Å; I257-C259 VanDerWaalsContact C-N 3.3Å; I257-C259 PolarHBondContact O-N 3.06Å; C259-L261 VanDerWaalsContact C-N 3.34Å; C259-I262 PolarHBondContact O-N 2.76Å; C259-S263 WeakPolarHBondContact O-CB 3.09Å; C259-S263 PolarHBondContact O-N 3.49Å; C259-S263 PolarHBondContact O-OG 3.11Å; C259-Y314 HydrophobicContact CB-CE1 4.09Å; C259-Y314 WeakPolarHBondContact SG-CE1 3.26Å; C259-L315 VanDerWaalsContact SG-CD2 3.52Å
260	V	90	Very high	89.8	Confident	60 Å²	60	46.7 Å²	46.7	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-63.7	-41	174.1	171.9	0	0	0	0	110.8	I256 I257 S263 F264 F493	I256-V260 HydrophobicContact CG2-CG2 4.21Å; I256-V260 WeakPolarHBondContact O-CG2 3.46Å; I256-V260 PolarHBondContact O-N 3.46Å; I257-V260 PolarHBondContact O-N 3.44Å; V260-S263 WeakPolarHBondContact O-CB 3.45Å; V260-S263 PolarHBondContact O-N 3.46Å; V260-F264 PolarHBondContact O-N 3.38Å; V260-F493 HydrophobicContact CG2-CE2 4.4Å
261	L	91.1	Very high	89.7	Confident	105 Å²	105	48.8 Å²	48.8	55%	0.55	25%	0.247	S	C	.	.	H	α-helix	trans	-63.4	-43	176.3	-68.2	172.9	0	0	0	112.3	I257 P258 C259 S263 F264 L265	I257-L261 HydrophobicContact CG2-CD1 4.01Å; I257-L261 HydrophobicContact CG2-CG 4.48Å; I257-L261 WeakPolarHBondContact O-CG 3.22Å; I257-L261 PolarHBondContact O-N 2.86Å; P258-L261 PolarHBondContact O-N 3.16Å; C259-L261 VanDerWaalsContact C-N 3.34Å; L261-S263 VanDerWaalsContact C-N 3.32Å; L261-S263 PolarHBondContact O-N 3.18Å; L261-F264 WeakPolarHBondContact O-CB 3.48Å; L261-F264 PolarHBondContact O-N 3.48Å; L261-L265 WeakPolarHBondContact O-CG 3.31Å; L261-L265 PolarHBondContact O-N 3.42Å
262	I	90	Very high	89.7	Confident	24 Å²	24	50.1 Å²	50.1	12%	0.123	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-39.4	176.1	-68.8	166	0	0	0	111.2	P258 C259 F264 L265 A266 V286 A289 F293	P258-I262 VanDerWaalsContact O-CG1 3.27Å; P258-I262 WeakPolarHBondContact O-CG1 3.46Å; P258-I262 PolarHBondContact O-N 3.06Å; C259-I262 PolarHBondContact O-N 2.76Å; I262-F264 VanDerWaalsContact C-N 3.3Å; I262-F264 PolarHBondContact O-N 2.98Å; I262-L265 WeakPolarHBondContact O-CB 3.34Å; I262-L265 PolarHBondContact O-N 3.4Å; I262-A266 PolarHBondContact O-N 2.81Å; I262-V286 HydrophobicContact CG2-CG1 3.77Å; I262-A289 HydrophobicContact CD1-CB 4.46Å; I262-F293 HydrophobicContact CD1-CD2 3.54Å; I262-F293 HydrophobicContact CD1-CE2 3.22Å; I262-F293 HydrophobicContact CD1-CZ 4.12Å
263	S	88.2	Confident	89.5	Confident	4 Å²	4	50.8 Å²	50.8	3%	0.028	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-40.4	175.4	-55.1	0	0	0	0	111.2	C259 V260 L261 A266 S267 I318	C259-S263 WeakPolarHBondContact O-CB 3.09Å; C259-S263 PolarHBondContact O-N 3.49Å; C259-S263 PolarHBondContact O-OG 3.11Å; V260-S263 WeakPolarHBondContact O-CB 3.45Å; V260-S263 PolarHBondContact O-N 3.46Å; L261-S263 VanDerWaalsContact C-N 3.32Å; L261-S263 PolarHBondContact O-N 3.18Å; S263-A266 WeakPolarHBondContact O-CB 3.42Å; S263-A266 PolarHBondContact O-N 3.38Å; S263-S267 PolarHBondContact O-N 3.01Å; S263-I318 WeakPolarHBondContact OG-CG2 3.08Å
264	F	89.6	Confident	89.2	Confident	124 Å²	124	47.6 Å²	47.6	54%	0.544	25%	0.245	S	C	.	.	H	α-helix	trans	-63	-41.3	174	-177.8	-108.2	0	0	0	112.4	V260 L261 I262 A266 S267 L268	V260-F264 PolarHBondContact O-N 3.38Å; L261-F264 WeakPolarHBondContact O-CB 3.48Å; L261-F264 PolarHBondContact O-N 3.48Å; I262-F264 VanDerWaalsContact C-N 3.3Å; I262-F264 PolarHBondContact O-N 2.98Å; F264-A266 VanDerWaalsContact C-N 3.28Å; F264-A266 PolarHBondContact O-N 3.08Å; F264-S267 PolarHBondContact O-N 3.44Å; F264-S267 VanDerWaalsContact O-N 3.12Å; F264-L268 HydrophobicContact CD1-CD1 3.82Å; F264-L268 HydrophobicContact CD1-CG 4.32Å; F264-L268 HydrophobicContact CE1-CD1 3.46Å; F264-L268 VanDerWaalsContact CE1-CD1 3.46Å; F264-L268 HydrophobicContact CE1-CD2 4.34Å; F264-L268 HydrophobicContact CE1-CG 3.97Å; F264-L268 HydrophobicContact CZ-CD1 4.11Å; F264-L268 HydrophobicContact CZ-CD2 4.16Å; F264-L268 HydrophobicContact CZ-CG 4.16Å; F264-L268 PolarHBondContact O-N 3.06Å; F264-L268 VanDerWaalsContact O-N 3.08Å
265	L	90.7	Very high	89	Confident	78 Å²	78	49.4 Å²	49.4	41%	0.408	26%	0.255	S	S	.	.	H	α-helix	trans	-59.8	-37.5	173.6	-68.1	173.9	0	0	0	112.2	L261 I262 S267 L268 V269 V286	L261-L265 WeakPolarHBondContact O-CG 3.31Å; L261-L265 PolarHBondContact O-N 3.42Å; I262-L265 WeakPolarHBondContact O-CB 3.34Å; I262-L265 PolarHBondContact O-N 3.4Å; L265-S267 VanDerWaalsContact C-N 3.31Å; L265-S267 PolarHBondContact O-N 3.38Å; L265-L268 HydrophobicContact CD2-CD1 4.22Å; L265-L268 PolarHBondContact O-N 3.27Å; L265-V269 PolarHBondContact O-N 2.77Å; L265-V286 HydrophobicContact CB-CG2 4.17Å
266	A	88.9	Confident	88.8	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-39.1	174.9	0	0	0	0	0	112.4	I262 S263 F264 V269 V286 V322 M485	I262-A266 PolarHBondContact O-N 2.81Å; S263-A266 WeakPolarHBondContact O-CB 3.42Å; S263-A266 PolarHBondContact O-N 3.38Å; F264-A266 VanDerWaalsContact C-N 3.28Å; F264-A266 PolarHBondContact O-N 3.08Å; A266-V269 WeakPolarHBondContact O-CB 3.41Å; A266-V269 WeakPolarHBondContact O-CG2 3.26Å; A266-V269 PolarHBondContact O-N 3.29Å; A266-V286 HydrophobicContact CB-CG1 3.91Å; A266-V322 HydrophobicContact CB-CG2 3.86Å; A266-M485 HydrophobicContact CB-CE 4.27Å
267	S	90.1	Very high	88.6	Confident	8 Å²	8	53.1 Å²	53.1	6%	0.056	29%	0.291	C	S	.	.	H	α-helix	trans	-69.4	-34.8	175.9	-69.6	0	0	0	0	112.5	S263 F264 L265 V269 Y270 T482 M485	S263-S267 PolarHBondContact O-N 3.01Å; F264-S267 PolarHBondContact O-N 3.44Å; F264-S267 VanDerWaalsContact O-N 3.12Å; L265-S267 VanDerWaalsContact C-N 3.31Å; L265-S267 PolarHBondContact O-N 3.38Å; S267-V269 PolarHBondContact O-N 3.02Å; S267-Y270 PolarHBondContact O-N 3.1Å; S267-T482 PolarHBondContact OG-OG1 3.37Å; S267-M485 PolarHBondContact OG-SD 2.77Å
268	L	89.6	Confident	88.4	Confident	73 Å²	73	54.2 Å²	54.2	38%	0.382	30%	0.295	S	S	.	.	H	α-helix	trans	-66	-19.5	178.2	-74.9	174.5	0	0	0	113.7	F264 L265 Y270 Y271	F264-L268 HydrophobicContact CD1-CD1 3.82Å; F264-L268 HydrophobicContact CD1-CG 4.32Å; F264-L268 HydrophobicContact CE1-CD1 3.46Å; F264-L268 VanDerWaalsContact CE1-CD1 3.46Å; F264-L268 HydrophobicContact CE1-CD2 4.34Å; F264-L268 HydrophobicContact CE1-CG 3.97Å; F264-L268 HydrophobicContact CZ-CD1 4.11Å; F264-L268 HydrophobicContact CZ-CD2 4.16Å; F264-L268 HydrophobicContact CZ-CG 4.16Å; F264-L268 PolarHBondContact O-N 3.06Å; F264-L268 VanDerWaalsContact O-N 3.08Å; L265-L268 HydrophobicContact CD2-CD1 4.22Å; L265-L268 PolarHBondContact O-N 3.27Å; L268-Y270 PolarHBondContact O-N 3.03Å; L268-Y271 WeakPolarHBondContact O-CB 3.25Å; L268-Y271 PolarHBondContact O-N 3.32Å
269	V	90.8	Very high	88.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-55.7	-34.5	175.6	-179.1	0	0	0	0	111.7	L265 A266 S267 Y271 L272 K279 L282 C329	L265-V269 PolarHBondContact O-N 2.77Å; A266-V269 WeakPolarHBondContact O-CB 3.41Å; A266-V269 WeakPolarHBondContact O-CG2 3.26Å; A266-V269 PolarHBondContact O-N 3.29Å; S267-V269 PolarHBondContact O-N 3.02Å; V269-Y271 PolarHBondContact O-N 3.29Å; V269-L272 PolarHBondContact O-N 3.31Å; V269-K279 HydrophobicContact CG1-CD 4.5Å; V269-K279 HydrophobicContact CG1-CG 3.6Å; V269-L282 HydrophobicContact CG2-CD2 3.8Å; V269-L282 HydrophobicContact CG2-CG 3.94Å; V269-C329 WeakPolarHBondContact CG1-SG 3.43Å
270	Y	89.6	Confident	88.3	Confident	3 Å²	3	54.6 Å²	54.6	1%	0.012	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-72.6	-13.6	177.8	-66.2	-60.6	0	0	0	114.3	S267 L268 V325 N328 D474 C477 L478 I481	S267-Y270 PolarHBondContact O-N 3.1Å; L268-Y270 PolarHBondContact O-N 3.03Å; Y270-V325 HydrophobicContact CE2-CG1 4.02Å; Y270-V325 HydrophobicContact CE2-CG2 3.93Å; Y270-V325 WeakPolarHBondContact OH-CA 3.36Å; Y270-N328 HydrophobicContact CE1-CB 4.19Å; Y270-N328 WeakPolarHBondContact OH-CB 3.46Å; Y270-N328 PolarHBondContact OH-ND2 3.32Å; Y270-D474 WeakPolarHBondContact CD1-OD1 3.43Å; Y270-C477 HydrophobicContact CD1-CB 3.92Å; Y270-C477 HydrophobicContact CE1-CB 3.45Å; Y270-C477 VanDerWaalsContact CE1-CB 3.45Å; Y270-C477 HydrophobicContact CE2-CB 4.27Å; Y270-L478 HydrophobicContact CD2-CB 4.25Å; Y270-L478 HydrophobicContact CG-CB 4.21Å; Y270-I481 HydrophobicContact CE2-CB 4.18Å; Y270-I481 HydrophobicContact CE2-CG1 4.27Å; Y270-I481 HydrophobicContact CE2-CG2 4.41Å
271	Y	87.9	Confident	88.3	Confident	151 Å²	151	55.1 Å²	55.1	59%	0.592	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-85.4	-21.1	174.4	-162.7	-94.1	0	0	0	112	L268 V269 R475	L268-Y271 WeakPolarHBondContact O-CB 3.25Å; L268-Y271 PolarHBondContact O-N 3.32Å; V269-Y271 PolarHBondContact O-N 3.29Å; Y271-R475 VanDerWaalsContact CE2-NH1 3.29Å
272	L	88.8	Confident	88.3	Confident	51 Å²	51	53.1 Å²	53.1	27%	0.267	29%	0.287	S	S	.	.	S	Bend	trans	-78.6	128	-176.3	-166.3	73.6	0	0	0	110.9	V269 E278 K279	V269-L272 PolarHBondContact O-N 3.31Å; L272-E278 HydrophobicContact CD2-CB 4.12Å; L272-K279 HydrophobicContact CD2-CB 4.13Å
273	P	87.6	Confident	88.2	Confident	72 Å²	72	52.1 Å²	52.1	47%	0.468	28%	0.281	S	S	.	.			trans	-66	143.8	177.7	27.8	-34.2	0	0	0	111.3	D275 S276	P273-D275 PolarHBondContact O-N 3Å; P273-S276 PolarHBondContact O-N 2.96Å
274	A	85.3	Confident	88.3	Confident	7 Å²	7	56.2 Å²	56.2	6%	0.058	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-64.7	-24.5	179.2	0	0	0	0	0	113.1	S276 G277 L333 H336	A274-S276 PolarHBondContact O-N 3.24Å; A274-G277 PolarHBondContact O-N 3.05Å; A274-L333 HydrophobicContact CB-CD1 4.12Å; A274-H336 HydrophobicContact CB-CB 4.01Å
275	D	84.3	Confident	88.4	Confident	120 Å²	120	53.6 Å²	53.6	64%	0.642	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-61.7	-25.5	177	-63.5	-49.4	0	0	0	113.5	P273 G277 H336	P273-D275 PolarHBondContact O-N 3Å; D275-G277 VanDerWaalsContact C-N 3.25Å; D275-G277 PolarHBondContact O-N 3.06Å; D275-H336 IonicContact OD1-CE1 3.8Å; D275-H336 PolarHBondContact OD1-CE1 3.48Å; D275-H336 IonicContact OD1-NE2 3.97Å; D275-H336 PolarHBondContact OD1-NE2 2.79Å
276	S	84.9	Confident	88.5	Confident	63 Å²	63	50.1 Å²	50.1	44%	0.441	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-71.4	-18.3	-178.4	-173.7	0	0	0	0	113.3	P273 A274 E278	P273-S276 PolarHBondContact O-N 2.96Å; A274-S276 PolarHBondContact O-N 3.24Å; S276-E278 PolarHBondContact O-N 3.33Å
277	G	83.3	Confident	88.5	Confident	47 Å²	47	52.3 Å²	52.3	49%	0.485	29%	0.293	S	S	.	.	S	Bend	trans	69.6	-24.1	-174.9	0	0	0	0	0	115.6	A274 D275 K279	A274-G277 PolarHBondContact O-N 3.05Å; D275-G277 VanDerWaalsContact C-N 3.25Å; D275-G277 PolarHBondContact O-N 3.06Å; G277-K279 PolarHBondContact O-N 2.89Å
278	E	87.7	Confident	88.5	Confident	109 Å²	109	57.3 Å²	57.3	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-75.2	-6.5	-175.4	-65.1	-52.6	142.4	0	0	115.1	L272 S276 M280 T281 L282	L272-E278 HydrophobicContact CD2-CB 4.12Å; S276-E278 PolarHBondContact O-N 3.33Å; E278-M280 VanDerWaalsContact C-N 3.34Å; E278-M280 PolarHBondContact O-N 2.99Å; E278-T281 PolarHBondContact O-N 2.9Å; E278-T281 PolarHBondContact OE2-OG1 3.49Å; E278-L282 PolarHBondContact O-N 3.39Å
279	K	87.9	Confident	88.6	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.013	31%	0.313	C	S	.	.	H	α-helix	trans	-60.3	-42.4	-177.6	-170	177.7	-179.9	-178	0	112.7	V269 L272 G277 S283 D474	V269-K279 HydrophobicContact CG1-CD 4.5Å; V269-K279 HydrophobicContact CG1-CG 3.6Å; L272-K279 HydrophobicContact CD2-CB 4.13Å; G277-K279 PolarHBondContact O-N 2.89Å; K279-S283 WeakPolarHBondContact O-CB 3.34Å; K279-S283 PolarHBondContact O-N 3.22Å; K279-D474 IonicContact NZ-OD1 2.69Å; K279-D474 PolarHBondContact NZ-OD1 2.97Å; K279-D474 IonicContact NZ-OD2 3.04Å; K279-D474 PolarHBondContact NZ-OD2 2.82Å
280	M	88.2	Confident	88.4	Confident	43 Å²	43	55.6 Å²	55.6	21%	0.212	31%	0.314	C	S	.	.	H	α-helix	trans	-71.3	-41.7	178.4	-71.9	-58	-58.5	0	0	111.7	E278 S283 I284 C329 V330 L333	E278-M280 VanDerWaalsContact C-N 3.34Å; E278-M280 PolarHBondContact O-N 2.99Å; M280-S283 PolarHBondContact O-N 3.13Å; M280-I284 HydrophobicContact CE-CD1 4.32Å; M280-I284 VanDerWaalsContact O-CG1 3.31Å; M280-I284 WeakPolarHBondContact O-CG1 3.43Å; M280-I284 PolarHBondContact O-N 2.79Å; M280-C329 HydrophobicContact SD-CB 4.08Å; M280-V330 HydrophobicContact CE-CG2 3.59Å; M280-V330 HydrophobicContact SD-CG2 4.04Å; M280-L333 HydrophobicContact CG-CD2 3.77Å; M280-L333 HydrophobicContact SD-CD2 4.41Å
281	T	90.4	Very high	88.3	Confident	72 Å²	72	58 Å²	58	44%	0.442	33%	0.331	S	S	.	.	H	α-helix	trans	-56.8	-52.9	176.9	-46.3	0	0	0	0	110.5	E278 S283 I284 S285	E278-T281 PolarHBondContact O-N 2.9Å; E278-T281 PolarHBondContact OE2-OG1 3.49Å; T281-S283 VanDerWaalsContact C-N 3.35Å; T281-S283 PolarHBondContact O-N 3.09Å; T281-I284 PolarHBondContact O-N 3.13Å; T281-S285 WeakPolarHBondContact O-CB 3.17Å; T281-S285 PolarHBondContact O-N 3.41Å; T281-S285 PolarHBondContact O-OG 3.48Å; T281-S285 VanDerWaalsContact O-OG 3.06Å
282	L	90.1	Very high	88.4	Confident	63 Å²	63	54.7 Å²	54.7	33%	0.33	33%	0.326	S	S	.	.	H	α-helix	trans	-59	-45.5	179.6	-178.1	63.8	0	0	0	111.7	V269 E278 I284 S285 V286	V269-L282 HydrophobicContact CG2-CD2 3.8Å; V269-L282 HydrophobicContact CG2-CG 3.94Å; E278-L282 PolarHBondContact O-N 3.39Å; L282-I284 PolarHBondContact O-N 3.33Å; L282-S285 PolarHBondContact O-N 3.36Å; L282-V286 HydrophobicContact CD1-CG2 4.42Å; L282-V286 WeakPolarHBondContact O-CB 3.5Å; L282-V286 VanDerWaalsContact O-CG2 3.28Å; L282-V286 WeakPolarHBondContact O-CG2 3.18Å; L282-V286 PolarHBondContact O-N 2.81Å
283	S	88.6	Confident	88.2	Confident	2 Å²	2	55 Å²	55	1%	0.014	33%	0.326	C	S	.	.	H	α-helix	trans	-64.1	-40.3	-178.7	-162.2	0	0	0	0	112.8	K279 M280 T281 L287 V326	K279-S283 WeakPolarHBondContact O-CB 3.34Å; K279-S283 PolarHBondContact O-N 3.22Å; M280-S283 PolarHBondContact O-N 3.13Å; T281-S283 VanDerWaalsContact C-N 3.35Å; T281-S283 PolarHBondContact O-N 3.09Å; S283-L287 PolarHBondContact O-N 2.86Å; S283-V326 WeakPolarHBondContact OG-CG2 3.38Å
284	I	90.6	Very high	88	Confident	90 Å²	90	53.5 Å²	53.5	46%	0.462	31%	0.313	S	S	.	.	H	α-helix	trans	-72.1	-42.6	178.2	-66.8	167.3	0	0	0	110.6	M280 T281 L282 V286 L287 L288	M280-I284 HydrophobicContact CE-CD1 4.32Å; M280-I284 VanDerWaalsContact O-CG1 3.31Å; M280-I284 WeakPolarHBondContact O-CG1 3.43Å; M280-I284 PolarHBondContact O-N 2.79Å; T281-I284 PolarHBondContact O-N 3.13Å; L282-I284 PolarHBondContact O-N 3.33Å; I284-V286 VanDerWaalsContact C-N 3.28Å; I284-V286 PolarHBondContact O-N 2.92Å; I284-L287 PolarHBondContact O-N 2.93Å; I284-L288 PolarHBondContact O-N 3Å
285	S	91.9	Very high	88	Confident	69 Å²	69	58.1 Å²	58.1	48%	0.483	34%	0.337	S	S	.	.	H	α-helix	trans	-60	-38.5	176.8	-65.8	0	0	0	0	112.1	T281 L282 L288 A289	T281-S285 WeakPolarHBondContact O-CB 3.17Å; T281-S285 PolarHBondContact O-N 3.41Å; T281-S285 PolarHBondContact O-OG 3.48Å; T281-S285 VanDerWaalsContact O-OG 3.06Å; L282-S285 PolarHBondContact O-N 3.36Å; S285-L288 PolarHBondContact O-N 3.3Å; S285-A289 WeakPolarHBondContact O-CB 3.44Å; S285-A289 PolarHBondContact O-N 2.95Å
286	V	91.1	Very high	88	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.036	33%	0.328	C	S	.	.	H	α-helix	trans	-65.2	-44	175.4	167.5	0	0	0	0	111.7	I262 L265 A266 L282 I284 L288 A289 Q290 V322	I262-V286 HydrophobicContact CG2-CG1 3.77Å; L265-V286 HydrophobicContact CB-CG2 4.17Å; A266-V286 HydrophobicContact CB-CG1 3.91Å; L282-V286 HydrophobicContact CD1-CG2 4.42Å; L282-V286 WeakPolarHBondContact O-CB 3.5Å; L282-V286 VanDerWaalsContact O-CG2 3.28Å; L282-V286 WeakPolarHBondContact O-CG2 3.18Å; L282-V286 PolarHBondContact O-N 2.81Å; I284-V286 VanDerWaalsContact C-N 3.28Å; I284-V286 PolarHBondContact O-N 2.92Å; V286-L288 VanDerWaalsContact C-N 3.35Å; V286-L288 PolarHBondContact O-N 2.91Å; V286-A289 PolarHBondContact O-N 3.34Å; V286-Q290 WeakPolarHBondContact O-CB 3.45Å; V286-Q290 PolarHBondContact O-N 3.4Å; V286-V322 HydrophobicContact CG1-CG1 4.14Å; V286-V322 HydrophobicContact CG1-CG2 4.41Å
287	L	89.3	Confident	87.9	Confident	47 Å²	47	53.8 Å²	53.8	25%	0.246	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-42.4	176.1	-178	68	0	0	0	111.9	S283 I284 Q290 S291 V322	S283-L287 PolarHBondContact O-N 2.86Å; I284-L287 PolarHBondContact O-N 2.93Å; L287-Q290 PolarHBondContact O-N 3.32Å; L287-S291 PolarHBondContact O-N 3.41Å; L287-S291 PolarHBondContact O-OG 3.34Å; L287-V322 HydrophobicContact CB-CG1 3.98Å; L287-V322 HydrophobicContact CD1-CB 4.49Å; L287-V322 HydrophobicContact CD1-CG1 3.93Å
288	L	91.4	Very high	87.7	Confident	112 Å²	112	54.7 Å²	54.7	59%	0.586	31%	0.307	S	S	*	.	H	α-helix	trans	-65.9	-48.1	178.1	-171.6	152.6	0	0	0	111.2	I284 S285 V286 Q290 S291 V292	I284-L288 PolarHBondContact O-N 3Å; S285-L288 PolarHBondContact O-N 3.3Å; V286-L288 VanDerWaalsContact C-N 3.35Å; V286-L288 PolarHBondContact O-N 2.91Å; L288-Q290 VanDerWaalsContact C-N 3.25Å; L288-Q290 PolarHBondContact O-N 2.97Å; L288-S291 WeakPolarHBondContact O-CB 3.21Å; L288-S291 PolarHBondContact O-N 3.48Å; L288-S291 VanDerWaalsContact O-N 3.08Å; L288-V292 HydrophobicContact CD2-CG2 4.05Å; L288-V292 WeakPolarHBondContact O-CG2 3.41Å; L288-V292 PolarHBondContact O-N 3.06Å
289	A	90.8	Very high	87.4	Confident	33 Å²	33	56.2 Å²	56.2	27%	0.273	31%	0.314	S	S	.	.	H	α-helix	trans	-54.9	-45.8	176.4	0	0	0	0	0	110.7	I262 S285 V286 S291 V292 F293	I262-A289 HydrophobicContact CD1-CB 4.46Å; S285-A289 WeakPolarHBondContact O-CB 3.44Å; S285-A289 PolarHBondContact O-N 2.95Å; V286-A289 PolarHBondContact O-N 3.34Å; A289-S291 VanDerWaalsContact C-N 3.34Å; A289-S291 PolarHBondContact O-N 3.02Å; A289-V292 PolarHBondContact O-N 2.98Å; A289-F293 WeakPolarHBondContact O-CD2 3.04Å; A289-F293 PolarHBondContact O-N 3.46Å
290	Q	87.4	Confident	87	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.019	34%	0.339	C	S	.	.	H	α-helix	trans	-62.1	-39.1	177.3	-178.2	169.5	3.6	0	0	113.5	V286 L287 L288 V292 F293 L294 L315 I318 V322	V286-Q290 WeakPolarHBondContact O-CB 3.45Å; V286-Q290 PolarHBondContact O-N 3.4Å; L287-Q290 PolarHBondContact O-N 3.32Å; L288-Q290 VanDerWaalsContact C-N 3.25Å; L288-Q290 PolarHBondContact O-N 2.97Å; Q290-V292 VanDerWaalsContact C-N 3.33Å; Q290-F293 PolarHBondContact O-N 3.24Å; Q290-L294 PolarHBondContact O-N 3.23Å; Q290-L315 PolarHBondContact NE2-O 3.43Å; Q290-I318 VanDerWaalsContact NE2-CB 3.27Å; Q290-V322 VanDerWaalsContact OE1-CG2 3.31Å
291	S	87.4	Confident	86.5	Confident	53 Å²	53	61.5 Å²	61.5	37%	0.371	33%	0.333	S	S	.	.	H	α-helix	trans	-64.9	-38.3	177.6	-57.6	0	0	0	0	111.5	L287 L288 A289 L294 L295	L287-S291 PolarHBondContact O-N 3.41Å; L287-S291 PolarHBondContact O-OG 3.34Å; L288-S291 WeakPolarHBondContact O-CB 3.21Å; L288-S291 PolarHBondContact O-N 3.48Å; L288-S291 VanDerWaalsContact O-N 3.08Å; A289-S291 VanDerWaalsContact C-N 3.34Å; A289-S291 PolarHBondContact O-N 3.02Å; S291-L294 PolarHBondContact O-N 3.47Å; S291-L295 PolarHBondContact O-N 3.38Å; S291-L295 VanDerWaalsContact O-N 3.13Å
292	V	90.1	Very high	85.9	Confident	82 Å²	82	58.8 Å²	58.8	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-64.8	-42.5	173.4	174.5	0	0	0	0	111.4	L288 A289 Q290 L294 L295 L296	L288-V292 HydrophobicContact CD2-CG2 4.05Å; L288-V292 WeakPolarHBondContact O-CG2 3.41Å; L288-V292 PolarHBondContact O-N 3.06Å; A289-V292 PolarHBondContact O-N 2.98Å; Q290-V292 VanDerWaalsContact C-N 3.33Å; V292-L294 VanDerWaalsContact C-N 3.34Å; V292-L294 PolarHBondContact O-N 2.98Å; V292-L295 PolarHBondContact O-N 3.49Å; V292-L296 PolarHBondContact O-N 3.34Å
293	F	84.5	Confident	85.2	Confident	58 Å²	58	65.4 Å²	65.4	25%	0.254	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-40	175.5	-85.6	-73.9	0	0	0	112.5	P258 I262 A289 Q290 L295 L296 I297	P258-F293 HydrophobicContact CB-CE1 4.15Å; P258-F293 HydrophobicContact CB-CZ 4Å; I262-F293 HydrophobicContact CD1-CD2 3.54Å; I262-F293 HydrophobicContact CD1-CE2 3.22Å; I262-F293 HydrophobicContact CD1-CZ 4.12Å; A289-F293 WeakPolarHBondContact O-CD2 3.04Å; A289-F293 PolarHBondContact O-N 3.46Å; Q290-F293 PolarHBondContact O-N 3.24Å; F293-L295 VanDerWaalsContact C-N 3.34Å; F293-L295 PolarHBondContact O-N 2.96Å; F293-L296 PolarHBondContact O-N 3.31Å; F293-I297 VanDerWaalsContact O-CD1 3.29Å; F293-I297 WeakPolarHBondContact O-CD1 3.42Å; F293-I297 VanDerWaalsContact O-CG1 3.3Å; F293-I297 WeakPolarHBondContact O-CG1 3.32Å; F293-I297 PolarHBondContact O-N 2.96Å
294	L	83.7	Confident	84.6	Confident	40 Å²	40	67.4 Å²	67.4	21%	0.209	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-43.8	175.3	-178.1	66.5	0	0	0	111.6	Q290 S291 V292 L296 I297 S298 L315 M316 M319	Q290-L294 PolarHBondContact O-N 3.23Å; S291-L294 PolarHBondContact O-N 3.47Å; V292-L294 VanDerWaalsContact C-N 3.34Å; V292-L294 PolarHBondContact O-N 2.98Å; L294-L296 PolarHBondContact O-N 3.18Å; L294-I297 PolarHBondContact O-N 3.3Å; L294-S298 PolarHBondContact O-N 3.24Å; L294-L315 HydrophobicContact CD1-CB 3.99Å; L294-L315 HydrophobicContact CD1-CD1 3.87Å; L294-M316 HydrophobicContact CD2-SD 4.41Å; L294-M319 HydrophobicContact CB-CE 4.41Å; L294-M319 HydrophobicContact CD2-CE 3.44Å; L294-M319 VanDerWaalsContact CD2-CE 3.44Å
295	L	85.2	Confident	84	Confident	105 Å²	105	69.3 Å²	69.3	55%	0.55	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-40.5	177.8	-178.6	66.5	0	0	0	112.4	S291 V292 F293 I297 S298	S291-L295 PolarHBondContact O-N 3.38Å; S291-L295 VanDerWaalsContact O-N 3.13Å; V292-L295 PolarHBondContact O-N 3.49Å; F293-L295 VanDerWaalsContact C-N 3.34Å; F293-L295 PolarHBondContact O-N 2.96Å; L295-I297 PolarHBondContact O-N 2.97Å; L295-S298 PolarHBondContact O-OG 3.06Å
296	L	84.5	Confident	83.4	Confident	87 Å²	87	74.6 Å²	74.6	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-63.4	-33	177.6	-175.3	142.6	0	0	0	111.9	V292 F293 L294	V292-L296 PolarHBondContact O-N 3.34Å; F293-L296 PolarHBondContact O-N 3.31Å; L294-L296 PolarHBondContact O-N 3.18Å
297	I	82.2	Confident	83	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.021	40%	0.404	C	S	.	.	H	α-helix	trans	-82.1	-36.6	-177.2	-68.5	161.9	0	0	0	111.6	I255 F293 L294 L295 Q299 R300 L301 I311 L315	I255-I297 HydrophobicContact CD1-CG1 4.18Å; I255-I297 HydrophobicContact CG2-CD1 3.41Å; I255-I297 VanDerWaalsContact CG2-CD1 3.41Å; I255-I297 HydrophobicContact CG2-CG1 4.1Å; F293-I297 VanDerWaalsContact O-CD1 3.29Å; F293-I297 WeakPolarHBondContact O-CD1 3.42Å; F293-I297 VanDerWaalsContact O-CG1 3.3Å; F293-I297 WeakPolarHBondContact O-CG1 3.32Å; F293-I297 PolarHBondContact O-N 2.96Å; L294-I297 PolarHBondContact O-N 3.3Å; L295-I297 PolarHBondContact O-N 2.97Å; I297-Q299 PolarHBondContact O-N 3.36Å; I297-R300 PolarHBondContact O-N 3.45Å; I297-L301 HydrophobicContact CG2-CD1 3.68Å; I297-L301 PolarHBondContact O-N 3.09Å; I297-I311 HydrophobicContact CG2-CG2 4.24Å; I297-L315 HydrophobicContact CB-CD1 4.37Å; I297-L315 HydrophobicContact CD1-CD1 3.34Å; I297-L315 HydrophobicContact CD1-CD2 4.39Å; I297-L315 HydrophobicContact CD1-CG 4.43Å; I297-L315 HydrophobicContact CG1-CD1 4.44Å; I297-L315 HydrophobicContact CG2-CD1 4.26Å
298	S	79.3	Confident	82.9	Confident	67 Å²	67	76.7 Å²	76.7	47%	0.469	41%	0.414	S	S	.	.	H	α-helix	trans	-61.4	-25.1	176.2	67.7	0	0	0	0	112.6	L294 L295 R300	L294-S298 PolarHBondContact O-N 3.24Å; L295-S298 PolarHBondContact O-OG 3.06Å; S298-R300 VanDerWaalsContact C-N 3.31Å
299	Q	81.3	Confident	82.8	Confident	140 Å²	140	72.1 Å²	72.1	65%	0.654	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-14.1	175.1	-67.1	177.7	-6.4	0	0	114.2	I297	I297-Q299 PolarHBondContact O-N 3.36Å
300	R	78.4	Confident	82.8	Confident	140 Å²	140	70.9 Å²	70.9	53%	0.528	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-13.8	-177.7	-61.5	-59.7	-172.5	112.6	-0.5	113.5	I297 S298	I297-R300 PolarHBondContact O-N 3.45Å; S298-R300 VanDerWaalsContact C-N 3.31Å
301	L	78.8	Confident	82.8	Confident	17 Å²	17	71 Å²	71	9%	0.089	38%	0.38	C	S	.	.	S	Bend	trans	-102	144.3	-177.5	-68	158.9	0	0	0	109.2	F160 I297 P309 I311 V312	F160-L301 HydrophobicContact CD1-CD2 3.62Å; F160-L301 HydrophobicContact CD2-CD2 4.24Å; F160-L301 HydrophobicContact CE1-CD2 3.72Å; F160-L301 HydrophobicContact CE2-CD2 4.31Å; F160-L301 HydrophobicContact CG-CD2 3.89Å; F160-L301 HydrophobicContact CZ-CD2 4.05Å; I297-L301 HydrophobicContact CG2-CD1 3.68Å; I297-L301 PolarHBondContact O-N 3.09Å; L301-P309 HydrophobicContact CD1-CG 4.12Å; L301-P309 HydrophobicContact CD2-CB 4.35Å; L301-P309 HydrophobicContact CD2-CG 4.07Å; L301-I311 HydrophobicContact CD1-CG2 4.29Å; L301-V312 HydrophobicContact CD1-CG2 3.5Å; L301-V312 VanDerWaalsContact CD1-CG2 3.5Å
302	P	76.9	Confident	82.8	Confident	15 Å²	15	69.9 Å²	69.9	10%	0.097	37%	0.371	C	S	.	.			trans	-64.7	148.3	171.1	27.3	-33.4	0	0	0	110.8	E70 V157 T304	E70-P302 HydrophobicContact CB-CG 4.39Å; E70-P302 WeakPolarHBondContact O-CB 3.05Å; V157-P302 HydrophobicContact CG1-CG 3.94Å; P302-T304 HydrophobicContact CB-CG2 4.09Å; P302-T304 HydrophobicContact CG-CG2 4.33Å; P302-T304 PolarHBondContact O-N 3.43Å
303	E	75	Confident	82.8	Confident	202 Å²	202	70.3 Å²	70.3	94%	0.944	37%	0.367	S	S	*	.			trans	-75.1	50.6	177.5	-60.6	-175.2	171.1	0	0	112.2
304	T	77	Confident	83	Confident	45 Å²	45	67.6 Å²	67.6	28%	0.276	35%	0.354	S	S	.	.			trans	-91.9	135.8	-179.4	56.9	0	0	0	0	111.5	P302	P302-T304 HydrophobicContact CB-CG2 4.09Å; P302-T304 HydrophobicContact CG-CG2 4.33Å; P302-T304 PolarHBondContact O-N 3.43Å
305	S	78.6	Confident	83.2	Confident	129 Å²	129	65.7 Å²	65.7	90%	0.902	35%	0.345	S	S	*	.			trans	-99.9	3.3	179	-63.4	0	0	0	0	113.9	S307	S305-S307 VanDerWaalsContact C-N 3.32Å; S305-S307 PolarHBondContact O-N 3.48Å
306	M	79.4	Confident	83.4	Confident	181 Å²	181	64.9 Å²	64.9	89%	0.892	34%	0.339	S	S	*	.	S	Bend	trans	-67.6	-33.7	-177.5	-68	-62.9	-72.5	0	0	112.3
307	S	82.2	Confident	83.7	Confident	22 Å²	22	63.6 Å²	63.6	15%	0.154	33%	0.33	C	S	.	.			trans	-161.2	151.5	176.7	62.1	0	0	0	0	111.9	V157 N158 S305	V157-S307 WeakPolarHBondContact CG2-O 3.38Å; V157-S307 WeakPolarHBondContact CG2-OG 3.48Å; N158-S307 PolarHBondContact ND2-OG 2.95Å; N158-S307 WeakPolarHBondContact OD1-CB 3.24Å; N158-S307 PolarHBondContact OD1-OG 3.31Å; S305-S307 VanDerWaalsContact C-N 3.32Å; S305-S307 PolarHBondContact O-N 3.48Å
308	V	86.2	Confident	84	Confident	75 Å²	75	63.5 Å²	63.5	46%	0.455	33%	0.329	S	S	.	.			trans	-86.5	128.8	175.8	-175.2	0	0	0	0	110	V312 K313	V308-V312 HydrophobicContact CG1-CB 3.95Å; V308-V312 HydrophobicContact CG1-CG1 3.81Å; V308-K313 HydrophobicContact CB-CG 4.22Å; V308-K313 HydrophobicContact CG1-CG 3.84Å; V308-K313 WeakPolarHBondContact O-CE 3.42Å; V308-K313 PolarHBondContact O-NZ 3.26Å
309	P	90.4	Very high	84.5	Confident	16 Å²	16	62.2 Å²	62.2	10%	0.104	32%	0.317	C	S	.	.			trans	-62.3	149.3	178.6	-20.6	30.1	0	0	0	113.9	V157 F160 L301 I311 V312 K313	V157-P309 HydrophobicContact CB-CG 4.01Å; V157-P309 HydrophobicContact CG2-CG 3.99Å; V157-P309 VanDerWaalsContact O-CA 3.24Å; V157-P309 WeakPolarHBondContact O-CA 3.43Å; V157-P309 WeakPolarHBondContact O-CB 3.49Å; F160-P309 HydrophobicContact CB-CB 4.31Å; L301-P309 HydrophobicContact CD1-CG 4.12Å; L301-P309 HydrophobicContact CD2-CB 4.35Å; L301-P309 HydrophobicContact CD2-CG 4.07Å; P309-I311 VanDerWaalsContact C-N 3.31Å; P309-I311 HydrophobicContact CB-CG2 4.18Å; P309-I311 PolarHBondContact O-N 3.45Å; P309-V312 HydrophobicContact CB-CB 4.35Å; P309-V312 HydrophobicContact CB-CG2 4.03Å; P309-V312 HydrophobicContact CG-CB 4.48Å; P309-V312 HydrophobicContact CG-CG2 3.96Å; P309-V312 PolarHBondContact O-N 2.87Å; P309-K313 WeakPolarHBondContact O-CG 3.48Å; P309-K313 PolarHBondContact O-N 3.35Å
310	L	89.5	Confident	85	Confident	6 Å²	6	59.6 Å²	59.6	3%	0.031	31%	0.31	C	S	.	.	H	α-helix	trans	-56.6	-43.7	178.7	-169.9	74.4	0	0	0	112.1	N158 F162 V312 K313 Y314 I492 M495	N158-L310 WeakPolarHBondContact O-CB 3.24Å; N158-L310 PolarHBondContact O-N 3.39Å; F162-L310 HydrophobicContact CD2-CD2 4.31Å; L310-V312 VanDerWaalsContact C-N 3.31Å; L310-V312 PolarHBondContact O-N 2.95Å; L310-K313 PolarHBondContact O-N 3.36Å; L310-Y314 WeakPolarHBondContact O-CB 3.37Å; L310-Y314 PolarHBondContact O-N 3.27Å; L310-I492 HydrophobicContact CD1-CG2 3.73Å; L310-I492 HydrophobicContact CD2-CG2 4.45Å; L310-I492 HydrophobicContact CG-CG2 3.83Å; L310-M495 HydrophobicContact CD1-SD 4.47Å
311	I	88.2	Confident	85.6	Confident	6 Å²	6	53.5 Å²	53.5	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-38.2	176.6	-168.8	63.7	0	0	0	112.3	F160 I255 I256 I297 L301 P309 Y314 L315	F160-I311 HydrophobicContact CD1-CG2 3.81Å; F160-I311 HydrophobicContact CE1-CG2 4.3Å; F160-I311 PolarHBondContact O-N 2.83Å; I255-I311 HydrophobicContact CG2-CD1 4.06Å; I255-I311 HydrophobicContact CG2-CG1 4.32Å; I256-I311 HydrophobicContact CG1-CD1 4.22Å; I297-I311 HydrophobicContact CG2-CG2 4.24Å; L301-I311 HydrophobicContact CD1-CG2 4.29Å; P309-I311 VanDerWaalsContact C-N 3.31Å; P309-I311 HydrophobicContact CB-CG2 4.18Å; P309-I311 PolarHBondContact O-N 3.45Å; I311-Y314 HydrophobicContact CD1-CD1 4.32Å; I311-Y314 WeakPolarHBondContact O-CB 3.49Å; I311-Y314 PolarHBondContact O-N 2.74Å; I311-L315 HydrophobicContact CG1-CD1 4.25Å; I311-L315 WeakPolarHBondContact O-CD1 3.38Å; I311-L315 VanDerWaalsContact O-CG 3.26Å; I311-L315 WeakPolarHBondContact O-CG 3.46Å; I311-L315 PolarHBondContact O-N 3.42Å
312	V	88.1	Confident	86.2	Confident	30 Å²	30	52.8 Å²	52.8	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-71.7	-42.3	178.5	178.5	0	0	0	0	110.2	L301 V308 P309 L310 Y314 L315 M316	L301-V312 HydrophobicContact CD1-CG2 3.5Å; L301-V312 VanDerWaalsContact CD1-CG2 3.5Å; V308-V312 HydrophobicContact CG1-CB 3.95Å; V308-V312 HydrophobicContact CG1-CG1 3.81Å; P309-V312 HydrophobicContact CB-CB 4.35Å; P309-V312 HydrophobicContact CB-CG2 4.03Å; P309-V312 HydrophobicContact CG-CB 4.48Å; P309-V312 HydrophobicContact CG-CG2 3.96Å; P309-V312 PolarHBondContact O-N 2.87Å; L310-V312 VanDerWaalsContact C-N 3.31Å; L310-V312 PolarHBondContact O-N 2.95Å; V312-Y314 VanDerWaalsContact C-N 3.26Å; V312-Y314 PolarHBondContact O-N 3.2Å; V312-L315 PolarHBondContact O-N 3.46Å; V312-M316 HydrophobicContact CG1-CG 4.24Å; V312-M316 WeakPolarHBondContact O-CB 3.44Å; V312-M316 VanDerWaalsContact O-CG 3.26Å; V312-M316 WeakPolarHBondContact O-CG 3.39Å; V312-M316 PolarHBondContact O-N 2.87Å
313	K	89.1	Confident	86.9	Confident	92 Å²	92	54.9 Å²	54.9	40%	0.4	30%	0.296	S	S	.	.	H	α-helix	trans	-55.9	-43.3	172.5	-70	173.5	-176.9	154.1	0	111.2	V308 P309 L310 F317	V308-K313 HydrophobicContact CB-CG 4.22Å; V308-K313 HydrophobicContact CG1-CG 3.84Å; V308-K313 WeakPolarHBondContact O-CE 3.42Å; V308-K313 PolarHBondContact O-NZ 3.26Å; P309-K313 WeakPolarHBondContact O-CG 3.48Å; P309-K313 PolarHBondContact O-N 3.35Å; L310-K313 PolarHBondContact O-N 3.36Å; K313-F317 VanDerWaalsContact O-CB 3.32Å; K313-F317 WeakPolarHBondContact O-CB 3.33Å; K313-F317 PolarHBondContact O-N 3.12Å
314	Y	89.5	Confident	87.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-50.1	176	174.6	-115	0	0	0	112.6	C259 L310 I311 V312 M316 F317 I318 T489 I492 F493	C259-Y314 HydrophobicContact CB-CE1 4.09Å; C259-Y314 WeakPolarHBondContact SG-CE1 3.26Å; L310-Y314 WeakPolarHBondContact O-CB 3.37Å; L310-Y314 PolarHBondContact O-N 3.27Å; I311-Y314 HydrophobicContact CD1-CD1 4.32Å; I311-Y314 WeakPolarHBondContact O-CB 3.49Å; I311-Y314 PolarHBondContact O-N 2.74Å; V312-Y314 VanDerWaalsContact C-N 3.26Å; V312-Y314 PolarHBondContact O-N 3.2Å; Y314-M316 VanDerWaalsContact C-N 3.34Å; Y314-M316 PolarHBondContact O-N 2.94Å; Y314-F317 WeakPolarHBondContact O-CB 3.27Å; Y314-F317 PolarHBondContact O-N 2.83Å; Y314-I318 HydrophobicContact CD2-CG1 4.14Å; Y314-I318 HydrophobicContact CE1-CG1 4.33Å; Y314-I318 HydrophobicContact CE2-CD1 3.83Å; Y314-I318 HydrophobicContact CE2-CG1 3.59Å; Y314-I318 WeakPolarHBondContact O-CG1 3.29Å; Y314-I318 PolarHBondContact O-N 3.37Å; Y314-T489 HydrophobicContact CE2-CG2 3.55Å; Y314-I492 HydrophobicContact CD2-CD1 4.15Å; Y314-F493 HydrophobicContact CD1-CZ 4.02Å; Y314-F493 HydrophobicContact CD2-CE2 4.32Å; Y314-F493 HydrophobicContact CD2-CZ 4.4Å; Y314-F493 HydrophobicContact CE1-CE2 4.3Å; Y314-F493 AromaticContact CE1-CZ 3.96Å; Y314-F493 HydrophobicContact CE1-CZ 3.96Å; Y314-F493 HydrophobicContact CE2-CE2 4.04Å; Y314-F493 HydrophobicContact CE2-CZ 4.37Å; Y314-F493 HydrophobicContact CG-CZ 4.23Å
315	L	88	Confident	88.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-39.1	-179.8	-68.4	163.3	0	0	0	112.4	C259 Q290 L294 I297 I311 V312 I318 M319	C259-L315 VanDerWaalsContact SG-CD2 3.52Å; Q290-L315 PolarHBondContact NE2-O 3.43Å; L294-L315 HydrophobicContact CD1-CB 3.99Å; L294-L315 HydrophobicContact CD1-CD1 3.87Å; I297-L315 HydrophobicContact CB-CD1 4.37Å; I297-L315 HydrophobicContact CD1-CD1 3.34Å; I297-L315 HydrophobicContact CD1-CD2 4.39Å; I297-L315 HydrophobicContact CD1-CG 4.43Å; I297-L315 HydrophobicContact CG1-CD1 4.44Å; I297-L315 HydrophobicContact CG2-CD1 4.26Å; I311-L315 HydrophobicContact CG1-CD1 4.25Å; I311-L315 WeakPolarHBondContact O-CD1 3.38Å; I311-L315 VanDerWaalsContact O-CG 3.26Å; I311-L315 WeakPolarHBondContact O-CG 3.46Å; I311-L315 PolarHBondContact O-N 3.42Å; V312-L315 PolarHBondContact O-N 3.46Å; L315-I318 PolarHBondContact O-N 3.04Å; L315-M319 VanDerWaalsContact O-CB 3.25Å; L315-M319 WeakPolarHBondContact O-CB 3.41Å; L315-M319 PolarHBondContact O-N 2.9Å
316	M	88.6	Confident	89	Confident	88 Å²	88	41.3 Å²	41.3	43%	0.433	22%	0.219	S	C	.	.	H	α-helix	trans	-64	-43.1	174.4	-71.4	-61.8	-64.9	0	0	111.2	L294 V312 Y314 M319 V320	L294-M316 HydrophobicContact CD2-SD 4.41Å; V312-M316 HydrophobicContact CG1-CG 4.24Å; V312-M316 WeakPolarHBondContact O-CB 3.44Å; V312-M316 VanDerWaalsContact O-CG 3.26Å; V312-M316 WeakPolarHBondContact O-CG 3.39Å; V312-M316 PolarHBondContact O-N 2.87Å; Y314-M316 VanDerWaalsContact C-N 3.34Å; Y314-M316 PolarHBondContact O-N 2.94Å; M316-M319 PolarHBondContact O-N 3.04Å; M316-V320 WeakPolarHBondContact O-CG2 3.48Å; M316-V320 PolarHBondContact O-N 3.25Å
317	F	90.6	Very high	89.6	Confident	60 Å²	60	37.8 Å²	37.8	26%	0.263	20%	0.203	S	C	.	.	H	α-helix	trans	-58.4	-50	174.7	168.1	-105.9	0	0	0	111.9	K313 Y314 M319 V320 L321 V484 I492	K313-F317 VanDerWaalsContact O-CB 3.32Å; K313-F317 WeakPolarHBondContact O-CB 3.33Å; K313-F317 PolarHBondContact O-N 3.12Å; Y314-F317 WeakPolarHBondContact O-CB 3.27Å; Y314-F317 PolarHBondContact O-N 2.83Å; F317-M319 VanDerWaalsContact C-N 3.28Å; F317-M319 PolarHBondContact O-N 3.22Å; F317-V320 PolarHBondContact O-N 3.08Å; F317-L321 HydrophobicContact CD1-CD1 4.14Å; F317-L321 HydrophobicContact CD2-CD1 4.41Å; F317-L321 HydrophobicContact CE1-CD1 3.5Å; F317-L321 HydrophobicContact CE2-CD1 3.81Å; F317-L321 HydrophobicContact CE2-CG 4.21Å; F317-L321 HydrophobicContact CZ-CD1 3.33Å; F317-L321 HydrophobicContact CZ-CG 4.22Å; F317-L321 WeakPolarHBondContact O-CG 3.17Å; F317-L321 PolarHBondContact O-N 3Å; F317-V484 HydrophobicContact CZ-CG1 4.32Å; F317-I492 HydrophobicContact CB-CD1 4.46Å; F317-I492 HydrophobicContact CD1-CD1 4.17Å; F317-I492 HydrophobicContact CG-CD1 4.37Å
318	I	89.9	Confident	90	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-63.8	-37	176.9	-61	-62.6	0	0	0	110.4	S263 Q290 Y314 L315 V320 L321 V322 M485 T489	S263-I318 WeakPolarHBondContact OG-CG2 3.08Å; Q290-I318 VanDerWaalsContact NE2-CB 3.27Å; Y314-I318 HydrophobicContact CD2-CG1 4.14Å; Y314-I318 HydrophobicContact CE1-CG1 4.33Å; Y314-I318 HydrophobicContact CE2-CD1 3.83Å; Y314-I318 HydrophobicContact CE2-CG1 3.59Å; Y314-I318 WeakPolarHBondContact O-CG1 3.29Å; Y314-I318 PolarHBondContact O-N 3.37Å; L315-I318 PolarHBondContact O-N 3.04Å; I318-V320 PolarHBondContact O-N 3.45Å; I318-L321 HydrophobicContact CD1-CD1 4.5Å; I318-L321 PolarHBondContact O-N 3.39Å; I318-V322 HydrophobicContact CG2-CG2 3.97Å; I318-V322 WeakPolarHBondContact O-CB 3.12Å; I318-V322 WeakPolarHBondContact O-CG2 3.05Å; I318-V322 PolarHBondContact O-N 3.49Å; I318-M485 HydrophobicContact CD1-CG 4.02Å; I318-T489 HydrophobicContact CD1-CG2 4.21Å
319	M	89.9	Confident	90.2	Very high	41 Å²	41	35.2 Å²	35.2	20%	0.202	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-42.8	-176.2	179.5	-175	-76.7	0	0	110.9	L294 L315 M316 F317 V322 T323	L294-M319 HydrophobicContact CB-CE 4.41Å; L294-M319 HydrophobicContact CD2-CE 3.44Å; L294-M319 VanDerWaalsContact CD2-CE 3.44Å; L315-M319 VanDerWaalsContact O-CB 3.25Å; L315-M319 WeakPolarHBondContact O-CB 3.41Å; L315-M319 PolarHBondContact O-N 2.9Å; M316-M319 PolarHBondContact O-N 3.04Å; F317-M319 VanDerWaalsContact C-N 3.28Å; F317-M319 PolarHBondContact O-N 3.22Å; M319-V322 PolarHBondContact O-N 3.28Å; M319-T323 WeakPolarHBondContact O-CB 3.3Å; M319-T323 PolarHBondContact O-N 3.39Å; M319-T323 PolarHBondContact O-OG1 3.2Å
320	V	91.8	Very high	90.2	Very high	85 Å²	85	38 Å²	38	52%	0.515	20%	0.201	S	C	.	.	H	α-helix	trans	-62	-45.2	173.2	172.8	0	0	0	0	110.3	M316 F317 I318 T323 I324	M316-V320 WeakPolarHBondContact O-CG2 3.48Å; M316-V320 PolarHBondContact O-N 3.25Å; F317-V320 PolarHBondContact O-N 3.08Å; I318-V320 PolarHBondContact O-N 3.45Å; V320-T323 WeakPolarHBondContact O-CB 3.23Å; V320-T323 PolarHBondContact O-N 2.99Å; V320-I324 HydrophobicContact CG1-CD1 4.09Å; V320-I324 WeakPolarHBondContact O-CG1 3.32Å; V320-I324 PolarHBondContact O-N 3.35Å
321	L	90.8	Very high	90.3	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-47	177.1	-76.8	179.4	0	0	0	112.8	F317 I318 T323 I324 V325 V484 M485	F317-L321 HydrophobicContact CD1-CD1 4.14Å; F317-L321 HydrophobicContact CD2-CD1 4.41Å; F317-L321 HydrophobicContact CE1-CD1 3.5Å; F317-L321 HydrophobicContact CE2-CD1 3.81Å; F317-L321 HydrophobicContact CE2-CG 4.21Å; F317-L321 HydrophobicContact CZ-CD1 3.33Å; F317-L321 HydrophobicContact CZ-CG 4.22Å; F317-L321 WeakPolarHBondContact O-CG 3.17Å; F317-L321 PolarHBondContact O-N 3Å; I318-L321 HydrophobicContact CD1-CD1 4.5Å; I318-L321 PolarHBondContact O-N 3.39Å; L321-T323 VanDerWaalsContact C-N 3.27Å; L321-T323 PolarHBondContact O-N 3.46Å; L321-I324 WeakPolarHBondContact O-CB 3.41Å; L321-I324 PolarHBondContact O-N 3.36Å; L321-I324 VanDerWaalsContact O-N 3.14Å; L321-V325 WeakPolarHBondContact O-CG2 3.47Å; L321-V325 PolarHBondContact O-N 3.22Å; L321-V484 HydrophobicContact CD1-CG1 4.43Å; L321-V484 HydrophobicContact CD2-CG1 4.03Å; L321-M485 HydrophobicContact CD1-CB 4.18Å; L321-M485 HydrophobicContact CD1-CG 4.31Å
322	V	90.7	Very high	90.5	Very high	1 Å²	1	41 Å²	41	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-36.3	178.5	172.3	0	0	0	0	110.9	A266 V286 L287 Q290 I318 M319 I324 V325 V326	A266-V322 HydrophobicContact CB-CG2 3.86Å; V286-V322 HydrophobicContact CG1-CG1 4.14Å; V286-V322 HydrophobicContact CG1-CG2 4.41Å; L287-V322 HydrophobicContact CB-CG1 3.98Å; L287-V322 HydrophobicContact CD1-CB 4.49Å; L287-V322 HydrophobicContact CD1-CG1 3.93Å; Q290-V322 VanDerWaalsContact OE1-CG2 3.31Å; I318-V322 HydrophobicContact CG2-CG2 3.97Å; I318-V322 WeakPolarHBondContact O-CB 3.12Å; I318-V322 WeakPolarHBondContact O-CG2 3.05Å; I318-V322 PolarHBondContact O-N 3.49Å; M319-V322 PolarHBondContact O-N 3.28Å; V322-I324 PolarHBondContact O-N 3.13Å; V322-V325 WeakPolarHBondContact O-CB 3.35Å; V322-V325 PolarHBondContact O-N 2.98Å; V322-V325 VanDerWaalsContact O-N 3.16Å; V322-V326 VanDerWaalsContact O-CG2 3.31Å; V322-V326 WeakPolarHBondContact O-CG2 3.34Å; V322-V326 PolarHBondContact O-N 2.99Å
323	T	91.2	Very high	90.6	Very high	59 Å²	59	41.7 Å²	41.7	36%	0.362	22%	0.223	S	C	.	.	H	α-helix	trans	-62.1	-43.6	173.5	-55.8	0	0	0	0	111.5	M319 V320 L321 V325 V326 L327	M319-T323 WeakPolarHBondContact O-CB 3.3Å; M319-T323 PolarHBondContact O-N 3.39Å; M319-T323 PolarHBondContact O-OG1 3.2Å; V320-T323 WeakPolarHBondContact O-CB 3.23Å; V320-T323 PolarHBondContact O-N 2.99Å; L321-T323 VanDerWaalsContact C-N 3.27Å; L321-T323 PolarHBondContact O-N 3.46Å; T323-V325 VanDerWaalsContact C-N 3.3Å; T323-V325 PolarHBondContact O-N 3.25Å; T323-V326 PolarHBondContact O-N 3.01Å; T323-L327 WeakPolarHBondContact O-CG 3.32Å; T323-L327 PolarHBondContact O-N 3.21Å
324	I	92	Very high	90.7	Very high	68 Å²	68	41.4 Å²	41.4	35%	0.349	23%	0.225	S	C	.	.	H	α-helix	trans	-62.6	-38.9	173.8	-66.6	165.3	0	0	0	110.8	V320 L321 V322 L327 N328 I481	V320-I324 HydrophobicContact CG1-CD1 4.09Å; V320-I324 WeakPolarHBondContact O-CG1 3.32Å; V320-I324 PolarHBondContact O-N 3.35Å; L321-I324 WeakPolarHBondContact O-CB 3.41Å; L321-I324 PolarHBondContact O-N 3.36Å; L321-I324 VanDerWaalsContact O-N 3.14Å; V322-I324 PolarHBondContact O-N 3.13Å; I324-L327 PolarHBondContact O-N 3.26Å; I324-N328 WeakPolarHBondContact O-CB 3.25Å; I324-N328 VanDerWaalsContact O-CG 3.28Å; I324-N328 PolarHBondContact O-N 3.47Å; I324-N328 PolarHBondContact O-ND2 3.01Å; I324-I481 HydrophobicContact CG2-CD1 4.25Å
325	V	91.4	Very high	90.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-47	175.1	172.6	0	0	0	0	111.4	Y270 L321 V322 T323 L327 N328 C329 I481	Y270-V325 HydrophobicContact CE2-CG1 4.02Å; Y270-V325 HydrophobicContact CE2-CG2 3.93Å; Y270-V325 WeakPolarHBondContact OH-CA 3.36Å; L321-V325 WeakPolarHBondContact O-CG2 3.47Å; L321-V325 PolarHBondContact O-N 3.22Å; V322-V325 WeakPolarHBondContact O-CB 3.35Å; V322-V325 PolarHBondContact O-N 2.98Å; V322-V325 VanDerWaalsContact O-N 3.16Å; T323-V325 VanDerWaalsContact C-N 3.3Å; T323-V325 PolarHBondContact O-N 3.25Å; V325-L327 PolarHBondContact O-N 3.01Å; V325-N328 PolarHBondContact O-N 3.03Å; V325-C329 PolarHBondContact O-N 3.24Å; V325-C329 PolarHBondContact O-SG 3.38Å; V325-I481 HydrophobicContact CG2-CG2 3.83Å
326	V	91.4	Very high	90.6	Very high	23 Å²	23	43.2 Å²	43.2	14%	0.139	23%	0.234	C	C	.	.	H	α-helix	trans	-58.6	-47	176.8	174.5	0	0	0	0	110.6	S283 V322 T323 N328 C329 V330	S283-V326 WeakPolarHBondContact OG-CG2 3.38Å; V322-V326 VanDerWaalsContact O-CG2 3.31Å; V322-V326 WeakPolarHBondContact O-CG2 3.34Å; V322-V326 PolarHBondContact O-N 2.99Å; T323-V326 PolarHBondContact O-N 3.01Å; V326-N328 PolarHBondContact O-N 2.9Å; V326-C329 WeakPolarHBondContact O-CB 3.26Å; V326-C329 PolarHBondContact O-N 3.27Å; V326-V330 WeakPolarHBondContact O-CG2 3.35Å; V326-V330 PolarHBondContact O-N 3.04Å
327	L	91.8	Very high	90.6	Very high	108 Å²	108	45.3 Å²	45.3	57%	0.565	24%	0.242	S	C	*	.	H	α-helix	trans	-60.9	-44.8	177.8	-70.1	173.8	0	0	0	112	T323 I324 V325 C329 V330 V331	T323-L327 WeakPolarHBondContact O-CG 3.32Å; T323-L327 PolarHBondContact O-N 3.21Å; I324-L327 PolarHBondContact O-N 3.26Å; V325-L327 PolarHBondContact O-N 3.01Å; L327-C329 VanDerWaalsContact C-N 3.3Å; L327-C329 PolarHBondContact O-N 3.28Å; L327-V330 WeakPolarHBondContact O-CB 3.44Å; L327-V330 PolarHBondContact O-N 3.39Å; L327-V331 WeakPolarHBondContact O-CG2 3.44Å; L327-V331 PolarHBondContact O-N 3.24Å
328	N	90.9	Very high	90.5	Very high	43 Å²	43	45.2 Å²	45.2	23%	0.23	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-38.1	175.7	-73.7	-25.1	0	0	0	111.7	Y270 I324 V325 V326 V330 V331 V332	Y270-N328 HydrophobicContact CE1-CB 4.19Å; Y270-N328 WeakPolarHBondContact OH-CB 3.46Å; Y270-N328 PolarHBondContact OH-ND2 3.32Å; I324-N328 WeakPolarHBondContact O-CB 3.25Å; I324-N328 VanDerWaalsContact O-CG 3.28Å; I324-N328 PolarHBondContact O-N 3.47Å; I324-N328 PolarHBondContact O-ND2 3.01Å; V325-N328 PolarHBondContact O-N 3.03Å; V326-N328 PolarHBondContact O-N 2.9Å; N328-V330 VanDerWaalsContact C-N 3.34Å; N328-V330 PolarHBondContact O-N 3.11Å; N328-V331 PolarHBondContact O-N 3.29Å; N328-V332 WeakPolarHBondContact O-CG2 3.2Å; N328-V332 PolarHBondContact O-N 3.23Å
329	C	90.5	Very high	90.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.1	-41.3	175.5	-68.6	0	0	0	0	111.9	V269 M280 V325 V326 L327 V331 V332 L333	V269-C329 WeakPolarHBondContact CG1-SG 3.43Å; M280-C329 HydrophobicContact SD-CB 4.08Å; V325-C329 PolarHBondContact O-N 3.24Å; V325-C329 PolarHBondContact O-SG 3.38Å; V326-C329 WeakPolarHBondContact O-CB 3.26Å; V326-C329 PolarHBondContact O-N 3.27Å; L327-C329 VanDerWaalsContact C-N 3.3Å; L327-C329 PolarHBondContact O-N 3.28Å; C329-V331 VanDerWaalsContact C-N 3.35Å; C329-V332 PolarHBondContact O-N 3.26Å; C329-L333 VanDerWaalsContact O-CB 3.32Å; C329-L333 WeakPolarHBondContact O-CB 3.36Å; C329-L333 PolarHBondContact O-N 2.82Å
330	V	91.1	Very high	89.9	Confident	73 Å²	73	46.2 Å²	46.2	44%	0.442	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-43	174.5	175.2	0	0	0	0	111.1	M280 V326 L327 N328 L333 N334	M280-V330 HydrophobicContact CE-CG2 3.59Å; M280-V330 HydrophobicContact SD-CG2 4.04Å; V326-V330 WeakPolarHBondContact O-CG2 3.35Å; V326-V330 PolarHBondContact O-N 3.04Å; L327-V330 WeakPolarHBondContact O-CB 3.44Å; L327-V330 PolarHBondContact O-N 3.39Å; N328-V330 VanDerWaalsContact C-N 3.34Å; N328-V330 PolarHBondContact O-N 3.11Å; V330-L333 PolarHBondContact O-N 3.07Å; V330-N334 WeakPolarHBondContact O-CB 3.43Å; V330-N334 PolarHBondContact O-N 3.19Å
331	V	91.2	Very high	89.4	Confident	76 Å²	76	46.9 Å²	46.9	46%	0.461	26%	0.257	S	S	.	.	H	α-helix	trans	-62.8	-46.2	176.9	172.9	0	0	0	0	111.1	L327 N328 C329 L333 N334 L335	L327-V331 WeakPolarHBondContact O-CG2 3.44Å; L327-V331 PolarHBondContact O-N 3.24Å; N328-V331 PolarHBondContact O-N 3.29Å; C329-V331 VanDerWaalsContact C-N 3.35Å; V331-L333 VanDerWaalsContact C-N 3.34Å; V331-L333 PolarHBondContact O-N 3.47Å; V331-N334 WeakPolarHBondContact O-CB 3.3Å; V331-N334 PolarHBondContact O-N 2.93Å; V331-L335 HydrophobicContact CG1-CD1 4.18Å; V331-L335 WeakPolarHBondContact O-CG 3.33Å; V331-L335 PolarHBondContact O-N 3.22Å
332	V	91.5	Very high	89.2	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-41.6	178.6	171.9	0	0	0	0	111.2	N328 C329 N334 L335 H336 A470 V473 D474	N328-V332 WeakPolarHBondContact O-CG2 3.2Å; N328-V332 PolarHBondContact O-N 3.23Å; C329-V332 PolarHBondContact O-N 3.26Å; V332-N334 VanDerWaalsContact C-N 3.32Å; V332-N334 PolarHBondContact O-N 3.43Å; V332-L335 PolarHBondContact O-N 3.01Å; V332-H336 WeakPolarHBondContact O-CB 3.23Å; V332-H336 PolarHBondContact O-N 2.91Å; V332-A470 HydrophobicContact CG1-CB 4.09Å; V332-V473 HydrophobicContact CG2-CB 4.24Å; V332-V473 HydrophobicContact CG2-CG1 3.68Å; V332-D474 WeakPolarHBondContact CG2-OD1 3.46Å
333	L	90.3	Very high	89	Confident	43 Å²	43	54.4 Å²	54.4	23%	0.225	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-39.8	176.6	-161.4	68	0	0	0	111.4	A274 M280 C329 V330 V331 L335 H336 F337	A274-L333 HydrophobicContact CB-CD1 4.12Å; M280-L333 HydrophobicContact CG-CD2 3.77Å; M280-L333 HydrophobicContact SD-CD2 4.41Å; C329-L333 VanDerWaalsContact O-CB 3.32Å; C329-L333 WeakPolarHBondContact O-CB 3.36Å; C329-L333 PolarHBondContact O-N 2.82Å; V330-L333 PolarHBondContact O-N 3.07Å; V331-L333 VanDerWaalsContact C-N 3.34Å; V331-L333 PolarHBondContact O-N 3.47Å; L333-L335 VanDerWaalsContact C-N 3.35Å; L333-H336 PolarHBondContact O-N 3.36Å; L333-F337 HydrophobicContact CD1-CD2 3.96Å; L333-F337 HydrophobicContact CD1-CE2 3.41Å; L333-F337 VanDerWaalsContact CD1-CE2 3.41Å; L333-F337 HydrophobicContact CD1-CZ 4.33Å; L333-F337 HydrophobicContact CD2-CE2 4.36Å; L333-F337 HydrophobicContact CG-CD2 3.84Å; L333-F337 HydrophobicContact CG-CE2 3.69Å; L333-F337 WeakPolarHBondContact O-CD2 3.4Å; L333-F337 PolarHBondContact O-N 2.88Å; L333-F337 VanDerWaalsContact O-N 3.12Å
334	N	90.9	Very high	88.6	Confident	86 Å²	86	57.9 Å²	57.9	46%	0.46	32%	0.319	S	S	.	.	H	α-helix	trans	-61	-43.2	173.6	-176.9	-94.9	0	0	0	111.6	V330 V331 V332 R338	V330-N334 WeakPolarHBondContact O-CB 3.43Å; V330-N334 PolarHBondContact O-N 3.19Å; V331-N334 WeakPolarHBondContact O-CB 3.3Å; V331-N334 PolarHBondContact O-N 2.93Å; V332-N334 VanDerWaalsContact C-N 3.32Å; V332-N334 PolarHBondContact O-N 3.43Å; N334-R338 WeakPolarHBondContact O-CG 3.1Å; N334-R338 PolarHBondContact O-N 3.14Å; N334-R338 PolarHBondContact OD1-NE 3.47Å; N334-R338 PolarHBondContact OD1-NH2 3.4Å
335	L	88.1	Confident	88.1	Confident	23 Å²	23	55.1 Å²	55.1	12%	0.12	30%	0.304	C	S	.	.	H	α-helix	trans	-66.7	-39	177.3	-68.6	171.6	0	0	0	112.1	V331 V332 L333 R338 W466 A470 V473	V331-L335 HydrophobicContact CG1-CD1 4.18Å; V331-L335 WeakPolarHBondContact O-CG 3.33Å; V331-L335 PolarHBondContact O-N 3.22Å; V332-L335 PolarHBondContact O-N 3.01Å; L333-L335 VanDerWaalsContact C-N 3.35Å; L335-R338 PolarHBondContact O-N 3.21Å; L335-W466 HydrophobicContact CD2-CE3 4.42Å; L335-W466 HydrophobicContact CD2-CZ3 3.9Å; L335-A470 HydrophobicContact CB-CB 4.21Å; L335-V473 HydrophobicContact CD1-CG2 4Å
336	H	88.8	Confident	87.9	Confident	16 Å²	16	58.3 Å²	58.3	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-65.9	-40.6	-178.7	-174.1	-91.9	0	0	0	113	A274 D275 V332 L333 R338 S467 A470	A274-H336 HydrophobicContact CB-CB 4.01Å; D275-H336 IonicContact OD1-CE1 3.8Å; D275-H336 PolarHBondContact OD1-CE1 3.48Å; D275-H336 IonicContact OD1-NE2 3.97Å; D275-H336 PolarHBondContact OD1-NE2 2.79Å; V332-H336 WeakPolarHBondContact O-CB 3.23Å; V332-H336 PolarHBondContact O-N 2.91Å; L333-H336 PolarHBondContact O-N 3.36Å; H336-R338 VanDerWaalsContact C-N 3.31Å; H336-R338 PolarHBondContact O-N 3.16Å; H336-S467 PolarHBondContact CD2-OG 3.39Å; H336-S467 PolarHBondContact NE2-OG 3.23Å; H336-S467 VanDerWaalsContact NE2-OG 3.12Å; H336-A470 HydrophobicContact CB-CB 3.78Å
337	F	87.9	Confident	87.5	Confident	133 Å²	133	63.2 Å²	63.2	58%	0.583	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	10.7	-180	-68.6	-59.5	0	0	0	114.1	L333	L333-F337 HydrophobicContact CD1-CD2 3.96Å; L333-F337 HydrophobicContact CD1-CE2 3.41Å; L333-F337 VanDerWaalsContact CD1-CE2 3.41Å; L333-F337 HydrophobicContact CD1-CZ 4.33Å; L333-F337 HydrophobicContact CD2-CE2 4.36Å; L333-F337 HydrophobicContact CG-CD2 3.84Å; L333-F337 HydrophobicContact CG-CE2 3.69Å; L333-F337 WeakPolarHBondContact O-CD2 3.4Å; L333-F337 PolarHBondContact O-N 2.88Å; L333-F337 VanDerWaalsContact O-N 3.12Å
338	R	88	Confident	87.2	Confident	58 Å²	58	66.2 Å²	66.2	22%	0.219	35%	0.352	C	S	.	.			trans	-68.5	138.4	170.9	-82.6	172.5	-168.2	-160.1	1	110.4	N334 L335 H336 H343 W466	N334-R338 WeakPolarHBondContact O-CG 3.1Å; N334-R338 PolarHBondContact O-N 3.14Å; N334-R338 PolarHBondContact OD1-NE 3.47Å; N334-R338 PolarHBondContact OD1-NH2 3.4Å; L335-R338 PolarHBondContact O-N 3.21Å; H336-R338 VanDerWaalsContact C-N 3.31Å; H336-R338 PolarHBondContact O-N 3.16Å; R338-H343 HydrophobicContact CG-CB 4.28Å; R338-W466 HydrophobicContact CB-CD2 3.74Å; R338-W466 HydrophobicContact CB-CE3 4.02Å; R338-W466 HydrophobicContact CB-CG 3.98Å; R338-W466 VanDerWaalsContact CD-CZ3 3.47Å
339	T	85.4	Confident	86.8	Confident	33 Å²	33	65.5 Å²	65.5	20%	0.202	35%	0.35	C	S	.	.			trans	-122.9	153	176.6	55.8	0	0	0	0	110.1	S341 T342 H343 Y459	T339-S341 PolarHBondContact O-N 3.48Å; T339-T342 PolarHBondContact N-OG1 3.39Å; T339-T342 PolarHBondContact O-N 2.76Å; T339-T342 PolarHBondContact O-OG1 2.97Å; T339-T342 PolarHBondContact OG1-OG1 3.01Å; T339-H343 PolarHBondContact O-N 3.26Å; T339-H343 VanDerWaalsContact O-N 3.12Å; T339-Y459 WeakPolarHBondContact CB-OH 3.42Å; T339-Y459 WeakPolarHBondContact CG2-OH 3.29Å
340	P	81.1	Confident	86.5	Confident	29 Å²	29	68.5 Å²	68.5	19%	0.188	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-31.2	176	-30.6	36.9	0	0	0	114.1	T342 Y459 E462	P340-T342 VanDerWaalsContact C-N 3.31Å; P340-T342 PolarHBondContact O-N 3.01Å; P340-Y459 HydrophobicContact CB-CD2 3.94Å; P340-Y459 HydrophobicContact CB-CE2 4.05Å; P340-Y459 HydrophobicContact CG-CD2 3.71Å; P340-Y459 HydrophobicContact CG-CE2 3.88Å; P340-Y459 HydrophobicContact CG-CG 4.27Å; P340-E462 VanDerWaalsContact CB-OE2 3.3Å; P340-E462 WeakPolarHBondContact CB-OE2 3.44Å; P340-E462 HydrophobicContact CG-CB 3.76Å; P340-E462 HydrophobicContact CG-CG 3.83Å; P340-E462 WeakPolarHBondContact CG-OE2 3.39Å
341	S	82.4	Confident	86	Confident	100 Å²	100	71.3 Å²	71.3	70%	0.699	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-19.7	-180	-48.6	0	0	0	0	114.1	T339	T339-S341 PolarHBondContact O-N 3.48Å
342	T	85.7	Confident	85.7	Confident	92 Å²	92	70.8 Å²	70.8	56%	0.564	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-37	-176	59.2	0	0	0	0	112.7	T339 P340	T339-T342 PolarHBondContact N-OG1 3.39Å; T339-T342 PolarHBondContact O-N 2.76Å; T339-T342 PolarHBondContact O-OG1 2.97Å; T339-T342 PolarHBondContact OG1-OG1 3.01Å; P340-T342 VanDerWaalsContact C-N 3.31Å; P340-T342 PolarHBondContact O-N 3.01Å
343	H	86.4	Confident	85.4	Confident	78 Å²	78	72.6 Å²	72.6	36%	0.361	37%	0.368	S	S	.	.			trans	-138.7	132.3	-174.2	-67.4	77.6	0	0	0	110.1	R338 T339 W466	R338-H343 HydrophobicContact CG-CB 4.28Å; T339-H343 PolarHBondContact O-N 3.26Å; T339-H343 VanDerWaalsContact O-N 3.12Å; H343-W466 HydrophobicContact CB-CZ2 4.23Å
344	V	84.6	Confident	84.8	Confident	133 Å²	133	72.2 Å²	72.2	81%	0.806	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-87.9	129.9	174.3	-178.1	0	0	0	0	109.3	S346	V344-S346 PolarHBondContact O-N 3.35Å
345	M	81.4	Confident	84.3	Confident	9 Å²	9	72.6 Å²	72.6	4%	0.044	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-80.2	118.4	177.3	-171.9	157	57.9	0	0	111.4	K350 E462 N465 W466 I469	M345-K350 HydrophobicContact CE-CD 3.88Å; M345-K350 HydrophobicContact CE-CG 3.66Å; M345-K350 HydrophobicContact CG-CD 4.41Å; M345-K350 HydrophobicContact CG-CG 3.7Å; M345-K350 HydrophobicContact SD-CG 3.74Å; M345-E462 HydrophobicContact CE-CG 4.17Å; M345-N465 HydrophobicContact CE-CB 3.43Å; M345-N465 VanDerWaalsContact CE-CB 3.43Å; M345-N465 HydrophobicContact SD-CB 4.33Å; M345-W466 HydrophobicContact CB-CZ2 3.82Å; M345-W466 HydrophobicContact CG-CZ2 4.19Å; M345-W466 HydrophobicContact SD-CD2 4.46Å; M345-I469 HydrophobicContact SD-CD1 3.36Å; M345-I469 WeakPolarHBondContact SD-CD1 3.43Å
346	S	86.5	Confident	84	Confident	67 Å²	67	79.3 Å²	79.3	47%	0.469	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-70.6	140.9	174.5	178.7	0	0	0	0	111.3	V344 W348 T349 K350	V344-S346 PolarHBondContact O-N 3.35Å; S346-W348 PolarHBondContact O-N 3.2Å; S346-T349 WeakPolarHBondContact O-CA 3.29Å; S346-T349 WeakPolarHBondContact O-CB 3.49Å; S346-T349 PolarHBondContact O-N 3.47Å; S346-K350 PolarHBondContact O-N 3.44Å; S346-K350 VanDerWaalsContact O-N 3.17Å
347	E	82.4	Confident	83.7	Confident	126 Å²	126	79.1 Å²	79.1	59%	0.589	39%	0.388	S	S	*	.	H	α-helix	trans	-58.3	-31.3	177.1	-69.4	-57.3	130.7	0	0	112.8	K350 K351	E347-K350 IonicContact OE1-NZ 3.23Å; E347-K350 PolarHBondContact OE1-NZ 2.94Å; E347-K351 WeakPolarHBondContact O-CB 3.44Å; E347-K351 PolarHBondContact O-N 3.41Å; E347-K351 VanDerWaalsContact O-N 3.1Å
348	W	85.7	Confident	83.4	Confident	171 Å²	171	73.4 Å²	73.4	65%	0.648	37%	0.365	S	S	*	.	H	α-helix	trans	-65.6	-40.9	173.6	-177.5	88.8	0	0	0	112	S346 K351 F352	S346-W348 PolarHBondContact O-N 3.2Å; W348-K351 PolarHBondContact O-N 2.98Å; W348-F352 HydrophobicContact CH2-CB 4.37Å; W348-F352 HydrophobicContact CH2-CD1 4.39Å; W348-F352 HydrophobicContact CH2-CD2 4.48Å; W348-F352 HydrophobicContact CH2-CG 4.16Å; W348-F352 HydrophobicContact CZ2-CB 4.39Å; W348-F352 HydrophobicContact CZ2-CD2 4.26Å; W348-F352 HydrophobicContact CZ2-CG 4.28Å; W348-F352 HydrophobicContact CZ3-CB 4.44Å; W348-F352 WeakPolarHBondContact O-CB 3.37Å; W348-F352 PolarHBondContact O-N 3.42Å
349	T	83.6	Confident	83.1	Confident	29 Å²	29	79 Å²	79	18%	0.178	39%	0.386	C	S	.	.	H	α-helix	trans	-65.1	-42.1	179.8	-48.9	0	0	0	0	110.6	S346 F352 F353 I469	S346-T349 WeakPolarHBondContact O-CA 3.29Å; S346-T349 WeakPolarHBondContact O-CB 3.49Å; S346-T349 PolarHBondContact O-N 3.47Å; T349-F352 PolarHBondContact O-N 3.47Å; T349-F353 HydrophobicContact CG2-CD2 3.6Å; T349-F353 HydrophobicContact CG2-CE2 4.04Å; T349-F353 WeakPolarHBondContact O-CB 3.39Å; T349-F353 WeakPolarHBondContact O-CD2 3.41Å; T349-F353 PolarHBondContact O-N 3Å; T349-I469 HydrophobicContact CG2-CD1 4.12Å
350	K	82.9	Confident	83	Confident	62 Å²	62	82.7 Å²	82.7	27%	0.27	40%	0.403	S	S	.	.	H	α-helix	trans	-58	-54.9	173.5	-65.3	-177.6	-176.8	163.5	0	110.9	M345 S346 E347 F352 F353 L354	M345-K350 HydrophobicContact CE-CD 3.88Å; M345-K350 HydrophobicContact CE-CG 3.66Å; M345-K350 HydrophobicContact CG-CD 4.41Å; M345-K350 HydrophobicContact CG-CG 3.7Å; M345-K350 HydrophobicContact SD-CG 3.74Å; S346-K350 PolarHBondContact O-N 3.44Å; S346-K350 VanDerWaalsContact O-N 3.17Å; E347-K350 IonicContact OE1-NZ 3.23Å; E347-K350 PolarHBondContact OE1-NZ 2.94Å; K350-F352 VanDerWaalsContact C-N 3.3Å; K350-F352 PolarHBondContact O-N 2.85Å; K350-F353 PolarHBondContact O-N 3.01Å; K350-L354 HydrophobicContact CB-CD1 4.27Å; K350-L354 HydrophobicContact CG-CD1 4.39Å; K350-L354 WeakPolarHBondContact O-CA 3.4Å; K350-L354 VanDerWaalsContact O-CB 3.23Å; K350-L354 WeakPolarHBondContact O-CB 3.35Å; K350-L354 PolarHBondContact O-N 3.08Å
351	K	81.9	Confident	83	Confident	132 Å²	132	82.5 Å²	82.5	57%	0.574	40%	0.4	S	S	*	.	I	π-helix	trans	-61.5	-38.3	-177.3	-165.6	170.2	-169.3	168.8	0	112.8	E347 W348 E355 R356	E347-K351 WeakPolarHBondContact O-CB 3.44Å; E347-K351 PolarHBondContact O-N 3.41Å; E347-K351 VanDerWaalsContact O-N 3.1Å; W348-K351 PolarHBondContact O-N 2.98Å; K351-E355 WeakPolarHBondContact O-CB 3.44Å; K351-E355 PolarHBondContact O-N 3.22Å; K351-R356 PolarHBondContact O-N 3.37Å; K351-R356 VanDerWaalsContact O-N 3.16Å
352	F	84.9	Confident	82.9	Confident	65 Å²	65	85.9 Å²	85.9	29%	0.285	41%	0.405	S	S	.	.	I	π-helix	trans	-73.1	-53.7	179.5	-174	-98.7	0	0	0	112.2	W348 T349 K350 R356 L357	W348-F352 HydrophobicContact CH2-CB 4.37Å; W348-F352 HydrophobicContact CH2-CD1 4.39Å; W348-F352 HydrophobicContact CH2-CD2 4.48Å; W348-F352 HydrophobicContact CH2-CG 4.16Å; W348-F352 HydrophobicContact CZ2-CB 4.39Å; W348-F352 HydrophobicContact CZ2-CD2 4.26Å; W348-F352 HydrophobicContact CZ2-CG 4.28Å; W348-F352 HydrophobicContact CZ3-CB 4.44Å; W348-F352 WeakPolarHBondContact O-CB 3.37Å; W348-F352 PolarHBondContact O-N 3.42Å; T349-F352 PolarHBondContact O-N 3.47Å; K350-F352 VanDerWaalsContact C-N 3.3Å; K350-F352 PolarHBondContact O-N 2.85Å; F352-R356 PolarHBondContact O-N 2.92Å; F352-L357 HydrophobicContact CE1-CD1 4.14Å; F352-L357 HydrophobicContact CZ-CD1 4.14Å; F352-L357 WeakPolarHBondContact O-CB 3.42Å; F352-L357 PolarHBondContact O-N 3.45Å
353	F	83.5	Confident	82.4	Confident	39 Å²	39	84.1 Å²	84.1	17%	0.171	39%	0.391	C	S	.	.	I	π-helix	trans	-86.5	-26.9	-171	-75.1	-76.6	0	0	0	114.9	T349 K350 L357 P358 I469 T472 V473	T349-F353 HydrophobicContact CG2-CD2 3.6Å; T349-F353 HydrophobicContact CG2-CE2 4.04Å; T349-F353 WeakPolarHBondContact O-CB 3.39Å; T349-F353 WeakPolarHBondContact O-CD2 3.41Å; T349-F353 PolarHBondContact O-N 3Å; K350-F353 PolarHBondContact O-N 3.01Å; F353-L357 HydrophobicContact CD1-CD2 3.87Å; F353-L357 HydrophobicContact CE1-CD2 4.2Å; F353-P358 WeakPolarHBondContact O-CD 3.44Å; F353-P358 WeakPolarHBondContact O-CG 3.46Å; F353-I469 HydrophobicContact CB-CB 4.33Å; F353-I469 HydrophobicContact CB-CG1 3.81Å; F353-I469 HydrophobicContact CB-CG2 4Å; F353-I469 HydrophobicContact CD1-CG2 4.27Å; F353-I469 HydrophobicContact CD2-CG2 4.24Å; F353-I469 HydrophobicContact CG-CG2 3.92Å; F353-T472 WeakPolarHBondContact O-CG2 3.41Å; F353-T472 PolarHBondContact O-OG1 3.31Å; F353-V473 HydrophobicContact CD1-CG2 3.82Å; F353-V473 HydrophobicContact CE1-CG2 3.44Å; F353-V473 VanDerWaalsContact CE1-CG2 3.44Å; F353-V473 HydrophobicContact CZ-CG2 4.19Å
354	L	79.6	Confident	81.4	Confident	36 Å²	36	86 Å²	86	19%	0.188	41%	0.412	C	S	.	.	I	π-helix	trans	-97.7	-34.1	179.9	-61.1	169.8	0	0	0	112.4	K350 P358 N465 I469	K350-L354 HydrophobicContact CB-CD1 4.27Å; K350-L354 HydrophobicContact CG-CD1 4.39Å; K350-L354 WeakPolarHBondContact O-CA 3.4Å; K350-L354 VanDerWaalsContact O-CB 3.23Å; K350-L354 WeakPolarHBondContact O-CB 3.35Å; K350-L354 PolarHBondContact O-N 3.08Å; L354-P358 WeakPolarHBondContact O-CD 3.49Å; L354-P358 VanDerWaalsContact O-CG 3.26Å; L354-P358 WeakPolarHBondContact O-CG 3.34Å; L354-N465 HydrophobicContact CD1-CB 4.13Å; L354-I469 HydrophobicContact CD2-CG1 4.01Å; L354-I469 HydrophobicContact CG-CG1 4.05Å
355	E	79.1	Confident	80.1	Confident	94 Å²	94	85.9 Å²	85.9	44%	0.439	40%	0.403	S	S	.	.	I	π-helix	trans	-100.1	-46.8	-177.3	-59.5	176.9	-161.2	0	0	113.8	K351 R359	K351-E355 WeakPolarHBondContact O-CB 3.44Å; K351-E355 PolarHBondContact O-N 3.22Å; E355-R359 PolarHBondContact O-NE 3.46Å
356	R	82.2	Confident	78.8	Confident	164 Å²	164	90.2 Å²	90.2	62%	0.619	43%	0.432	S	S	*	.	I	π-helix	trans	-86.8	-49.5	-170.3	-171.9	174.5	-178.4	167.4	0	112.7	K351 F352 I360	K351-R356 PolarHBondContact O-N 3.37Å; K351-R356 VanDerWaalsContact O-N 3.16Å; F352-R356 PolarHBondContact O-N 2.92Å; R356-I360 HydrophobicContact CG-CD1 4.13Å; R356-I360 WeakPolarHBondContact O-CG1 3.4Å; R356-I360 PolarHBondContact O-N 2.96Å
357	L	82.4	Confident	76.7	Confident	11 Å²	11	91.5 Å²	91.5	6%	0.058	45%	0.447	C	S	.	.	H	α-helix	trans	-65.4	-42.1	-176.9	-151.8	78.7	0	0	0	113.3	F352 F353 R359 I360 L361 L476	F352-L357 HydrophobicContact CE1-CD1 4.14Å; F352-L357 HydrophobicContact CZ-CD1 4.14Å; F352-L357 WeakPolarHBondContact O-CB 3.42Å; F352-L357 PolarHBondContact O-N 3.45Å; F353-L357 HydrophobicContact CD1-CD2 3.87Å; F353-L357 HydrophobicContact CE1-CD2 4.2Å; L357-R359 VanDerWaalsContact C-N 3.3Å; L357-R359 PolarHBondContact O-N 3.02Å; L357-I360 PolarHBondContact O-N 3.49Å; L357-I360 VanDerWaalsContact O-N 3.11Å; L357-L361 HydrophobicContact CD2-CD1 3.93Å; L357-L361 HydrophobicContact CG-CD1 3.77Å; L357-L361 HydrophobicContact CG-CG 4.37Å; L357-L361 WeakPolarHBondContact O-CB 3.28Å; L357-L361 VanDerWaalsContact O-CG 3.3Å; L357-L361 WeakPolarHBondContact O-CG 3.5Å; L357-L361 PolarHBondContact O-N 3.42Å; L357-L476 HydrophobicContact CD1-CD1 4.29Å; L357-L476 HydrophobicContact CD1-CD2 4.43Å; L357-L476 HydrophobicContact CD2-CB 4.18Å; L357-L476 HydrophobicContact CD2-CD2 4.12Å
358	P	82.1	Confident	74.9	Confident	14 Å²	14	92.1 Å²	92.1	9%	0.091	45%	0.454	C	S	.	.	H	α-helix	trans	-67.1	-32.2	-179.2	-25.9	40.9	0	0	0	112.8	F353 L354 L361 H362 M363 T472	F353-P358 WeakPolarHBondContact O-CD 3.44Å; F353-P358 WeakPolarHBondContact O-CG 3.46Å; L354-P358 WeakPolarHBondContact O-CD 3.49Å; L354-P358 VanDerWaalsContact O-CG 3.26Å; L354-P358 WeakPolarHBondContact O-CG 3.34Å; P358-L361 CarbonylContact O-C 3.51Å; P358-L361 PolarHBondContact O-N 3.32Å; P358-H362 PolarHBondContact O-N 2.98Å; P358-M363 HydrophobicContact CB-CB 4.12Å; P358-M363 HydrophobicContact CB-CG 4.37Å; P358-M363 HydrophobicContact CB-SD 4.43Å; P358-M363 PolarHBondContact O-N 3.43Å; P358-T472 HydrophobicContact CG-CG2 3.66Å
359	R	81.5	Confident	73.1	Confident	176 Å²	176	91.5 Å²	91.5	66%	0.664	46%	0.463	S	S	*	.	H	α-helix	trans	-63.9	-39.6	170.9	-82.2	-172.5	-94.7	-178.7	-13.5	112.4	E355 L357 H362	E355-R359 PolarHBondContact O-NE 3.46Å; L357-R359 VanDerWaalsContact C-N 3.3Å; L357-R359 PolarHBondContact O-N 3.02Å; R359-H362 PolarHBondContact O-CD2 3.43Å
360	I	83.6	Confident	71.3	Confident	109 Å²	109	97 Å²	97	56%	0.559	49%	0.487	S	S	*	.	H	α-helix	trans	-70.3	-38	176.3	-65.3	165.1	0	0	0	111	R356 L357 H362	R356-I360 HydrophobicContact CG-CD1 4.13Å; R356-I360 WeakPolarHBondContact O-CG1 3.4Å; R356-I360 PolarHBondContact O-N 2.96Å; L357-I360 PolarHBondContact O-N 3.49Å; L357-I360 VanDerWaalsContact O-N 3.11Å; I360-H362 VanDerWaalsContact C-N 3.31Å
361	L	79.7	Confident	69.2	Low	25 Å²	25	99 Å²	99	13%	0.131	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	5	-176.7	-62.8	174.6	0	0	0	113.6	L357 P358 M363 R475 L476 F479	L357-L361 HydrophobicContact CD2-CD1 3.93Å; L357-L361 HydrophobicContact CG-CD1 3.77Å; L357-L361 HydrophobicContact CG-CG 4.37Å; L357-L361 WeakPolarHBondContact O-CB 3.28Å; L357-L361 VanDerWaalsContact O-CG 3.3Å; L357-L361 WeakPolarHBondContact O-CG 3.5Å; L357-L361 PolarHBondContact O-N 3.42Å; P358-L361 CarbonylContact O-C 3.51Å; P358-L361 PolarHBondContact O-N 3.32Å; L361-M363 VanDerWaalsContact C-N 3.28Å; L361-M363 HydrophobicContact CB-CE 3.94Å; L361-M363 HydrophobicContact CB-CG 4.15Å; L361-M363 HydrophobicContact CD1-CE 3.6Å; L361-M363 HydrophobicContact CG-CE 4.43Å; L361-M363 PolarHBondContact O-N 2.81Å; L361-R475 HydrophobicContact CD1-CB 4.33Å; L361-L476 HydrophobicContact CD1-CB 4.14Å; L361-L476 HydrophobicContact CD2-CD1 4.45Å; L361-F479 HydrophobicContact CD2-CD2 3.61Å; L361-F479 HydrophobicContact CD2-CE2 4.11Å; L361-F479 HydrophobicContact CD2-CG 4.35Å
362	H	80.5	Confident	67.3	Low	171 Å²	171	98.5 Å²	98.5	79%	0.792	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	45.2	-176.3	-64.8	165.8	0	0	0	113.9	P358 R359 I360	P358-H362 PolarHBondContact O-N 2.98Å; R359-H362 PolarHBondContact O-CD2 3.43Å; I360-H362 VanDerWaalsContact C-N 3.31Å
363	M	75.8	Confident	65.4	Low	56 Å²	56	105.9 Å²	105.9	28%	0.276	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-76.8	138.3	175.9	-60.2	-164.3	-173.2	0	0	111.2	P358 L361 H365 T472 R475	P358-M363 HydrophobicContact CB-CB 4.12Å; P358-M363 HydrophobicContact CB-CG 4.37Å; P358-M363 HydrophobicContact CB-SD 4.43Å; P358-M363 PolarHBondContact O-N 3.43Å; L361-M363 VanDerWaalsContact C-N 3.28Å; L361-M363 HydrophobicContact CB-CE 3.94Å; L361-M363 HydrophobicContact CB-CG 4.15Å; L361-M363 HydrophobicContact CD1-CE 3.6Å; L361-M363 HydrophobicContact CG-CE 4.43Å; L361-M363 PolarHBondContact O-N 2.81Å; M363-H365 PolarHBondContact O-N 3.16Å; M363-T472 HydrophobicContact CE-CG2 4.03Å; M363-T472 HydrophobicContact SD-CG2 3.75Å; M363-R475 HydrophobicContact CE-CB 3.23Å; M363-R475 HydrophobicContact CE-CG 3.35Å; M363-R475 HydrophobicContact SD-CG 4.42Å
364	S	65.4	Low	63.4	Low	116 Å²	116	111.8 Å²	111.8	81%	0.811	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-66.7	116.9	167.2	53	0	0	0	0	109
365	H	57.7	Low	61.6	Low	132 Å²	132	113 Å²	113	61%	0.611	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-64.5	137	170.3	-139.4	-91.2	0	0	0	108.5	M363 A367 D368	M363-H365 PolarHBondContact O-N 3.16Å; H365-A367 PolarHBondContact O-N 3.47Å; H365-D368 IonicContact ND1-OD1 3.43Å
366	P	53.3	Low	60.2	Low	99 Å²	99	113.6 Å²	113.6	64%	0.643	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-55.2	134.7	159.5	24.6	-29.1	0	0	0	107.2	D368	P366-D368 PolarHBondContact O-N 2.96Å
367	A	42.6	Very low	58.3	Low	95 Å²	95	113.2 Å²	113.2	79%	0.785	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-48.8	128.6	-178.1	0	0	0	0	0	109.2	H365 D369	H365-A367 PolarHBondContact O-N 3.47Å; A367-D369 PolarHBondContact O-N 3.25Å
368	D	45.9	Very low	56.6	Low	139 Å²	139	118.4 Å²	118.4	74%	0.743	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-50.9	131.3	178.9	-62.4	-42.8	0	0	0	109.3	H365 P366 E370	H365-D368 IonicContact ND1-OD1 3.43Å; P366-D368 PolarHBondContact O-N 2.96Å; D368-E370 PolarHBondContact O-N 2.93Å
369	D	47.7	Very low	54.6	Low	158 Å²	158	128.6 Å²	128.6	85%	0.845	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-53.2	134.4	173.3	-71.1	-49.3	0	0	0	109.1	A367	A367-D369 PolarHBondContact O-N 3.25Å
370	E	44.7	Very low	52.9	Low	145 Å²	145	131.7 Å²	131.7	68%	0.678	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-48.9	136.1	173.1	-69.7	-174.4	161.5	0	0	109.1	D368	D368-E370 PolarHBondContact O-N 2.93Å
371	P	38.3	Very low	51	Low	103 Å²	103	131.9 Å²	131.9	67%	0.669	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-55	148.4	-176.2	21.3	-31.9	0	0	0	110.8	W373	P371-W373 PolarHBondContact O-N 2.96Å; P371-W373 VanDerWaalsContact O-N 3.1Å
372	P	43.1	Very low	49.7	Very low	121 Å²	121	134.5 Å²	134.5	79%	0.786	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-50.4	123.3	177.5	-22.7	31.1	0	0	0	109.5	D374	P372-D374 VanDerWaalsContact C-N 3.29Å; P372-D374 PolarHBondContact O-N 3.47Å
373	W	44	Very low	48.6	Very low	220 Å²	220	130.4 Å²	130.4	83%	0.833	73%	0.732	S	S	*	*			trans	-63.4	85.9	-176.9	-78.1	83.1	0	0	0	111	P371	P371-W373 PolarHBondContact O-N 2.96Å; P371-W373 VanDerWaalsContact O-N 3.1Å
374	D	41.6	Very low	47.7	Very low	163 Å²	163	132.2 Å²	132.2	87%	0.872	75%	0.746	S	S	*	*			trans	-89.7	104.3	166.2	-100.8	-15.8	0	0	0	109.3	P372	P372-D374 VanDerWaalsContact C-N 3.29Å; P372-D374 PolarHBondContact O-N 3.47Å
375	G	43.5	Very low	47.4	Very low	61 Å²	61	128.2 Å²	128.2	63%	0.629	72%	0.723	S	S	*	*	S	Bend	trans	88.6	131	156.6	0	0	0	0	0	116.5	L377	G375-L377 PolarHBondContact O-N 3.38Å
376	A	48.1	Very low	47.4	Very low	107 Å²	107	131 Å²	131	88%	0.884	73%	0.73	S	S	*	*			trans	-47.9	124.8	179.5	0	0	0	0	0	114.4
377	L	43.4	Very low	47.8	Very low	156 Å²	156	131.3 Å²	131.3	82%	0.817	73%	0.725	S	S	*	*			trans	-119.6	152	158	-79.5	174.5	0	0	0	110.9	G375 R379	G375-L377 PolarHBondContact O-N 3.38Å; L377-R379 PolarHBondContact O-N 2.9Å
378	P	46.9	Very low	48.7	Very low	120 Å²	120	129.3 Å²	129.3	78%	0.779	71%	0.708	S	S	*	*			trans	-69.5	124.1	-163.3	2.9	8.8	0	0	0	111	R380	P378-R380 PolarHBondContact O-N 3.42Å
379	R	40.1	Very low	49.4	Very low	229 Å²	229	125.2 Å²	125.2	86%	0.864	69%	0.694	S	S	*	*			trans	-54.6	103.9	-179.5	-153.1	175.9	-164.3	142	1.4	110.6	L377 S381	L377-R379 PolarHBondContact O-N 2.9Å; R379-S381 PolarHBondContact O-N 3.3Å
380	R	44.8	Very low	49.9	Very low	240 Å²	240	119.6 Å²	119.6	91%	0.906	67%	0.67	S	S	*	*			trans	-75	113.9	164.5	-155.7	177.6	-170.9	-170.2	2.5	107	P378 S382	P378-R380 PolarHBondContact O-N 3.42Å; R380-S382 PolarHBondContact O-N 3.31Å
381	S	44	Very low	50.8	Low	113 Å²	113	119.3 Å²	119.3	79%	0.79	67%	0.668	S	S	*	*			trans	-63.1	101.9	-172.6	57.7	0	0	0	0	112	R379	R379-S381 PolarHBondContact O-N 3.3Å
382	S	53	Low	52.1	Low	81 Å²	81	120.2 Å²	120.2	57%	0.566	66%	0.663	S	S	*	*			trans	-100.2	140.5	152.4	64.8	0	0	0	0	108.6	R380 V384	R380-S382 PolarHBondContact O-N 3.31Å; S382-V384 PolarHBondContact O-N 3.29Å
383	S	57.4	Low	52.9	Low	85 Å²	85	120.7 Å²	120.7	59%	0.594	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-3.3	-175.9	47.1	0	0	0	0	114.6	G385 Y386 I387	S383-G385 VanDerWaalsContact C-N 3.35Å; S383-G385 PolarHBondContact O-N 3.37Å; S383-Y386 PolarHBondContact O-N 3.32Å; S383-I387 WeakPolarHBondContact O-CG1 3.47Å; S383-I387 PolarHBondContact O-N 3.25Å
384	V	56.5	Low	53.5	Low	93 Å²	93	118.3 Å²	118.3	56%	0.564	64%	0.642	S	S	*	*	H	α-helix	trans	-67.5	-34.5	-179	-177.6	0	0	0	0	111.7	S382 Y386 I387 A388	S382-V384 PolarHBondContact O-N 3.29Å; V384-Y386 VanDerWaalsContact C-N 3.32Å; V384-Y386 PolarHBondContact O-N 3.42Å; V384-I387 PolarHBondContact O-N 2.96Å; V384-A388 PolarHBondContact O-N 3.49Å
385	G	59.1	Low	54.3	Low	32 Å²	32	115 Å²	115	33%	0.33	63%	0.633	S	S	.	*	H	α-helix	trans	-65.2	-33.5	178.7	0	0	0	0	0	113.7	S383 A389	S383-G385 VanDerWaalsContact C-N 3.35Å; S383-G385 PolarHBondContact O-N 3.37Å; G385-A389 WeakPolarHBondContact O-CB 3.47Å; G385-A389 PolarHBondContact O-N 2.64Å
386	Y	57.1	Low	55.1	Low	191 Å²	191	118.4 Å²	118.4	75%	0.749	64%	0.635	S	S	*	*	H	α-helix	trans	-74.5	-31.7	175.2	-72	-74.1	0	0	0	112.2	S383 V384 A390	S383-Y386 PolarHBondContact O-N 3.32Å; V384-Y386 VanDerWaalsContact C-N 3.32Å; V384-Y386 PolarHBondContact O-N 3.42Å; Y386-A390 WeakPolarHBondContact O-CB 3.47Å; Y386-A390 PolarHBondContact O-N 2.99Å
387	I	62.3	Low	55.4	Low	106 Å²	106	115.1 Å²	115.1	54%	0.544	60%	0.6	S	S	.	*	H	α-helix	trans	-71.4	-46.3	177	-64.2	167.9	0	0	0	109.9	S383 V384 A390 E391	S383-I387 WeakPolarHBondContact O-CG1 3.47Å; S383-I387 PolarHBondContact O-N 3.25Å; V384-I387 PolarHBondContact O-N 2.96Å; I387-A390 PolarHBondContact O-N 3.42Å; I387-E391 WeakPolarHBondContact O-CB 3.26Å; I387-E391 PolarHBondContact O-N 3.23Å
388	A	62.1	Low	56.2	Low	52 Å²	52	110.5 Å²	110.5	43%	0.43	58%	0.581	S	S	.	*	H	α-helix	trans	-63.9	-42.2	175.8	0	0	0	0	0	112.1	V384 A390 E391 E392	V384-A388 PolarHBondContact O-N 3.49Å; A388-A390 VanDerWaalsContact C-N 3.32Å; A388-A390 PolarHBondContact O-N 3.19Å; A388-E391 PolarHBondContact O-N 3.02Å; A388-E392 WeakPolarHBondContact O-CB 3.5Å; A388-E392 PolarHBondContact O-N 2.63Å
389	A	59.3	Low	56.7	Low	54 Å²	54	114.4 Å²	114.4	45%	0.446	58%	0.58	S	S	.	*	H	α-helix	trans	-65.8	-34.5	175	0	0	0	0	0	112.4	G385 Y393	G385-A389 WeakPolarHBondContact O-CB 3.47Å; G385-A389 PolarHBondContact O-N 2.64Å; A389-Y393 VanDerWaalsContact O-CB 3.25Å; A389-Y393 WeakPolarHBondContact O-CB 3.22Å; A389-Y393 PolarHBondContact O-N 2.87Å
390	A	59.2	Low	57.7	Low	40 Å²	40	106.9 Å²	106.9	33%	0.331	56%	0.563	S	S	.	*	H	α-helix	trans	-69	-40.4	173.8	0	0	0	0	0	111.4	Y386 I387 A388 Y393 Y394	Y386-A390 WeakPolarHBondContact O-CB 3.47Å; Y386-A390 PolarHBondContact O-N 2.99Å; I387-A390 PolarHBondContact O-N 3.42Å; A388-A390 VanDerWaalsContact C-N 3.32Å; A388-A390 PolarHBondContact O-N 3.19Å; A390-Y393 CarbonylContact O-C 3.52Å; A390-Y393 WeakPolarHBondContact O-CB 3.42Å; A390-Y393 PolarHBondContact O-N 3.28Å; A390-Y394 HydrophobicContact CB-CE2 4.46Å; A390-Y394 WeakPolarHBondContact O-CD2 3.2Å; A390-Y394 PolarHBondContact O-N 3.14Å
391	E	62.9	Low	58.4	Low	139 Å²	139	100.6 Å²	100.6	65%	0.65	54%	0.544	S	S	*	.	H	α-helix	trans	-68.1	-37.2	179.1	-151.1	169.1	-156.9	0	0	112.1	I387 A388 Y394 S395	I387-E391 WeakPolarHBondContact O-CB 3.26Å; I387-E391 PolarHBondContact O-N 3.23Å; A388-E391 PolarHBondContact O-N 3.02Å; E391-Y394 PolarHBondContact O-N 2.89Å; E391-S395 WeakPolarHBondContact O-CB 3.45Å; E391-S395 PolarHBondContact O-N 3.16Å; E391-S395 PolarHBondContact O-OG 3.49Å
392	E	65.9	Low	59.2	Low	122 Å²	122	98 Å²	98	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-40.9	169.2	-166.6	175.4	-166.5	0	0	111.2	A388 Y394 S395 I396	A388-E392 WeakPolarHBondContact O-CB 3.5Å; A388-E392 PolarHBondContact O-N 2.63Å; E392-Y394 PolarHBondContact O-N 3.46Å; E392-S395 PolarHBondContact O-N 3.46Å; E392-S395 PolarHBondContact O-OG 2.91Å; E392-S395 VanDerWaalsContact O-OG 3.1Å; E392-I396 HydrophobicContact CG-CD1 3.67Å; E392-I396 HydrophobicContact CG-CG1 4.49Å; E392-I396 WeakPolarHBondContact O-CB 3.44Å; E392-I396 VanDerWaalsContact O-CG1 3.32Å; E392-I396 WeakPolarHBondContact O-CG1 3.43Å; E392-I396 PolarHBondContact O-N 3.36Å; E392-I396 VanDerWaalsContact O-N 3.11Å
393	Y	58.6	Low	59.5	Low	130 Å²	130	99.7 Å²	99.7	51%	0.51	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-33.4	175.8	-160	-93.2	0	0	0	113.2	A389 A390 K397	A389-Y393 VanDerWaalsContact O-CB 3.25Å; A389-Y393 WeakPolarHBondContact O-CB 3.22Å; A389-Y393 PolarHBondContact O-N 2.87Å; A390-Y393 CarbonylContact O-C 3.52Å; A390-Y393 WeakPolarHBondContact O-CB 3.42Å; A390-Y393 PolarHBondContact O-N 3.28Å; Y393-K397 HydrophobicContact CE1-CD 4.13Å; Y393-K397 WeakPolarHBondContact O-CB 3.28Å; Y393-K397 PolarHBondContact OH-NZ 3.3Å
394	Y	58	Low	59.4	Low	170 Å²	170	102 Å²	102	67%	0.667	52%	0.521	S	S	*	.	H	α-helix	trans	-78.7	-26	176.1	-80	-65.1	0	0	0	113.8	A390 E391 E392 L402	A390-Y394 HydrophobicContact CB-CE2 4.46Å; A390-Y394 WeakPolarHBondContact O-CD2 3.2Å; A390-Y394 PolarHBondContact O-N 3.14Å; E391-Y394 PolarHBondContact O-N 2.89Å; E392-Y394 PolarHBondContact O-N 3.46Å; Y394-L402 HydrophobicContact CD1-CD1 4.27Å; Y394-L402 HydrophobicContact CE1-CD1 4.32Å
395	S	57.3	Low	59.5	Low	95 Å²	95	102 Å²	102	66%	0.664	51%	0.514	S	S	*	.	H	α-helix	trans	-86.2	-31.5	-179.5	63.4	0	0	0	0	113.1	E391 E392	E391-S395 WeakPolarHBondContact O-CB 3.45Å; E391-S395 PolarHBondContact O-N 3.16Å; E391-S395 PolarHBondContact O-OG 3.49Å; E392-S395 PolarHBondContact O-N 3.46Å; E392-S395 PolarHBondContact O-OG 2.91Å; E392-S395 VanDerWaalsContact O-OG 3.1Å
396	I	61.4	Low	59.2	Low	132 Å²	132	110.5 Å²	110.5	68%	0.677	54%	0.537	S	S	*	.	H	α-helix	trans	-82.3	-30.3	-179.6	-63.8	173.2	0	0	0	112	E392	E392-I396 HydrophobicContact CG-CD1 3.67Å; E392-I396 HydrophobicContact CG-CG1 4.49Å; E392-I396 WeakPolarHBondContact O-CB 3.44Å; E392-I396 VanDerWaalsContact O-CG1 3.32Å; E392-I396 WeakPolarHBondContact O-CG1 3.43Å; E392-I396 PolarHBondContact O-N 3.36Å; E392-I396 VanDerWaalsContact O-N 3.11Å
397	K	53.8	Low	58.9	Low	37 Å²	37	106.7 Å²	106.7	16%	0.161	53%	0.526	C	S	.	.	S	Bend	trans	-98.8	122.7	-174.4	-152.3	171.7	-170.3	-177.8	0	111.7	Y393 E401 L402 E405	Y393-K397 HydrophobicContact CE1-CD 4.13Å; Y393-K397 WeakPolarHBondContact O-CB 3.28Å; Y393-K397 PolarHBondContact OH-NZ 3.3Å; K397-E401 HydrophobicContact CG-CB 4.1Å; K397-E401 WeakPolarHBondContact CG-OE2 3.44Å; K397-L402 HydrophobicContact CD-CD2 4.03Å; K397-L402 HydrophobicContact CD-CG 4.37Å; K397-E405 IonicContact NZ-OE1 2.82Å; K397-E405 PolarHBondContact NZ-OE1 2.98Å; K397-E405 VanDerWaalsContact NZ-OE1 3.08Å; K397-E405 IonicContact NZ-OE2 3.08Å; K397-E405 PolarHBondContact NZ-OE2 3.3Å
398	S	59.5	Low	58.6	Low	59 Å²	59	104.8 Å²	104.8	41%	0.413	52%	0.522	S	S	.	.			trans	-63.8	140.3	-179.7	74.1	0	0	0	0	111.5	S400 E401	S398-S400 PolarHBondContact O-N 3.02Å; S398-S400 PolarHBondContact OG-OG 3.02Å; S398-E401 PolarHBondContact O-N 3.3Å
399	R	57.6	Low	58.2	Low	203 Å²	203	110 Å²	110	77%	0.766	54%	0.537	S	S	*	.	H	α-helix	trans	-56.5	-22.2	-178.7	-171.3	176.7	157.3	91.5	0.6	113.6
400	S	61.1	Low	58	Low	70 Å²	70	118.2 Å²	118.2	49%	0.49	56%	0.557	S	S	.	*	H	α-helix	trans	-67.9	-41.8	171.7	27.3	0	0	0	0	113.2	S398 L402 M403 F404	S398-S400 PolarHBondContact O-N 3.02Å; S398-S400 PolarHBondContact OG-OG 3.02Å; S400-L402 PolarHBondContact O-N 3.3Å; S400-M403 PolarHBondContact O-N 2.94Å; S400-F404 WeakPolarHBondContact O-CD2 3.38Å; S400-F404 PolarHBondContact O-N 3.25Å
401	E	60.1	Low	57.6	Low	109 Å²	109	122.8 Å²	122.8	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-66.4	-36.6	-179.2	-95.1	-178.5	142.3	0	0	112.8	K397 S398 M403 F404 E405	K397-E401 HydrophobicContact CG-CB 4.1Å; K397-E401 WeakPolarHBondContact CG-OE2 3.44Å; S398-E401 PolarHBondContact O-N 3.3Å; E401-M403 VanDerWaalsContact C-N 3.29Å; E401-M403 PolarHBondContact O-N 3.5Å; E401-F404 PolarHBondContact O-N 3.36Å; E401-E405 PolarHBondContact O-N 3.26Å; E401-E405 VanDerWaalsContact O-N 3.14Å
402	L	61.5	Low	57.2	Low	58 Å²	58	120.3 Å²	120.3	30%	0.304	58%	0.582	S	S	.	*	H	α-helix	trans	-67.5	-27.7	178	-70.6	170.2	0	0	0	113.1	Y394 K397 S400	Y394-L402 HydrophobicContact CD1-CD1 4.27Å; Y394-L402 HydrophobicContact CE1-CD1 4.32Å; K397-L402 HydrophobicContact CD-CD2 4.03Å; K397-L402 HydrophobicContact CD-CG 4.37Å; S400-L402 PolarHBondContact O-N 3.3Å
403	M	58.1	Low	56.6	Low	117 Å²	117	121.5 Å²	121.5	58%	0.576	59%	0.592	S	S	*	*	H	α-helix	trans	-74.4	-34.7	175.8	-72	-86.5	-168.4	0	0	111.8	S400 E401	S400-M403 PolarHBondContact O-N 2.94Å; E401-M403 VanDerWaalsContact C-N 3.29Å; E401-M403 PolarHBondContact O-N 3.5Å
404	F	56	Low	56.2	Low	133 Å²	133	120.3 Å²	120.3	58%	0.583	60%	0.603	S	S	*	*	H	α-helix	trans	-83.2	-24.8	-178.3	-70.8	-66.5	0	0	0	113.9	S400 E401 Q407 S408	S400-F404 WeakPolarHBondContact O-CD2 3.38Å; S400-F404 PolarHBondContact O-N 3.25Å; E401-F404 PolarHBondContact O-N 3.36Å; F404-Q407 PolarHBondContact O-N 3.38Å; F404-Q407 VanDerWaalsContact O-N 3.15Å; F404-S408 PolarHBondContact O-N 3.34Å
405	E	58	Low	55.8	Low	92 Å²	92	121.6 Å²	121.6	43%	0.43	61%	0.612	S	S	.	*	H	α-helix	trans	-63.6	-45.9	-178.3	-160.8	160.2	-151	0	0	111.7	K397 E401 Q407 S408	K397-E405 IonicContact NZ-OE1 2.82Å; K397-E405 PolarHBondContact NZ-OE1 2.98Å; K397-E405 VanDerWaalsContact NZ-OE1 3.08Å; K397-E405 IonicContact NZ-OE2 3.08Å; K397-E405 PolarHBondContact NZ-OE2 3.3Å; E401-E405 PolarHBondContact O-N 3.26Å; E401-E405 VanDerWaalsContact O-N 3.14Å; E405-Q407 VanDerWaalsContact C-N 3.29Å; E405-Q407 PolarHBondContact O-N 3.23Å; E405-S408 PolarHBondContact O-N 3.28Å; E405-S408 PolarHBondContact O-OG 3.23Å
406	R	54.3	Low	55	Low	212 Å²	212	127.9 Å²	127.9	80%	0.8	62%	0.621	S	S	*	*	H	α-helix	trans	-73.7	-16.5	173.7	-80.3	-165.4	176.5	176.4	1.2	114.5
407	Q	50.5	Low	54.1	Low	111 Å²	111	127 Å²	127	52%	0.519	62%	0.623	S	S	.	*	H	α-helix	trans	-82.8	-31.2	176.2	-128	167.3	-12.2	0	0	111.5	F404 E405 E409 R410 H411	F404-Q407 PolarHBondContact O-N 3.38Å; F404-Q407 VanDerWaalsContact O-N 3.15Å; E405-Q407 VanDerWaalsContact C-N 3.29Å; E405-Q407 PolarHBondContact O-N 3.23Å; Q407-E409 VanDerWaalsContact C-N 3.28Å; Q407-E409 PolarHBondContact O-N 3.2Å; Q407-R410 PolarHBondContact O-N 3.06Å; Q407-H411 PolarHBondContact O-N 3.39Å
408	S	55.5	Low	53.3	Low	66 Å²	66	131.1 Å²	131.1	46%	0.462	65%	0.652	S	S	.	*	H	α-helix	trans	-66.9	-25.3	175.4	80.4	0	0	0	0	113.7	F404 E405 H411	F404-S408 PolarHBondContact O-N 3.34Å; E405-S408 PolarHBondContact O-N 3.28Å; E405-S408 PolarHBondContact O-OG 3.23Å; S408-H411 VanDerWaalsContact O-O 3.06Å
409	E	54.2	Low	52.4	Low	162 Å²	162	134.1 Å²	134.1	76%	0.757	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-21.5	175.1	-68.3	-174.5	155.7	0	0	113	Q407	Q407-E409 VanDerWaalsContact C-N 3.28Å; Q407-E409 PolarHBondContact O-N 3.2Å
410	R	55	Low	51.5	Low	226 Å²	226	128.5 Å²	128.5	85%	0.853	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-23.9	-175.3	-150	177.3	-157.2	-173.9	5.6	113.9	Q407	Q407-R410 PolarHBondContact O-N 3.06Å
411	H	50.8	Low	50.3	Low	136 Å²	136	130 Å²	130	63%	0.63	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	106.4	166.1	-74	-71.5	0	0	0	106.9	Q407 S408 L413	Q407-H411 PolarHBondContact O-N 3.39Å; S408-H411 VanDerWaalsContact O-O 3.06Å; H411-L413 PolarHBondContact O-N 3.32Å
412	G	54.5	Low	49.4	Very low	86 Å²	86	131 Å²	131	89%	0.887	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	68	-173.1	0	0	0	0	0	115.8	S414	G412-S414 PolarHBondContact O-N 2.91Å
413	L	52.9	Low	48.5	Very low	147 Å²	147	135 Å²	135	77%	0.77	71%	0.712	S	S	*	*			trans	-91.2	89.3	171.1	-75.8	165.4	0	0	0	106.3	H411 K415	H411-L413 PolarHBondContact O-N 3.32Å; L413-K415 PolarHBondContact O-N 2.99Å
414	S	51.1	Low	47.4	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	72%	0.719	S	S	*	*			trans	-44	132.7	163.5	172.7	0	0	0	0	109.7	G412 R416	G412-S414 PolarHBondContact O-N 2.91Å; S414-R416 PolarHBondContact O-N 3.38Å
415	K	47.7	Very low	46.7	Very low	196 Å²	196	137.3 Å²	137.3	85%	0.852	73%	0.732	S	S	*	*			trans	-46.7	110.7	163.8	-95.7	-179.1	175	176.4	0	107.7	L413 P417	L413-K415 PolarHBondContact O-N 2.99Å; K415-P417 WeakPolarHBondContact O-CD 3.45Å
416	R	41.7	Very low	45.9	Very low	227 Å²	227	138.5 Å²	138.5	86%	0.857	75%	0.745	S	S	*	*			trans	-71.2	118.2	167.9	-169.4	173.3	-172.7	155.4	0.8	105.4	S414 T418	S414-R416 PolarHBondContact O-N 3.38Å; R416-T418 PolarHBondContact O-N 3.01Å
417	P	42.3	Very low	45.7	Very low	113 Å²	113	138 Å²	138	73%	0.734	75%	0.752	S	S	*	*			trans	-63.4	111.6	167.1	23.9	-24.1	0	0	0	105.7	K415	K415-P417 WeakPolarHBondContact O-CD 3.45Å
418	T	36.2	Very low	45.5	Very low	125 Å²	125	136.5 Å²	136.5	77%	0.767	75%	0.754	S	S	*	*			trans	-55.5	128.7	159	34.4	0	0	0	0	105.9	R416 A420	R416-T418 PolarHBondContact O-N 3.01Å; T418-A420 PolarHBondContact O-N 2.92Å
419	P	41.3	Very low	45.3	Very low	121 Å²	121	141 Å²	141	79%	0.786	77%	0.772	S	S	*	*			trans	-62.8	112.9	173	26.2	-28.7	0	0	0	105.5	S421	P419-S421 PolarHBondContact O-N 3.19Å
420	A	39.1	Very low	45.3	Very low	85 Å²	85	134.5 Å²	134.5	70%	0.702	75%	0.749	S	S	*	*			trans	-48	117.1	156.6	0	0	0	0	0	105.2	T418 V422	T418-A420 PolarHBondContact O-N 2.92Å; A420-V422 VanDerWaalsContact C-N 3.3Å; A420-V422 PolarHBondContact O-N 2.87Å
421	S	35.9	Very low	45.3	Very low	102 Å²	102	126.3 Å²	126.3	71%	0.713	73%	0.73	S	S	*	*			trans	-57.5	108	167.7	50.3	0	0	0	0	105	P419 L423	P419-S421 PolarHBondContact O-N 3.19Å; S421-L423 PolarHBondContact O-N 3.35Å
422	V	41.3	Very low	45.5	Very low	129 Å²	129	126.7 Å²	126.7	78%	0.782	73%	0.734	S	S	*	*			trans	-61.3	97	168.3	175.7	0	0	0	0	104.6	A420 K424	A420-V422 VanDerWaalsContact C-N 3.3Å; A420-V422 PolarHBondContact O-N 2.87Å; V422-K424 PolarHBondContact O-N 3.32Å
423	L	41.1	Very low	45.8	Very low	143 Å²	143	127.8 Å²	127.8	75%	0.749	72%	0.719	S	S	*	*			trans	-59.1	109.3	164.9	-127.9	100	0	0	0	104.9	S421	S421-L423 PolarHBondContact O-N 3.35Å
424	K	35.8	Very low	46.1	Very low	166 Å²	166	128 Å²	128	72%	0.722	72%	0.716	S	S	*	*			trans	-56	139.7	165.2	-74.3	179.6	174.7	178.8	0	107.2	V422 V426	V422-K424 PolarHBondContact O-N 3.32Å; K424-V426 PolarHBondContact O-N 2.93Å
425	P	42.3	Very low	46.6	Very low	132 Å²	132	127.5 Å²	127.5	86%	0.857	71%	0.705	S	S	*	*			trans	-69	92.1	173.4	29	-30	0	0	0	107.1
426	V	40.9	Very low	47.4	Very low	118 Å²	118	125.7 Å²	125.7	72%	0.715	69%	0.694	S	S	*	*			trans	-89.1	115.3	162.1	177.6	0	0	0	0	104.5	K424 S428	K424-V426 PolarHBondContact O-N 2.93Å; V426-S428 PolarHBondContact O-N 3.45Å
427	E	50.1	Low	48.9	Very low	201 Å²	201	117 Å²	117	94%	0.939	68%	0.675	S	S	*	*			trans	-48.4	105.7	164.7	-68.6	174.4	154.4	0	0	108.6
428	S	45.2	Very low	50.3	Low	80 Å²	80	118.8 Å²	118.8	56%	0.559	67%	0.674	S	S	*	*			trans	-162	114.9	167.2	-176.3	0	0	0	0	108.6	V426 G430 A431	V426-S428 PolarHBondContact O-N 3.45Å; S428-G430 PolarHBondContact O-N 3.23Å; S428-G430 PolarHBondContact OG-N 3.27Å; S428-A431 PolarHBondContact O-N 2.9Å
429	D	52.6	Low	52.4	Low	159 Å²	159	117 Å²	117	85%	0.85	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.8	-17.9	164.3	-128.7	5.7	0	0	0	113
430	G	54.5	Low	54.4	Low	26 Å²	26	116.6 Å²	116.6	27%	0.268	64%	0.644	S	S	.	*	H	α-helix	trans	-85.6	-12.4	-172.8	0	0	0	0	0	118.4	S428 D433 Q434	S428-G430 PolarHBondContact O-N 3.23Å; S428-G430 PolarHBondContact OG-N 3.27Å; G430-D433 PolarHBondContact O-N 3.49Å; G430-Q434 PolarHBondContact O-N 3.49Å
431	A	54.9	Low	56.7	Low	54 Å²	54	116.3 Å²	116.3	45%	0.446	64%	0.635	S	S	.	*	H	α-helix	trans	-77.6	-35.3	-178.1	0	0	0	0	0	113	S428 D433 L435	S428-A431 PolarHBondContact O-N 2.9Å; A431-D433 VanDerWaalsContact C-N 3.35Å; A431-L435 PolarHBondContact O-N 2.88Å
432	M	54.1	Low	59	Low	144 Å²	144	114.7 Å²	114.7	71%	0.709	63%	0.628	S	S	*	*	H	α-helix	trans	-67.9	-37.5	168.6	-77.4	-69.6	-74.8	0	0	110.6	Q434 L435 Y436	M432-Q434 PolarHBondContact O-N 2.86Å; M432-L435 PolarHBondContact O-N 3.2Å; M432-Y436 WeakPolarHBondContact O-CB 3.39Å; M432-Y436 PolarHBondContact O-N 2.91Å
433	D	59.8	Low	61.2	Low	110 Å²	110	111.9 Å²	111.9	59%	0.588	61%	0.611	S	S	*	*	H	α-helix	trans	-65.3	-32.9	175.5	-81.4	-19.1	0	0	0	113.5	G430 A431 G437	G430-D433 PolarHBondContact O-N 3.49Å; A431-D433 VanDerWaalsContact C-N 3.35Å; D433-G437 WeakPolarHBondContact O-CA 3.46Å; D433-G437 PolarHBondContact O-N 2.85Å
434	Q	60.6	Low	63.4	Low	151 Å²	151	109 Å²	109	71%	0.706	60%	0.597	S	S	*	*	H	α-helix	trans	-69.1	-45.9	173.8	-87.9	-178.4	-23.5	0	0	112.5	G430 M432 Y436 G437 E438	G430-Q434 PolarHBondContact O-N 3.49Å; M432-Q434 PolarHBondContact O-N 2.86Å; Q434-Y436 VanDerWaalsContact C-N 3.32Å; Q434-G437 PolarHBondContact O-N 3.19Å; Q434-E438 PolarHBondContact O-N 3.29Å
435	L	61.7	Low	66	Low	96 Å²	96	102.6 Å²	102.6	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-65.1	-39.2	175.8	-166.9	80.5	0	0	0	111.1	A431 M432 G437 E438 I439	A431-L435 PolarHBondContact O-N 2.88Å; M432-L435 PolarHBondContact O-N 3.2Å; L435-G437 VanDerWaalsContact C-N 3.33Å; L435-E438 PolarHBondContact O-N 2.94Å; L435-I439 HydrophobicContact CD1-CD1 4.37Å; L435-I439 HydrophobicContact CD2-CD1 4.17Å; L435-I439 HydrophobicContact CG-CD1 3.81Å; L435-I439 WeakPolarHBondContact O-CB 3.44Å; L435-I439 VanDerWaalsContact O-CG1 3.3Å; L435-I439 WeakPolarHBondContact O-CG1 3.41Å; L435-I439 PolarHBondContact O-N 3.49Å
436	Y	65.1	Low	68.2	Low	158 Å²	158	98.6 Å²	98.6	62%	0.62	56%	0.555	S	S	*	*	H	α-helix	trans	-66	-36.8	173.6	-153.6	-96.9	0	0	0	111.1	M432 Q434 E438 K440	M432-Y436 WeakPolarHBondContact O-CB 3.39Å; M432-Y436 PolarHBondContact O-N 2.91Å; Q434-Y436 VanDerWaalsContact C-N 3.32Å; Y436-E438 VanDerWaalsContact C-N 3.34Å; Y436-E438 PolarHBondContact O-N 3.43Å; Y436-K440 HydrophobicContact CD1-CD 4.45Å; Y436-K440 HydrophobicContact CE1-CD 4.32Å; Y436-K440 WeakPolarHBondContact O-CB 3.31Å; Y436-K440 PolarHBondContact O-N 3.1Å
437	G	72.1	Confident	70.6	Confident	45 Å²	45	97.4 Å²	97.4	46%	0.464	55%	0.545	S	S	.	.	H	α-helix	trans	-65.5	-30.3	174.6	0	0	0	0	0	114.3	D433 Q434 L435 P441	D433-G437 WeakPolarHBondContact O-CA 3.46Å; D433-G437 PolarHBondContact O-N 2.85Å; Q434-G437 PolarHBondContact O-N 3.19Å; L435-G437 VanDerWaalsContact C-N 3.33Å; G437-P441 WeakPolarHBondContact O-CD 3.48Å
438	E	72.4	Confident	72.7	Confident	150 Å²	150	95.3 Å²	95.3	70%	0.701	53%	0.53	S	S	*	.	H	α-helix	trans	-86	-35.6	175.5	-72.2	-174.1	175	0	0	113.3	Q434 L435 Y436 P441	Q434-E438 PolarHBondContact O-N 3.29Å; L435-E438 PolarHBondContact O-N 2.94Å; Y436-E438 VanDerWaalsContact C-N 3.34Å; Y436-E438 PolarHBondContact O-N 3.43Å; E438-P441 WeakPolarHBondContact O-CD 3.42Å; E438-P441 WeakPolarHBondContact O-CG 3.42Å
439	I	80.5	Confident	74.9	Confident	87 Å²	87	96.2 Å²	96.2	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-80.5	-36	-179.1	-67.8	172.9	0	0	0	111.9	L435 A442 V443	L435-I439 HydrophobicContact CD1-CD1 4.37Å; L435-I439 HydrophobicContact CD2-CD1 4.17Å; L435-I439 HydrophobicContact CG-CD1 3.81Å; L435-I439 WeakPolarHBondContact O-CB 3.44Å; L435-I439 VanDerWaalsContact O-CG1 3.3Å; L435-I439 WeakPolarHBondContact O-CG1 3.41Å; L435-I439 PolarHBondContact O-N 3.49Å; I439-A442 WeakPolarHBondContact O-CB 3.4Å; I439-A442 PolarHBondContact O-N 3.4Å; I439-V443 HydrophobicContact CG2-CG2 3.76Å; I439-V443 WeakPolarHBondContact O-CG2 3.12Å; I439-V443 PolarHBondContact O-N 3.33Å
440	K	83.2	Confident	76.8	Confident	112 Å²	112	93.2 Å²	93.2	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-53.1	-49.1	180	-177.6	173.8	-175.5	-180	0	114	Y436 A442 V443 D444	Y436-K440 HydrophobicContact CD1-CD 4.45Å; Y436-K440 HydrophobicContact CE1-CD 4.32Å; Y436-K440 WeakPolarHBondContact O-CB 3.31Å; Y436-K440 PolarHBondContact O-N 3.1Å; K440-A442 VanDerWaalsContact C-N 3.28Å; K440-A442 PolarHBondContact O-N 2.79Å; K440-V443 PolarHBondContact O-N 3.43Å; K440-D444 WeakPolarHBondContact CG-OD2 3.4Å; K440-D444 WeakPolarHBondContact O-CB 3.46Å; K440-D444 PolarHBondContact O-N 3.3Å
441	P	85.8	Confident	78.5	Confident	79 Å²	79	97.8 Å²	97.8	51%	0.513	53%	0.529	S	S	.	.	H	α-helix	trans	-65.4	-28.7	177.1	24.8	-34.1	0	0	0	113.3	G437 E438 G445	G437-P441 WeakPolarHBondContact O-CD 3.48Å; E438-P441 WeakPolarHBondContact O-CD 3.42Å; E438-P441 WeakPolarHBondContact O-CG 3.42Å; P441-G445 PolarHBondContact O-N 2.9Å
442	A	84.8	Confident	80.3	Confident	68 Å²	68	100 Å²	100	56%	0.562	53%	0.529	S	S	*	.	H	α-helix	trans	-72.8	-40.1	174.9	0	0	0	0	0	111.9	I439 K440 G445 A446	I439-A442 WeakPolarHBondContact O-CB 3.4Å; I439-A442 PolarHBondContact O-N 3.4Å; K440-A442 VanDerWaalsContact C-N 3.28Å; K440-A442 PolarHBondContact O-N 2.79Å; A442-G445 PolarHBondContact O-N 3.49Å; A442-A446 WeakPolarHBondContact O-CB 3.31Å; A442-A446 PolarHBondContact O-N 3.25Å
443	V	87.7	Confident	81.9	Confident	70 Å²	70	99.1 Å²	99.1	42%	0.424	53%	0.525	S	S	.	.	H	α-helix	trans	-68.1	-42.5	173.9	173.6	0	0	0	0	111	I439 K440 G445 A446 N447	I439-V443 HydrophobicContact CG2-CG2 3.76Å; I439-V443 WeakPolarHBondContact O-CG2 3.12Å; I439-V443 PolarHBondContact O-N 3.33Å; K440-V443 PolarHBondContact O-N 3.43Å; V443-G445 VanDerWaalsContact C-N 3.31Å; V443-G445 PolarHBondContact O-N 3.32Å; V443-A446 PolarHBondContact O-N 2.96Å; V443-N447 WeakPolarHBondContact O-CB 3.19Å; V443-N447 VanDerWaalsContact O-CG 3.27Å; V443-N447 PolarHBondContact O-N 3.47Å; V443-N447 PolarHBondContact O-ND2 3.05Å
444	D	86.8	Confident	83.4	Confident	84 Å²	84	99.2 Å²	99.2	45%	0.449	52%	0.522	S	S	.	.	H	α-helix	trans	-63.9	-38.7	174.9	-69.8	-21.6	0	0	0	110.9	K440 N447 Y448	K440-D444 WeakPolarHBondContact CG-OD2 3.4Å; K440-D444 WeakPolarHBondContact O-CB 3.46Å; K440-D444 PolarHBondContact O-N 3.3Å; D444-N447 PolarHBondContact O-N 3.23Å; D444-Y448 WeakPolarHBondContact O-CB 3.2Å; D444-Y448 PolarHBondContact O-N 3.48Å
445	G	90.1	Very high	84.7	Confident	30 Å²	30	96.4 Å²	96.4	31%	0.309	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-43.7	172.3	0	0	0	0	0	113	P441 A442 V443 Y448 I449	P441-G445 PolarHBondContact O-N 2.9Å; A442-G445 PolarHBondContact O-N 3.49Å; V443-G445 VanDerWaalsContact C-N 3.31Å; V443-G445 PolarHBondContact O-N 3.32Å; G445-Y448 PolarHBondContact O-N 3.22Å; G445-I449 VanDerWaalsContact O-CG1 3.27Å; G445-I449 WeakPolarHBondContact O-CG1 3.39Å; G445-I449 PolarHBondContact O-N 3.12Å
446	A	89.8	Confident	86	Confident	49 Å²	49	97.8 Å²	97.8	41%	0.405	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-43.8	175	0	0	0	0	0	111.8	A442 V443 Y448 I449 V450	A442-A446 WeakPolarHBondContact O-CB 3.31Å; A442-A446 PolarHBondContact O-N 3.25Å; V443-A446 PolarHBondContact O-N 2.96Å; A446-Y448 VanDerWaalsContact C-N 3.32Å; A446-Y448 PolarHBondContact O-N 2.95Å; A446-I449 PolarHBondContact O-N 2.87Å; A446-V450 WeakPolarHBondContact O-CG2 3.41Å; A446-V450 PolarHBondContact O-N 3.38Å
447	N	90.8	Very high	87.1	Confident	92 Å²	92	95.3 Å²	95.3	49%	0.492	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-40.3	175	-74.9	-22.8	0	0	0	111.6	V443 D444 V450 Q451	V443-N447 WeakPolarHBondContact O-CB 3.19Å; V443-N447 VanDerWaalsContact O-CG 3.27Å; V443-N447 PolarHBondContact O-N 3.47Å; V443-N447 PolarHBondContact O-ND2 3.05Å; D444-N447 PolarHBondContact O-N 3.23Å; N447-V450 PolarHBondContact O-N 3.04Å; N447-Q451 VanDerWaalsContact O-CB 3.29Å; N447-Q451 WeakPolarHBondContact O-CB 3Å; N447-Q451 PolarHBondContact O-N 2.89Å
448	Y	93.5	Very high	87.8	Confident	158 Å²	158	96.3 Å²	96.3	62%	0.62	51%	0.506	S	S	*	.	H	α-helix	trans	-62.9	-42.7	173.9	179.2	-95.6	0	0	0	112	D444 G445 A446 Q451 H452	D444-Y448 WeakPolarHBondContact O-CB 3.2Å; D444-Y448 PolarHBondContact O-N 3.48Å; G445-Y448 PolarHBondContact O-N 3.22Å; A446-Y448 VanDerWaalsContact C-N 3.32Å; A446-Y448 PolarHBondContact O-N 2.95Å; Y448-Q451 PolarHBondContact O-N 3.41Å; Y448-H452 WeakPolarHBondContact O-CB 3.38Å; Y448-H452 PolarHBondContact O-N 3.37Å
449	I	91.8	Very high	88.6	Confident	99 Å²	99	93.1 Å²	93.1	51%	0.508	49%	0.488	S	S	.	.	H	α-helix	trans	-63	-46.6	176.3	-68	163.2	0	0	0	110.4	G445 A446 Q451 H452 M453	G445-I449 VanDerWaalsContact O-CG1 3.27Å; G445-I449 WeakPolarHBondContact O-CG1 3.39Å; G445-I449 PolarHBondContact O-N 3.12Å; A446-I449 PolarHBondContact O-N 2.87Å; I449-Q451 VanDerWaalsContact C-N 3.35Å; I449-Q451 PolarHBondContact O-N 3.06Å; I449-H452 PolarHBondContact O-N 3.42Å; I449-M453 HydrophobicContact CG2-CG 4.35Å; I449-M453 HydrophobicContact CG2-SD 4.04Å; I449-M453 WeakPolarHBondContact O-CB 3.23Å; I449-M453 VanDerWaalsContact O-CG 3.28Å; I449-M453 WeakPolarHBondContact O-CG 3.44Å; I449-M453 PolarHBondContact O-N 3.43Å
450	V	92.6	Very high	88.9	Confident	95 Å²	95	92 Å²	92	58%	0.576	48%	0.483	S	S	*	.	H	α-helix	trans	-60.2	-46	177.6	171.4	0	0	0	0	110.7	A446 N447 H452 M453 H454	A446-V450 WeakPolarHBondContact O-CG2 3.41Å; A446-V450 PolarHBondContact O-N 3.38Å; N447-V450 PolarHBondContact O-N 3.04Å; V450-H452 PolarHBondContact O-N 2.87Å; V450-M453 PolarHBondContact O-N 3.48Å; V450-H454 PolarHBondContact O-N 3.43Å
451	Q	91.2	Very high	89	Confident	123 Å²	123	92.1 Å²	92.1	58%	0.575	49%	0.485	S	S	*	.	H	α-helix	trans	-67.2	-37.2	178.6	-169.7	166.7	9.1	0	0	112.2	N447 Y448 I449 H454 N455	N447-Q451 VanDerWaalsContact O-CB 3.29Å; N447-Q451 WeakPolarHBondContact O-CB 3Å; N447-Q451 PolarHBondContact O-N 2.89Å; Y448-Q451 PolarHBondContact O-N 3.41Å; I449-Q451 VanDerWaalsContact C-N 3.35Å; I449-Q451 PolarHBondContact O-N 3.06Å; Q451-H454 PolarHBondContact O-N 3.28Å; Q451-N455 WeakPolarHBondContact O-CB 3.45Å; Q451-N455 PolarHBondContact O-N 3.15Å; Q451-N455 PolarHBondContact O-ND2 2.97Å
452	H	91.2	Very high	89	Confident	99 Å²	99	90.8 Å²	90.8	46%	0.458	47%	0.472	S	S	.	.	H	α-helix	trans	-66.6	-39.5	173.8	-174.1	77.3	0	0	0	111.8	Y448 I449 V450 K456	Y448-H452 WeakPolarHBondContact O-CB 3.38Å; Y448-H452 PolarHBondContact O-N 3.37Å; I449-H452 PolarHBondContact O-N 3.42Å; V450-H452 PolarHBondContact O-N 2.87Å; H452-K456 WeakPolarHBondContact O-CB 3.34Å; H452-K456 PolarHBondContact O-N 3.04Å
453	M	88.4	Confident	89	Confident	126 Å²	126	92.3 Å²	92.3	62%	0.621	47%	0.466	S	S	*	.	H	α-helix	trans	-63.4	-43.9	173.9	-75.9	-178.8	66.5	0	0	111.3	I449 V450 K456 N457	I449-M453 HydrophobicContact CG2-CG 4.35Å; I449-M453 HydrophobicContact CG2-SD 4.04Å; I449-M453 WeakPolarHBondContact O-CB 3.23Å; I449-M453 VanDerWaalsContact O-CG 3.28Å; I449-M453 WeakPolarHBondContact O-CG 3.44Å; I449-M453 PolarHBondContact O-N 3.43Å; V450-M453 PolarHBondContact O-N 3.48Å; M453-K456 PolarHBondContact O-N 3.43Å; M453-N457 WeakPolarHBondContact O-CB 3.33Å; M453-N457 PolarHBondContact O-N 2.69Å
454	H	91.5	Very high	88.9	Confident	113 Å²	113	93.7 Å²	93.7	52%	0.523	47%	0.471	S	S	.	.	H	α-helix	trans	-61.7	-52.7	176.2	-167.4	-68.6	0	0	0	111.4	V450 Q451 K456 N457 D458	V450-H454 PolarHBondContact O-N 3.43Å; Q451-H454 PolarHBondContact O-N 3.28Å; H454-K456 PolarHBondContact O-N 3.11Å; H454-N457 WeakPolarHBondContact O-CA 3.49Å; H454-N457 WeakPolarHBondContact O-CB 3.32Å; H454-N457 PolarHBondContact O-N 3.42Å; H454-D458 IonicContact CE1-OD1 3.37Å; H454-D458 PolarHBondContact CE1-OD1 2.81Å; H454-D458 VanDerWaalsContact CE1-OD1 3.23Å; H454-D458 IonicContact CE1-OD2 3.2Å; H454-D458 PolarHBondContact CE1-OD2 3.34Å; H454-D458 IonicContact ND1-OD1 3.17Å; H454-D458 PolarHBondContact ND1-OD1 3.4Å; H454-D458 IonicContact ND1-OD2 2.78Å; H454-D458 PolarHBondContact ND1-OD2 3.14Å; H454-D458 VanDerWaalsContact O-CG 3.28Å; H454-D458 PolarHBondContact O-N 3.1Å
455	N	88.8	Confident	88.9	Confident	92 Å²	92	92 Å²	92	49%	0.492	46%	0.462	S	S	.	.	H	α-helix	trans	-59.4	-35.4	178.6	-69.5	-16.9	0	0	0	112.4	Q451 Y459	Q451-N455 WeakPolarHBondContact O-CB 3.45Å; Q451-N455 PolarHBondContact O-N 3.15Å; Q451-N455 PolarHBondContact O-ND2 2.97Å; N455-Y459 VanDerWaalsContact O-CB 3.31Å; N455-Y459 WeakPolarHBondContact O-CB 3.33Å; N455-Y459 PolarHBondContact O-N 3.39Å
456	K	87.5	Confident	88.8	Confident	124 Å²	124	90.9 Å²	90.9	54%	0.539	45%	0.448	S	S	.	.	H	α-helix	trans	-70.3	-36.1	175	-177.5	169.6	-177.6	166.3	0	111.9	H452 M453 H454 N460	H452-K456 WeakPolarHBondContact O-CB 3.34Å; H452-K456 PolarHBondContact O-N 3.04Å; M453-K456 PolarHBondContact O-N 3.43Å; H454-K456 PolarHBondContact O-N 3.11Å; K456-N460 WeakPolarHBondContact O-CB 3.46Å; K456-N460 PolarHBondContact O-N 3.45Å; K456-N460 PolarHBondContact O-ND2 3.41Å
457	N	89.3	Confident	88.7	Confident	106 Å²	106	89 Å²	89	57%	0.567	43%	0.432	S	S	*	.	H	α-helix	trans	-67	-47.9	175.7	-156.2	45.4	0	0	0	110.9	M453 H454 Y459 N460 E461	M453-N457 WeakPolarHBondContact O-CB 3.33Å; M453-N457 PolarHBondContact O-N 2.69Å; H454-N457 WeakPolarHBondContact O-CA 3.49Å; H454-N457 WeakPolarHBondContact O-CB 3.32Å; H454-N457 PolarHBondContact O-N 3.42Å; N457-Y459 VanDerWaalsContact C-N 3.27Å; N457-Y459 PolarHBondContact O-N 3.29Å; N457-N460 WeakPolarHBondContact O-CB 3.5Å; N457-N460 PolarHBondContact O-N 2.98Å; N457-E461 PolarHBondContact O-N 3.41Å
458	D	86.9	Confident	88.4	Confident	66 Å²	66	85.1 Å²	85.1	35%	0.353	41%	0.414	S	S	.	.	H	α-helix	trans	-57.7	-41.7	175.7	-58.6	-24.9	0	0	0	111.3	H454 N460 E461 E462	H454-D458 IonicContact CE1-OD1 3.37Å; H454-D458 PolarHBondContact CE1-OD1 2.81Å; H454-D458 VanDerWaalsContact CE1-OD1 3.23Å; H454-D458 IonicContact CE1-OD2 3.2Å; H454-D458 PolarHBondContact CE1-OD2 3.34Å; H454-D458 IonicContact ND1-OD1 3.17Å; H454-D458 PolarHBondContact ND1-OD1 3.4Å; H454-D458 IonicContact ND1-OD2 2.78Å; H454-D458 PolarHBondContact ND1-OD2 3.14Å; H454-D458 VanDerWaalsContact O-CG 3.28Å; H454-D458 PolarHBondContact O-N 3.1Å; D458-N460 PolarHBondContact O-N 3.23Å; D458-E461 PolarHBondContact O-N 3.15Å; D458-E462 PolarHBondContact O-N 3.4Å
459	Y	87.9	Confident	88.1	Confident	84 Å²	84	77.6 Å²	77.6	33%	0.329	39%	0.385	S	S	.	.	H	α-helix	trans	-62.7	-41.7	175.9	-177.2	-86.4	0	0	0	112.4	T339 P340 N455 N457 K463	T339-Y459 WeakPolarHBondContact CB-OH 3.42Å; T339-Y459 WeakPolarHBondContact CG2-OH 3.29Å; P340-Y459 HydrophobicContact CB-CD2 3.94Å; P340-Y459 HydrophobicContact CB-CE2 4.05Å; P340-Y459 HydrophobicContact CG-CD2 3.71Å; P340-Y459 HydrophobicContact CG-CE2 3.88Å; P340-Y459 HydrophobicContact CG-CG 4.27Å; N455-Y459 VanDerWaalsContact O-CB 3.31Å; N455-Y459 WeakPolarHBondContact O-CB 3.33Å; N455-Y459 PolarHBondContact O-N 3.39Å; N457-Y459 VanDerWaalsContact C-N 3.27Å; N457-Y459 PolarHBondContact O-N 3.29Å; Y459-K463 WeakPolarHBondContact O-CB 3.32Å; Y459-K463 PolarHBondContact O-N 2.77Å; Y459-K463 VanDerWaalsContact O-N 3.1Å
460	N	86.4	Confident	88	Confident	63 Å²	63	73 Å²	73	34%	0.337	36%	0.361	S	S	.	.	H	α-helix	trans	-68.8	-41	177.7	-72	-21.7	0	0	0	111.3	K456 N457 D458 E462 K463 D464	K456-N460 WeakPolarHBondContact O-CB 3.46Å; K456-N460 PolarHBondContact O-N 3.45Å; K456-N460 PolarHBondContact O-ND2 3.41Å; N457-N460 WeakPolarHBondContact O-CB 3.5Å; N457-N460 PolarHBondContact O-N 2.98Å; D458-N460 PolarHBondContact O-N 3.23Å; N460-E462 PolarHBondContact O-N 3.17Å; N460-K463 WeakPolarHBondContact O-CB 3.48Å; N460-K463 PolarHBondContact O-N 3.04Å; N460-D464 WeakPolarHBondContact O-CB 3.25Å; N460-D464 VanDerWaalsContact O-CG 3.3Å; N460-D464 PolarHBondContact O-N 3.4Å
461	E	86.9	Confident	87.7	Confident	114 Å²	114	74.8 Å²	74.8	53%	0.533	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-45.5	178	-169.5	-171	157	0	0	111.3	N457 D458 K463 D464 N465	N457-E461 PolarHBondContact O-N 3.41Å; D458-E461 PolarHBondContact O-N 3.15Å; E461-K463 VanDerWaalsContact C-N 3.34Å; E461-K463 PolarHBondContact O-N 3.42Å; E461-D464 PolarHBondContact O-N 3.1Å; E461-N465 WeakPolarHBondContact O-CB 3.42Å; E461-N465 VanDerWaalsContact O-CG 3.28Å; E461-N465 PolarHBondContact O-N 3.02Å; E461-N465 PolarHBondContact O-ND2 3.3Å
462	E	85.1	Confident	87.6	Confident	51 Å²	51	69.2 Å²	69.2	24%	0.238	33%	0.332	C	S	.	.	H	α-helix	trans	-67.6	-35.3	176.9	-173.6	173.1	-169.6	0	0	112	P340 M345 D458 N460 N465 W466	P340-E462 VanDerWaalsContact CB-OE2 3.3Å; P340-E462 WeakPolarHBondContact CB-OE2 3.44Å; P340-E462 HydrophobicContact CG-CB 3.76Å; P340-E462 HydrophobicContact CG-CG 3.83Å; P340-E462 WeakPolarHBondContact CG-OE2 3.39Å; M345-E462 HydrophobicContact CE-CG 4.17Å; D458-E462 PolarHBondContact O-N 3.4Å; N460-E462 PolarHBondContact O-N 3.17Å; E462-N465 WeakPolarHBondContact O-CB 3.49Å; E462-N465 PolarHBondContact O-N 3.48Å; E462-W466 PolarHBondContact O-N 2.96Å
463	K	85.1	Confident	87.5	Confident	100 Å²	100	65.3 Å²	65.3	44%	0.435	32%	0.315	S	S	.	.	H	α-helix	trans	-64	-42.3	172.4	-176.8	-174.1	174	-170.7	0	112	Y459 N460 E461 N465 W466 S467	Y459-K463 WeakPolarHBondContact O-CB 3.32Å; Y459-K463 PolarHBondContact O-N 2.77Å; Y459-K463 VanDerWaalsContact O-N 3.1Å; N460-K463 WeakPolarHBondContact O-CB 3.48Å; N460-K463 PolarHBondContact O-N 3.04Å; E461-K463 VanDerWaalsContact C-N 3.34Å; E461-K463 PolarHBondContact O-N 3.42Å; K463-N465 VanDerWaalsContact C-N 3.31Å; K463-N465 PolarHBondContact O-N 3.06Å; K463-W466 PolarHBondContact O-N 3.47Å; K463-S467 PolarHBondContact O-N 3.23Å
464	D	85.4	Confident	87.7	Confident	100 Å²	100	59.8 Å²	59.8	54%	0.535	29%	0.288	S	S	.	.	H	α-helix	trans	-66.5	-36	177.7	-73.5	-18.2	0	0	0	111.2	N460 E461 S467 G468	N460-D464 WeakPolarHBondContact O-CB 3.25Å; N460-D464 VanDerWaalsContact O-CG 3.3Å; N460-D464 PolarHBondContact O-N 3.4Å; E461-D464 PolarHBondContact O-N 3.1Å; D464-S467 PolarHBondContact O-N 2.91Å; D464-G468 PolarHBondContact O-N 3.49Å
465	N	87.4	Confident	87.6	Confident	47 Å²	47	58.4 Å²	58.4	25%	0.251	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-43.7	170.8	-76.2	-42.7	0	0	0	112.3	M345 L354 E461 E462 K463 G468 I469	M345-N465 HydrophobicContact CE-CB 3.43Å; M345-N465 VanDerWaalsContact CE-CB 3.43Å; M345-N465 HydrophobicContact SD-CB 4.33Å; L354-N465 HydrophobicContact CD1-CB 4.13Å; E461-N465 WeakPolarHBondContact O-CB 3.42Å; E461-N465 VanDerWaalsContact O-CG 3.28Å; E461-N465 PolarHBondContact O-N 3.02Å; E461-N465 PolarHBondContact O-ND2 3.3Å; E462-N465 WeakPolarHBondContact O-CB 3.49Å; E462-N465 PolarHBondContact O-N 3.48Å; K463-N465 VanDerWaalsContact C-N 3.31Å; K463-N465 PolarHBondContact O-N 3.06Å; N465-G468 PolarHBondContact O-N 2.94Å; N465-I469 WeakPolarHBondContact O-CG1 3.32Å; N465-I469 PolarHBondContact O-N 3.22Å
466	W	87.9	Confident	87.6	Confident	7 Å²	7	56.5 Å²	56.5	3%	0.027	27%	0.267	C	S	.	.	H	α-helix	trans	-62.7	-41.8	173.4	-81.7	110.9	0	0	0	112.6	L335 R338 H343 M345 E462 K463 G468 I469 A470	L335-W466 HydrophobicContact CD2-CE3 4.42Å; L335-W466 HydrophobicContact CD2-CZ3 3.9Å; R338-W466 HydrophobicContact CB-CD2 3.74Å; R338-W466 HydrophobicContact CB-CE3 4.02Å; R338-W466 HydrophobicContact CB-CG 3.98Å; R338-W466 VanDerWaalsContact CD-CZ3 3.47Å; H343-W466 HydrophobicContact CB-CZ2 4.23Å; M345-W466 HydrophobicContact CB-CZ2 3.82Å; M345-W466 HydrophobicContact CG-CZ2 4.19Å; M345-W466 HydrophobicContact SD-CD2 4.46Å; E462-W466 PolarHBondContact O-N 2.96Å; K463-W466 PolarHBondContact O-N 3.47Å; W466-G468 VanDerWaalsContact C-N 3.32Å; W466-G468 PolarHBondContact O-N 2.96Å; W466-I469 HydrophobicContact CE3-CD1 4.38Å; W466-I469 PolarHBondContact O-N 3.24Å; W466-A470 PolarHBondContact O-N 2.86Å
467	S	86.4	Confident	87.8	Confident	9 Å²	9	51.2 Å²	51.2	6%	0.063	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-39.4	173.4	-177.3	0	0	0	0	111.6	H336 K463 D464 A470 R471	H336-S467 PolarHBondContact CD2-OG 3.39Å; H336-S467 PolarHBondContact NE2-OG 3.23Å; H336-S467 VanDerWaalsContact NE2-OG 3.12Å; K463-S467 PolarHBondContact O-N 3.23Å; D464-S467 PolarHBondContact O-N 2.91Å; S467-A470 PolarHBondContact O-N 2.81Å; S467-R471 WeakPolarHBondContact O-CG 3.5Å; S467-R471 PolarHBondContact O-N 3.1Å; S467-R471 PolarHBondContact OG-NE 3.48Å; S467-R471 PolarHBondContact OG-NH2 3.12Å
468	G	84.2	Confident	87.9	Confident	11 Å²	11	47.8 Å²	47.8	11%	0.113	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-48	172.7	0	0	0	0	0	112.2	D464 N465 W466 A470 R471 T472	D464-G468 PolarHBondContact O-N 3.49Å; N465-G468 PolarHBondContact O-N 2.94Å; W466-G468 VanDerWaalsContact C-N 3.32Å; W466-G468 PolarHBondContact O-N 2.96Å; G468-A470 VanDerWaalsContact C-N 3.34Å; G468-A470 PolarHBondContact O-N 3.21Å; G468-R471 PolarHBondContact O-N 3.49Å; G468-T472 VanDerWaalsContact O-CG2 3.28Å; G468-T472 WeakPolarHBondContact O-CG2 3.34Å; G468-T472 PolarHBondContact O-N 3.34Å
469	I	88.3	Confident	88.1	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-60.2	-43.2	175.7	-67.4	168.9	0	0	0	111.3	M345 T349 F353 L354 N465 W466 R471 T472 V473	M345-I469 HydrophobicContact SD-CD1 3.36Å; M345-I469 WeakPolarHBondContact SD-CD1 3.43Å; T349-I469 HydrophobicContact CG2-CD1 4.12Å; F353-I469 HydrophobicContact CB-CB 4.33Å; F353-I469 HydrophobicContact CB-CG1 3.81Å; F353-I469 HydrophobicContact CB-CG2 4Å; F353-I469 HydrophobicContact CD1-CG2 4.27Å; F353-I469 HydrophobicContact CD2-CG2 4.24Å; F353-I469 HydrophobicContact CG-CG2 3.92Å; L354-I469 HydrophobicContact CD2-CG1 4.01Å; L354-I469 HydrophobicContact CG-CG1 4.05Å; N465-I469 WeakPolarHBondContact O-CG1 3.32Å; N465-I469 PolarHBondContact O-N 3.22Å; W466-I469 HydrophobicContact CE3-CD1 4.38Å; W466-I469 PolarHBondContact O-N 3.24Å; I469-R471 VanDerWaalsContact C-N 3.33Å; I469-R471 PolarHBondContact O-N 3.47Å; I469-T472 WeakPolarHBondContact CA-OG1 3.5Å; I469-T472 PolarHBondContact O-N 3.4Å; I469-T472 PolarHBondContact O-OG1 3.08Å; I469-V473 HydrophobicContact CG2-CG2 4.38Å; I469-V473 VanDerWaalsContact O-CG2 3.32Å; I469-V473 WeakPolarHBondContact O-CG2 3.36Å; I469-V473 PolarHBondContact O-N 3.29Å
470	A	88.8	Confident	88.2	Confident	1 Å²	1	51 Å²	51	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-43.1	177.4	0	0	0	0	0	111.7	V332 L335 H336 W466 S467 G468 T472 V473 D474	V332-A470 HydrophobicContact CG1-CB 4.09Å; L335-A470 HydrophobicContact CB-CB 4.21Å; H336-A470 HydrophobicContact CB-CB 3.78Å; W466-A470 PolarHBondContact O-N 2.86Å; S467-A470 PolarHBondContact O-N 2.81Å; G468-A470 VanDerWaalsContact C-N 3.34Å; G468-A470 PolarHBondContact O-N 3.21Å; A470-T472 VanDerWaalsContact C-N 3.35Å; A470-T472 PolarHBondContact O-N 2.9Å; A470-V473 PolarHBondContact O-N 2.9Å; A470-D474 PolarHBondContact O-N 2.61Å
471	R	87.6	Confident	88.4	Confident	133 Å²	133	49 Å²	49	50%	0.502	23%	0.234	S	C	.	.	H	α-helix	trans	-63.8	-37.4	174.8	-72.9	179.6	-117.6	140.8	-1.7	112.5	S467 G468 I469 D474 R475	S467-R471 WeakPolarHBondContact O-CG 3.5Å; S467-R471 PolarHBondContact O-N 3.1Å; S467-R471 PolarHBondContact OG-NE 3.48Å; S467-R471 PolarHBondContact OG-NH2 3.12Å; G468-R471 PolarHBondContact O-N 3.49Å; I469-R471 VanDerWaalsContact C-N 3.33Å; I469-R471 PolarHBondContact O-N 3.47Å; R471-D474 PolarHBondContact O-N 3.35Å; R471-R475 WeakPolarHBondContact O-CG 3.36Å; R471-R475 PolarHBondContact O-N 3.22Å; R471-R475 VanDerWaalsContact O-N 3.16Å
472	T	88.8	Confident	88.6	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.043	22%	0.22	C	C	.	.	H	α-helix	trans	-71.3	-38.9	-180	62.6	0	0	0	0	112.1	F353 P358 M363 G468 I469 A470 L476	F353-T472 WeakPolarHBondContact O-CG2 3.41Å; F353-T472 PolarHBondContact O-OG1 3.31Å; P358-T472 HydrophobicContact CG-CG2 3.66Å; M363-T472 HydrophobicContact CE-CG2 4.03Å; M363-T472 HydrophobicContact SD-CG2 3.75Å; G468-T472 VanDerWaalsContact O-CG2 3.28Å; G468-T472 WeakPolarHBondContact O-CG2 3.34Å; G468-T472 PolarHBondContact O-N 3.34Å; I469-T472 WeakPolarHBondContact CA-OG1 3.5Å; I469-T472 PolarHBondContact O-N 3.4Å; I469-T472 PolarHBondContact O-OG1 3.08Å; A470-T472 VanDerWaalsContact C-N 3.35Å; A470-T472 PolarHBondContact O-N 2.9Å; T472-L476 WeakPolarHBondContact O-CB 3.43Å; T472-L476 PolarHBondContact O-N 3.17Å
473	V	89.6	Confident	89	Confident	17 Å²	17	45.4 Å²	45.4	10%	0.103	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-44.1	170.9	175.6	0	0	0	0	111.3	V332 L335 F353 I469 A470 R475 L476 C477	V332-V473 HydrophobicContact CG2-CB 4.24Å; V332-V473 HydrophobicContact CG2-CG1 3.68Å; L335-V473 HydrophobicContact CD1-CG2 4Å; F353-V473 HydrophobicContact CD1-CG2 3.82Å; F353-V473 HydrophobicContact CE1-CG2 3.44Å; F353-V473 VanDerWaalsContact CE1-CG2 3.44Å; F353-V473 HydrophobicContact CZ-CG2 4.19Å; I469-V473 HydrophobicContact CG2-CG2 4.38Å; I469-V473 VanDerWaalsContact O-CG2 3.32Å; I469-V473 WeakPolarHBondContact O-CG2 3.36Å; I469-V473 PolarHBondContact O-N 3.29Å; A470-V473 PolarHBondContact O-N 2.9Å; V473-R475 PolarHBondContact O-N 2.98Å; V473-L476 WeakPolarHBondContact O-CB 3.41Å; V473-L476 PolarHBondContact O-N 2.97Å; V473-C477 PolarHBondContact O-N 2.89Å; V473-C477 PolarHBondContact O-SG 3.5Å; V473-C477 VanDerWaalsContact O-SG 3.38Å
474	D	90.8	Very high	89.3	Confident	9 Å²	9	44.2 Å²	44.2	5%	0.048	23%	0.225	C	C	.	.	H	α-helix	trans	-57.4	-48	178.6	-107.3	-11.3	0	0	0	112.9	Y270 K279 V332 A470 R471 C477 L478	Y270-D474 WeakPolarHBondContact CD1-OD1 3.43Å; K279-D474 IonicContact NZ-OD1 2.69Å; K279-D474 PolarHBondContact NZ-OD1 2.97Å; K279-D474 IonicContact NZ-OD2 3.04Å; K279-D474 PolarHBondContact NZ-OD2 2.82Å; V332-D474 WeakPolarHBondContact CG2-OD1 3.46Å; A470-D474 PolarHBondContact O-N 2.61Å; R471-D474 PolarHBondContact O-N 3.35Å; D474-C477 PolarHBondContact O-N 3.22Å; D474-L478 PolarHBondContact O-N 3.05Å
475	R	89.4	Confident	89.6	Confident	85 Å²	85	39.8 Å²	39.8	32%	0.321	20%	0.201	S	C	.	.	H	α-helix	trans	-67.4	-39.1	178.9	-63.5	-69	-178.1	177.6	-5.6	111.3	Y271 L361 M363 R471 V473 C477 L478 F479	Y271-R475 VanDerWaalsContact CE2-NH1 3.29Å; L361-R475 HydrophobicContact CD1-CB 4.33Å; M363-R475 HydrophobicContact CE-CB 3.23Å; M363-R475 HydrophobicContact CE-CG 3.35Å; M363-R475 HydrophobicContact SD-CG 4.42Å; R471-R475 WeakPolarHBondContact O-CG 3.36Å; R471-R475 PolarHBondContact O-N 3.22Å; R471-R475 VanDerWaalsContact O-N 3.16Å; V473-R475 PolarHBondContact O-N 2.98Å; R475-C477 VanDerWaalsContact C-N 3.32Å; R475-C477 PolarHBondContact O-N 3.48Å; R475-L478 WeakPolarHBondContact O-CB 3.45Å; R475-L478 PolarHBondContact O-N 3.23Å; R475-F479 WeakPolarHBondContact O-CD2 3.37Å; R475-F479 PolarHBondContact O-N 3.37Å
476	L	90.6	Very high	89.8	Confident	51 Å²	51	40.8 Å²	40.8	27%	0.267	21%	0.209	S	C	.	.	H	α-helix	trans	-57.3	-48.4	173.3	-178.8	68.6	0	0	0	110.8	L357 L361 T472 V473 L478 F479 L480	L357-L476 HydrophobicContact CD1-CD1 4.29Å; L357-L476 HydrophobicContact CD1-CD2 4.43Å; L357-L476 HydrophobicContact CD2-CB 4.18Å; L357-L476 HydrophobicContact CD2-CD2 4.12Å; L361-L476 HydrophobicContact CD1-CB 4.14Å; L361-L476 HydrophobicContact CD2-CD1 4.45Å; T472-L476 WeakPolarHBondContact O-CB 3.43Å; T472-L476 PolarHBondContact O-N 3.17Å; V473-L476 WeakPolarHBondContact O-CB 3.41Å; V473-L476 PolarHBondContact O-N 2.97Å; L476-L478 VanDerWaalsContact C-N 3.32Å; L476-L478 PolarHBondContact O-N 3.02Å; L476-F479 PolarHBondContact O-N 3.31Å; L476-L480 HydrophobicContact CD1-CD1 4.29Å; L476-L480 HydrophobicContact CG-CD1 4.05Å; L476-L480 WeakPolarHBondContact O-CG 3.37Å; L476-L480 PolarHBondContact O-N 2.94Å
477	C	90.7	Very high	90.1	Very high	14 Å²	14	47 Å²	47	10%	0.095	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-39.7	177	-70.4	0	0	0	0	112.1	Y270 V473 D474 R475 L480 I481	Y270-C477 HydrophobicContact CD1-CB 3.92Å; Y270-C477 HydrophobicContact CE1-CB 3.45Å; Y270-C477 VanDerWaalsContact CE1-CB 3.45Å; Y270-C477 HydrophobicContact CE2-CB 4.27Å; V473-C477 PolarHBondContact O-N 2.89Å; V473-C477 PolarHBondContact O-SG 3.5Å; V473-C477 VanDerWaalsContact O-SG 3.38Å; D474-C477 PolarHBondContact O-N 3.22Å; R475-C477 VanDerWaalsContact C-N 3.32Å; R475-C477 PolarHBondContact O-N 3.48Å; C477-L480 PolarHBondContact O-N 3.06Å; C477-I481 VanDerWaalsContact O-CB 3.29Å; C477-I481 WeakPolarHBondContact O-CB 3.49Å; C477-I481 VanDerWaalsContact O-CG1 3.29Å; C477-I481 WeakPolarHBondContact O-CG1 3.5Å; C477-I481 PolarHBondContact O-N 2.89Å
478	L	91.3	Very high	90.3	Very high	33 Å²	33	47.3 Å²	47.3	17%	0.173	24%	0.241	C	C	.	.	H	α-helix	trans	-58.6	-51.7	173.3	-173	158.9	0	0	0	111.4	Y270 D474 R475 L476 L480 I481 T482	Y270-L478 HydrophobicContact CD2-CB 4.25Å; Y270-L478 HydrophobicContact CG-CB 4.21Å; D474-L478 PolarHBondContact O-N 3.05Å; R475-L478 WeakPolarHBondContact O-CB 3.45Å; R475-L478 PolarHBondContact O-N 3.23Å; L476-L478 VanDerWaalsContact C-N 3.32Å; L476-L478 PolarHBondContact O-N 3.02Å; L478-L480 PolarHBondContact O-N 2.98Å; L478-I481 PolarHBondContact O-N 3.31Å; L478-T482 VanDerWaalsContact O-CB 3.23Å; L478-T482 WeakPolarHBondContact O-CB 3.04Å; L478-T482 PolarHBondContact O-N 3.06Å; L478-T482 PolarHBondContact O-OG1 2.94Å; L478-T482 VanDerWaalsContact O-OG1 3.09Å
479	F	90.4	Very high	90.7	Very high	115 Å²	115	47.8 Å²	47.8	50%	0.504	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-19.7	-179.1	-76.5	-68.2	0	0	0	113.8	L361 R475 L476 P483	L361-F479 HydrophobicContact CD2-CD2 3.61Å; L361-F479 HydrophobicContact CD2-CE2 4.11Å; L361-F479 HydrophobicContact CD2-CG 4.35Å; R475-F479 WeakPolarHBondContact O-CD2 3.37Å; R475-F479 PolarHBondContact O-N 3.37Å; L476-F479 PolarHBondContact O-N 3.31Å; F479-P483 WeakPolarHBondContact O-CD 3.44Å; F479-P483 WeakPolarHBondContact O-CG 3.3Å
480	L	90.9	Very high	90.9	Very high	104 Å²	104	51.9 Å²	51.9	55%	0.545	27%	0.267	S	S	.	.	H	α-helix	trans	-88.8	-48.8	174	-68.6	175.2	0	0	0	112.1	L476 C477 L478 V484	L476-L480 HydrophobicContact CD1-CD1 4.29Å; L476-L480 HydrophobicContact CG-CD1 4.05Å; L476-L480 WeakPolarHBondContact O-CG 3.37Å; L476-L480 PolarHBondContact O-N 2.94Å; C477-L480 PolarHBondContact O-N 3.06Å; L478-L480 PolarHBondContact O-N 2.98Å; L480-V484 VanDerWaalsContact O-CG2 3.23Å; L480-V484 WeakPolarHBondContact O-CG2 3.39Å
481	I	91.4	Very high	91.1	Very high	20 Å²	20	57.2 Å²	57.2	10%	0.103	29%	0.294	C	S	.	.	H	α-helix	trans	-77	-40.6	-172.5	-63.1	-63.2	0	0	0	111.7	Y270 I324 V325 C477 L478 V484 M485	Y270-I481 HydrophobicContact CE2-CB 4.18Å; Y270-I481 HydrophobicContact CE2-CG1 4.27Å; Y270-I481 HydrophobicContact CE2-CG2 4.41Å; I324-I481 HydrophobicContact CG2-CD1 4.25Å; V325-I481 HydrophobicContact CG2-CG2 3.83Å; C477-I481 VanDerWaalsContact O-CB 3.29Å; C477-I481 WeakPolarHBondContact O-CB 3.49Å; C477-I481 VanDerWaalsContact O-CG1 3.29Å; C477-I481 WeakPolarHBondContact O-CG1 3.5Å; C477-I481 PolarHBondContact O-N 2.89Å; L478-I481 PolarHBondContact O-N 3.31Å; I481-V484 PolarHBondContact O-N 3.43Å; I481-M485 HydrophobicContact CG2-CE 4.21Å; I481-M485 VanDerWaalsContact O-CB 3.32Å; I481-M485 WeakPolarHBondContact O-CB 3.36Å; I481-M485 PolarHBondContact O-N 3.44Å
482	T	91.3	Very high	91.3	Very high	39 Å²	39	52.3 Å²	52.3	24%	0.239	28%	0.277	C	S	.	.	H	α-helix	trans	-61.9	-47.1	-177.2	-58.9	0	0	0	0	112	S267 L478 V484 M485 T486	S267-T482 PolarHBondContact OG-OG1 3.37Å; L478-T482 VanDerWaalsContact O-CB 3.23Å; L478-T482 WeakPolarHBondContact O-CB 3.04Å; L478-T482 PolarHBondContact O-N 3.06Å; L478-T482 PolarHBondContact O-OG1 2.94Å; L478-T482 VanDerWaalsContact O-OG1 3.09Å; T482-V484 PolarHBondContact O-N 2.95Å; T482-M485 PolarHBondContact O-N 2.89Å; T482-T486 HydrophobicContact CG2-CG2 4.46Å; T482-T486 WeakPolarHBondContact O-CG2 3.4Å; T482-T486 PolarHBondContact O-N 3.37Å; T482-T486 PolarHBondContact O-OG1 3.43Å; T482-T486 VanDerWaalsContact O-OG1 3.13Å
483	P	92.1	Very high	91.4	Very high	51 Å²	51	53.5 Å²	53.5	33%	0.331	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-43.7	174.7	-26.5	38.2	0	0	0	113.1	F479 M485 T486 F487	F479-P483 WeakPolarHBondContact O-CD 3.44Å; F479-P483 WeakPolarHBondContact O-CG 3.3Å; P483-M485 VanDerWaalsContact C-N 3.27Å; P483-M485 PolarHBondContact O-N 3.37Å; P483-T486 WeakPolarHBondContact CA-OG1 3.42Å; P483-T486 PolarHBondContact O-N 2.78Å; P483-T486 PolarHBondContact O-OG1 3.12Å; P483-F487 HydrophobicContact CB-CD2 4.18Å; P483-F487 HydrophobicContact CB-CE2 4.3Å; P483-F487 WeakPolarHBondContact O-CB 3.42Å; P483-F487 WeakPolarHBondContact O-CD2 3.39Å; P483-F487 PolarHBondContact O-N 3.45Å
484	V	93.1	Very high	91.5	Very high	74 Å²	74	57.6 Å²	57.6	45%	0.448	30%	0.303	S	S	.	.	H	α-helix	trans	-58.9	-42.7	177.8	170.8	0	0	0	0	110.7	F317 L321 L480 I481 T482 G488	F317-V484 HydrophobicContact CZ-CG1 4.32Å; L321-V484 HydrophobicContact CD1-CG1 4.43Å; L321-V484 HydrophobicContact CD2-CG1 4.03Å; L480-V484 VanDerWaalsContact O-CG2 3.23Å; L480-V484 WeakPolarHBondContact O-CG2 3.39Å; I481-V484 PolarHBondContact O-N 3.43Å; T482-V484 PolarHBondContact O-N 2.95Å; V484-G488 WeakPolarHBondContact O-CA 3.38Å; V484-G488 PolarHBondContact O-N 3.42Å
485	M	91.6	Very high	91.5	Very high	7 Å²	7	61.8 Å²	61.8	3%	0.034	32%	0.323	C	S	.	.	H	α-helix	trans	-64.7	-47.5	176.9	-168	-176.8	-73.8	0	0	111.3	A266 S267 I318 L321 I481 T482 P483 T489	A266-M485 HydrophobicContact CB-CE 4.27Å; S267-M485 PolarHBondContact OG-SD 2.77Å; I318-M485 HydrophobicContact CD1-CG 4.02Å; L321-M485 HydrophobicContact CD1-CB 4.18Å; L321-M485 HydrophobicContact CD1-CG 4.31Å; I481-M485 HydrophobicContact CG2-CE 4.21Å; I481-M485 VanDerWaalsContact O-CB 3.32Å; I481-M485 WeakPolarHBondContact O-CB 3.36Å; I481-M485 PolarHBondContact O-N 3.44Å; T482-M485 PolarHBondContact O-N 2.89Å; P483-M485 VanDerWaalsContact C-N 3.27Å; P483-M485 PolarHBondContact O-N 3.37Å; M485-T489 WeakPolarHBondContact O-CG2 3.2Å; M485-T489 PolarHBondContact O-N 2.87Å; M485-T489 PolarHBondContact O-OG1 3.29Å
486	T	91.4	Very high	91.5	Very high	69 Å²	69	57.7 Å²	57.7	42%	0.423	31%	0.308	S	S	.	.	H	α-helix	trans	-68.9	-40.4	-179.6	53.8	0	0	0	0	113.5	T482 P483 T489 V490	T482-T486 HydrophobicContact CG2-CG2 4.46Å; T482-T486 WeakPolarHBondContact O-CG2 3.4Å; T482-T486 PolarHBondContact O-N 3.37Å; T482-T486 PolarHBondContact O-OG1 3.43Å; T482-T486 VanDerWaalsContact O-OG1 3.13Å; P483-T486 WeakPolarHBondContact CA-OG1 3.42Å; P483-T486 PolarHBondContact O-N 2.78Å; P483-T486 PolarHBondContact O-OG1 3.12Å; T486-T489 PolarHBondContact O-OG1 3.5Å; T486-V490 WeakPolarHBondContact O-CB 3.33Å; T486-V490 VanDerWaalsContact O-CG2 3.22Å; T486-V490 WeakPolarHBondContact O-CG2 3.42Å; T486-V490 PolarHBondContact O-N 3.4Å; T486-V490 VanDerWaalsContact O-N 3.09Å
487	F	93	Very high	91.4	Very high	138 Å²	138	59.9 Å²	59.9	61%	0.605	32%	0.318	S	S	*	.	H	α-helix	trans	-70.9	-40.5	176.9	-78.8	-66.6	0	0	0	110.6	P483 T489 V490 I491	P483-F487 HydrophobicContact CB-CD2 4.18Å; P483-F487 HydrophobicContact CB-CE2 4.3Å; P483-F487 WeakPolarHBondContact O-CB 3.42Å; P483-F487 WeakPolarHBondContact O-CD2 3.39Å; P483-F487 PolarHBondContact O-N 3.45Å; F487-T489 PolarHBondContact O-N 3.2Å; F487-V490 PolarHBondContact O-N 2.89Å; F487-I491 WeakPolarHBondContact O-CB 3.46Å; F487-I491 WeakPolarHBondContact O-CD1 3.22Å; F487-I491 WeakPolarHBondContact O-CG1 3.31Å; F487-I491 PolarHBondContact O-N 3.47Å
488	G	92	Very high	91.4	Very high	14 Å²	14	63.4 Å²	63.4	14%	0.144	34%	0.342	C	S	.	.	H	α-helix	trans	-59.3	-46	175.1	0	0	0	0	0	112.3	V484 I492	V484-G488 WeakPolarHBondContact O-CA 3.38Å; V484-G488 PolarHBondContact O-N 3.42Å; G488-I492 WeakPolarHBondContact O-CB 3.28Å; G488-I492 WeakPolarHBondContact O-CD1 3.39Å; G488-I492 WeakPolarHBondContact O-CG1 3.44Å; G488-I492 PolarHBondContact O-N 2.9Å; G488-I492 VanDerWaalsContact O-N 3.13Å
489	T	91.8	Very high	91.5	Very high	21 Å²	21	63 Å²	63	13%	0.129	34%	0.341	C	S	.	.	H	α-helix	trans	-61.7	-49.9	176.9	61.2	0	0	0	0	111	Y314 I318 M485 T486 F487 I491 I492 F493	Y314-T489 HydrophobicContact CE2-CG2 3.55Å; I318-T489 HydrophobicContact CD1-CG2 4.21Å; M485-T489 WeakPolarHBondContact O-CG2 3.2Å; M485-T489 PolarHBondContact O-N 2.87Å; M485-T489 PolarHBondContact O-OG1 3.29Å; T486-T489 PolarHBondContact O-OG1 3.5Å; F487-T489 PolarHBondContact O-N 3.2Å; T489-I491 PolarHBondContact O-N 2.8Å; T489-I492 PolarHBondContact O-N 2.99Å; T489-F493 WeakPolarHBondContact O-CD2 3.37Å; T489-F493 PolarHBondContact O-N 3.39Å
490	V	92	Very high	91.5	Very high	88 Å²	88	62.9 Å²	62.9	53%	0.533	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-45.8	-178.3	171.5	0	0	0	0	111.7	T486 F487 I492 F493 L494	T486-V490 WeakPolarHBondContact O-CB 3.33Å; T486-V490 VanDerWaalsContact O-CG2 3.22Å; T486-V490 WeakPolarHBondContact O-CG2 3.42Å; T486-V490 PolarHBondContact O-N 3.4Å; T486-V490 VanDerWaalsContact O-N 3.09Å; F487-V490 PolarHBondContact O-N 2.89Å; V490-I492 PolarHBondContact O-N 2.8Å; V490-F493 PolarHBondContact O-N 3.28Å; V490-L494 WeakPolarHBondContact O-CB 3.29Å; V490-L494 PolarHBondContact O-N 2.82Å
491	I	93	Very high	91.5	Very high	112 Å²	112	58.9 Å²	58.9	57%	0.574	32%	0.321	S	S	*	.	H	α-helix	trans	-62	-46.2	-179.5	-70.2	165.9	0	0	0	110.8	F487 T489 L494 M495	F487-I491 WeakPolarHBondContact O-CB 3.46Å; F487-I491 WeakPolarHBondContact O-CD1 3.22Å; F487-I491 WeakPolarHBondContact O-CG1 3.31Å; F487-I491 PolarHBondContact O-N 3.47Å; T489-I491 PolarHBondContact O-N 2.8Å; I491-L494 PolarHBondContact O-N 3.48Å; I491-M495 WeakPolarHBondContact O-CB 3.34Å; I491-M495 PolarHBondContact O-N 2.96Å
492	I	91.9	Very high	91.4	Very high	30 Å²	30	60.6 Å²	60.6	15%	0.154	33%	0.334	C	S	.	.	H	α-helix	trans	-63.9	-45.5	-178.5	-68.3	169	0	0	0	110.7	L310 Y314 F317 G488 T489 V490 M495 G496	L310-I492 HydrophobicContact CD1-CG2 3.73Å; L310-I492 HydrophobicContact CD2-CG2 4.45Å; L310-I492 HydrophobicContact CG-CG2 3.83Å; Y314-I492 HydrophobicContact CD2-CD1 4.15Å; F317-I492 HydrophobicContact CB-CD1 4.46Å; F317-I492 HydrophobicContact CD1-CD1 4.17Å; F317-I492 HydrophobicContact CG-CD1 4.37Å; G488-I492 WeakPolarHBondContact O-CB 3.28Å; G488-I492 WeakPolarHBondContact O-CD1 3.39Å; G488-I492 WeakPolarHBondContact O-CG1 3.44Å; G488-I492 PolarHBondContact O-N 2.9Å; G488-I492 VanDerWaalsContact O-N 3.13Å; T489-I492 PolarHBondContact O-N 2.99Å; V490-I492 PolarHBondContact O-N 2.8Å; I492-M495 WeakPolarHBondContact O-CB 3.47Å; I492-M495 PolarHBondContact O-N 3.27Å; I492-G496 PolarHBondContact O-N 3.36Å
493	F	90.4	Very high	91.3	Very high	33 Å²	33	69.8 Å²	69.8	15%	0.145	36%	0.364	C	S	.	.	H	α-helix	trans	-71.8	-35	179.4	-71.6	-59.3	0	0	0	113	F162 I256 V260 Y314 T489 V490 M495 G496 I497	F162-F493 HydrophobicContact CE2-CD1 4.13Å; I256-F493 HydrophobicContact CB-CE1 4.46Å; I256-F493 HydrophobicContact CB-CZ 4.36Å; I256-F493 HydrophobicContact CD1-CD1 4.26Å; I256-F493 HydrophobicContact CD1-CE1 3.57Å; I256-F493 HydrophobicContact CD1-CZ 4.3Å; I256-F493 HydrophobicContact CG1-CE1 3.82Å; I256-F493 HydrophobicContact CG1-CZ 4.07Å; I256-F493 HydrophobicContact CG2-CE1 3.82Å; I256-F493 HydrophobicContact CG2-CE2 4.05Å; I256-F493 HydrophobicContact CG2-CZ 3.49Å; I256-F493 VanDerWaalsContact CG2-CZ 3.49Å; V260-F493 HydrophobicContact CG2-CE2 4.4Å; Y314-F493 HydrophobicContact CD1-CZ 4.02Å; Y314-F493 HydrophobicContact CD2-CE2 4.32Å; Y314-F493 HydrophobicContact CD2-CZ 4.4Å; Y314-F493 HydrophobicContact CE1-CE2 4.3Å; Y314-F493 AromaticContact CE1-CZ 3.96Å; Y314-F493 HydrophobicContact CE1-CZ 3.96Å; Y314-F493 HydrophobicContact CE2-CE2 4.04Å; Y314-F493 HydrophobicContact CE2-CZ 4.37Å; Y314-F493 HydrophobicContact CG-CZ 4.23Å; T489-F493 WeakPolarHBondContact O-CD2 3.37Å; T489-F493 PolarHBondContact O-N 3.39Å; V490-F493 PolarHBondContact O-N 3.28Å; F493-M495 VanDerWaalsContact C-N 3.31Å; F493-M495 PolarHBondContact O-N 3.48Å; F493-G496 PolarHBondContact O-N 2.86Å; F493-G496 VanDerWaalsContact O-N 3.16Å; F493-I497 VanDerWaalsContact O-CG1 3.31Å; F493-I497 WeakPolarHBondContact O-CG1 3.27Å; F493-I497 PolarHBondContact O-N 3.45Å
494	L	91.6	Very high	91.2	Very high	103 Å²	103	70.5 Å²	70.5	54%	0.539	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-40.4	174.5	-170	145.4	0	0	0	110.9	V490 I491 G496 I497 C498	V490-L494 WeakPolarHBondContact O-CB 3.29Å; V490-L494 PolarHBondContact O-N 2.82Å; I491-L494 PolarHBondContact O-N 3.48Å; L494-G496 VanDerWaalsContact C-N 3.28Å; L494-G496 PolarHBondContact O-N 2.9Å; L494-I497 PolarHBondContact O-N 2.88Å; L494-C498 WeakPolarHBondContact O-CB 3.4Å; L494-C498 PolarHBondContact O-N 2.91Å; L494-C498 PolarHBondContact O-SG 3.07Å
495	M	91	Very high	91	Very high	96 Å²	96	67.8 Å²	67.8	47%	0.473	35%	0.349	S	S	.	.	H	α-helix	trans	-58.9	-39.8	173	-166.3	-171.1	174.2	0	0	112	Y159 L310 I491 I492 F493	Y159-M495 HydrophobicContact CE1-CE 3.72Å; Y159-M495 HydrophobicContact CE1-CG 3.96Å; Y159-M495 HydrophobicContact CE1-SD 4.29Å; Y159-M495 VanDerWaalsContact OH-CE 3.3Å; Y159-M495 WeakPolarHBondContact OH-CE 3.49Å; L310-M495 HydrophobicContact CD1-SD 4.47Å; I491-M495 WeakPolarHBondContact O-CB 3.34Å; I491-M495 PolarHBondContact O-N 2.96Å; I492-M495 WeakPolarHBondContact O-CB 3.47Å; I492-M495 PolarHBondContact O-N 3.27Å; F493-M495 VanDerWaalsContact C-N 3.31Å; F493-M495 PolarHBondContact O-N 3.48Å
496	G	89.8	Confident	90.9	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-67.3	-46.1	174.2	0	0	0	0	0	113.3	F162 I492 F493 L494 C498 N499	F162-G496 VanDerWaalsContact CB-O 3.28Å; F162-G496 WeakPolarHBondContact CB-O 3.33Å; I492-G496 PolarHBondContact O-N 3.36Å; F493-G496 PolarHBondContact O-N 2.86Å; F493-G496 VanDerWaalsContact O-N 3.16Å; L494-G496 VanDerWaalsContact C-N 3.28Å; L494-G496 PolarHBondContact O-N 2.9Å; G496-C498 VanDerWaalsContact C-N 3.31Å; G496-C498 PolarHBondContact O-N 2.93Å; G496-N499 VanDerWaalsContact O-CB 3.27Å; G496-N499 WeakPolarHBondContact O-CB 3.08Å; G496-N499 PolarHBondContact O-N 2.8Å
497	I	89.3	Confident	90.6	Very high	96 Å²	96	75.5 Å²	75.5	49%	0.492	38%	0.379	S	S	.	.	H	α-helix	trans	-64.4	-37.4	-178.9	-68.3	163.7	0	0	0	111.4	F162 F493 L494 N499 H500	F162-I497 HydrophobicContact CE1-CG1 4.26Å; F493-I497 VanDerWaalsContact O-CG1 3.31Å; F493-I497 WeakPolarHBondContact O-CG1 3.27Å; F493-I497 PolarHBondContact O-N 3.45Å; L494-I497 PolarHBondContact O-N 2.88Å; I497-N499 PolarHBondContact O-N 3.26Å; I497-H500 PolarHBondContact O-CE1 2.97Å
498	C	90.8	Very high	90.2	Very high	88 Å²	88	73.1 Å²	73.1	60%	0.595	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.6	176.4	-68	0	0	0	0	113.7	L494 G496 H500	L494-C498 WeakPolarHBondContact O-CB 3.4Å; L494-C498 PolarHBondContact O-N 2.91Å; L494-C498 PolarHBondContact O-SG 3.07Å; G496-C498 VanDerWaalsContact C-N 3.31Å; G496-C498 PolarHBondContact O-N 2.93Å; C498-H500 VanDerWaalsContact C-N 3.34Å; C498-H500 PolarHBondContact O-N 2.9Å
499	N	92.1	Very high	90	Very high	26 Å²	26	74 Å²	74	14%	0.139	40%	0.395	C	S	.	.			trans	-75.9	87.2	174.1	-175.5	51	0	0	0	110.1	Y159 F162 W164 G496 I497	Y159-N499 VanDerWaalsContact CB-ND2 3.33Å; Y159-N499 WeakPolarHBondContact CB-ND2 3.45Å; Y159-N499 HydrophobicContact CD1-CB 4.03Å; Y159-N499 HydrophobicContact CD2-CB 4.15Å; Y159-N499 VanDerWaalsContact CD2-CG 3.5Å; Y159-N499 HydrophobicContact CG-CB 3.83Å; F162-N499 PolarHBondContact O-ND2 3.33Å; W164-N499 PolarHBondContact NE1-OD1 3.36Å; G496-N499 VanDerWaalsContact O-CB 3.27Å; G496-N499 WeakPolarHBondContact O-CB 3.08Å; G496-N499 PolarHBondContact O-N 2.8Å; I497-N499 PolarHBondContact O-N 3.26Å
500	H	90.6	Very high	89.8	Confident	112 Å²	112	78.5 Å²	78.5	52%	0.519	42%	0.424	S	S	.	.			trans	-104.6	146.9	170.9	-70.4	-25.1	0	0	0	110.9	I497 C498	I497-H500 PolarHBondContact O-CE1 2.97Å; C498-H500 VanDerWaalsContact C-N 3.34Å; C498-H500 PolarHBondContact O-N 2.9Å
501	P	90.9	Very high	89.6	Confident	20 Å²	20	75.6 Å²	75.6	13%	0.13	41%	0.405	C	S	.	.			trans	-58.9	151.7	172.4	26.4	-33.7	0	0	0	109.9	W164 I216 V243	W164-P501 HydrophobicContact CB-CB 4.27Å; W164-P501 HydrophobicContact CD2-CB 4.16Å; W164-P501 HydrophobicContact CG-CB 4Å; I216-P501 HydrophobicContact CB-CG 4.42Å; I216-P501 HydrophobicContact CG1-CG 4.08Å; I216-P501 HydrophobicContact CG2-CG 3.98Å; V243-P501 HydrophobicContact CG1-CB 4.2Å
502	P	90.8	Very high	89.2	Confident	55 Å²	55	73.4 Å²	73.4	36%	0.357	40%	0.395	S	S	.	.			trans	-59.8	148.8	177.3	27.9	-35.2	0	0	0	110.5	H217 L504	H217-P502 PolarHBondContact NE2-O 3.1Å; P502-L504 WeakPolarHBondContact CB-O 2.97Å; P502-L504 WeakPolarHBondContact CG-O 3.45Å; P502-L504 PolarHBondContact O-N 3.01Å
503	R	88.4	Confident	89	Confident	233 Å²	233	72.4 Å²	72.4	88%	0.879	39%	0.389	S	S	*	.	S	Bend	trans	-62.1	-31.7	178.6	-71.4	-172	179.1	-172.4	-0.8	113	H217	H217-R503 PolarHBondContact CE1-O 2.81Å; H217-R503 PolarHBondContact NE2-O 2.85Å
504	L	90.4	Very high	88.7	Confident	66 Å²	66	72.4 Å²	72.4	35%	0.346	39%	0.393	S	S	.	.	S	Bend	trans	-114.5	144.7	176.3	-66.1	169.6	0	0	0	109	P502 F506 D512	P502-L504 WeakPolarHBondContact CB-O 2.97Å; P502-L504 WeakPolarHBondContact CG-O 3.45Å; P502-L504 PolarHBondContact O-N 3.01Å; L504-F506 PolarHBondContact O-N 2.85Å; L504-D512 HydrophobicContact CD2-CB 4.06Å
505	P	88.7	Confident	88.4	Confident	17 Å²	17	72.2 Å²	72.2	11%	0.11	39%	0.389	C	S	.	.	S	Bend	trans	-69.4	-32.9	-176.1	24.5	-32.7	0	0	0	113.3	H217 P219 Y513	H217-P505 HydrophobicContact CB-CB 4.06Å; P219-P505 HydrophobicContact CB-CG 4.43Å; P219-P505 HydrophobicContact CG-CB 3.84Å; P219-P505 HydrophobicContact CG-CG 4.18Å; P505-Y513 HydrophobicContact CG-CD2 3.77Å; P505-Y513 HydrophobicContact CG-CE2 4.48Å
506	F	89.9	Confident	88	Confident	36 Å²	36	74.2 Å²	74.2	16%	0.158	40%	0.402	C	S	.	.	S	Bend	trans	-118.8	133.1	-177.7	-57.3	-68.1	0	0	0	111.7	P219 Y241 L504 G508 D509 Y513	P219-F506 HydrophobicContact CB-CE2 3.74Å; P219-F506 HydrophobicContact CB-CZ 4.13Å; P219-F506 HydrophobicContact CG-CE2 3.72Å; P219-F506 HydrophobicContact CG-CZ 3.73Å; Y241-F506 HydrophobicContact CD1-CE1 4.26Å; Y241-F506 HydrophobicContact CD2-CE1 4.05Å; Y241-F506 AromaticContact CD2-CZ 3.62Å; Y241-F506 HydrophobicContact CD2-CZ 3.62Å; Y241-F506 HydrophobicContact CE1-CE1 4.15Å; Y241-F506 AromaticContact CE2-CE1 3.91Å; Y241-F506 HydrophobicContact CE2-CE1 3.91Å; Y241-F506 AromaticContact CE2-CZ 3.7Å; Y241-F506 HydrophobicContact CE2-CZ 3.7Å; Y241-F506 HydrophobicContact CG-CE1 4.25Å; Y241-F506 HydrophobicContact CG-CZ 4.12Å; Y241-F506 AromaticContact CZ-CE1 3.98Å; L504-F506 PolarHBondContact O-N 2.85Å; F506-G508 PolarHBondContact O-N 2.78Å; F506-D509 HydrophobicContact CB-CB 4.21Å; F506-Y513 AromaticContact CD2-CD2 4Å; F506-Y513 HydrophobicContact CD2-CD2 4Å; F506-Y513 AromaticContact CD2-CE2 3.43Å; F506-Y513 HydrophobicContact CD2-CE2 3.43Å; F506-Y513 VanDerWaalsContact CD2-CE2 3.43Å; F506-Y513 AromaticContact CD2-CZ 3.78Å; F506-Y513 HydrophobicContact CE2-CD2 4.12Å; F506-Y513 HydrophobicContact CE2-CE1 4.26Å; F506-Y513 AromaticContact CE2-CE2 3.77Å; F506-Y513 HydrophobicContact CE2-CE2 3.77Å; F506-Y513 AromaticContact CE2-CZ 3.82Å
507	Q	83.7	Confident	87.6	Confident	202 Å²	202	79.3 Å²	79.3	94%	0.944	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	124.1	174.5	-66.2	-178.7	-0.3	0	0	110
508	G	84.9	Confident	87.3	Confident	88 Å²	88	76.9 Å²	76.9	91%	0.907	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-5.7	177.3	0	0	0	0	0	115.4	F506	F506-G508 PolarHBondContact O-N 2.78Å
509	D	87.3	Confident	86.7	Confident	31 Å²	31	76.8 Å²	76.8	17%	0.166	41%	0.407	C	S	.	.			trans	-99.6	121.5	167.4	-163.4	-33.8	0	0	0	109.2	F506 H511 Y513 R519	F506-D509 HydrophobicContact CB-CB 4.21Å; D509-H511 PolarHBondContact O-N 3.46Å; D509-H511 VanDerWaalsContact OD1-CB 3.24Å; D509-H511 WeakPolarHBondContact OD1-CB 3.48Å; D509-H511 PolarHBondContact OD1-N 3.41Å; D509-Y513 PolarHBondContact OD2-OH 3.19Å; D509-R519 IonicContact OD1-CZ 2.67Å; D509-R519 IonicContact OD1-NH2 2.67Å; D509-R519 PolarHBondContact OD1-NH2 3.46Å; D509-R519 IonicContact OD2-CZ 2.73Å; D509-R519 IonicContact OD2-NH1 3.6Å; D509-R519 IonicContact OD2-NH2 3.35Å; D509-R519 PolarHBondContact OD2-NH2 3.48Å
510	P	87.8	Confident	86	Confident	116 Å²	116	80.8 Å²	80.8	75%	0.753	43%	0.428	S	S	*	.			trans	-72.2	-6.4	177.9	30.7	-36.7	0	0	0	114
511	H	87.6	Confident	85	Confident	27 Å²	27	82.4 Å²	82.4	13%	0.125	44%	0.439	C	S	.	.			trans	-86.4	140.3	-175.6	-169.8	64.4	0	0	0	113	E198 D509 Y513 N517	E198-H511 IonicContact OE2-CD2 3.73Å; E198-H511 IonicContact OE2-NE2 2.71Å; D509-H511 PolarHBondContact O-N 3.46Å; D509-H511 VanDerWaalsContact OD1-CB 3.24Å; D509-H511 WeakPolarHBondContact OD1-CB 3.48Å; D509-H511 PolarHBondContact OD1-N 3.41Å; H511-Y513 HydrophobicContact CB-CD2 4.31Å; H511-Y513 HydrophobicContact CB-CE2 4.08Å; H511-Y513 AromaticContact CD2-CD1 3.82Å; H511-Y513 AromaticContact CD2-CD2 3.7Å; H511-Y513 AromaticContact CD2-CE2 3.93Å; H511-Y513 AromaticContact CD2-CG 3.64Å; H511-Y513 PolarHBondContact CD2-N 3.32Å; H511-Y513 VanDerWaalsContact CD2-N 3.29Å; H511-Y513 VanDerWaalsContact O-CD2 3.22Å; H511-Y513 WeakPolarHBondContact O-CD2 3.33Å; H511-Y513 WeakPolarHBondContact O-CE2 3.39Å; H511-N517 PolarHBondContact CE1-O 3.27Å
512	D	85.1	Confident	84.8	Confident	67 Å²	67	85.5 Å²	85.5	36%	0.358	46%	0.455	S	S	.	.			trans	-90.3	-11.1	-176.3	-157.3	17.6	0	0	0	113.1	H217 L504 S514	H217-D512 IonicContact CE1-OD1 3.46Å; L504-D512 HydrophobicContact CD2-CB 4.06Å; D512-S514 PolarHBondContact O-N 3.04Å
513	Y	87.7	Confident	84.4	Confident	8 Å²	8	87.1 Å²	87.1	3%	0.031	46%	0.46	C	S	.	.			trans	55.4	34.6	179.6	-63.9	-95.8	0	0	0	112.7	E198 W199 P219 P505 F506 D509 H511	E198-Y513 HydrophobicContact CB-CD1 3.61Å; E198-Y513 HydrophobicContact CB-CE1 4.03Å; E198-Y513 WeakPolarHBondContact O-CD1 3.38Å; E198-Y513 VanDerWaalsContact OE2-CE1 3.22Å; E198-Y513 WeakPolarHBondContact OE2-CE1 3.49Å; W199-Y513 WeakPolarHBondContact CB-O 3.3Å; P219-Y513 HydrophobicContact CB-CD1 3.89Å; P219-Y513 HydrophobicContact CB-CD2 4.29Å; P219-Y513 HydrophobicContact CB-CG 3.66Å; P505-Y513 HydrophobicContact CG-CD2 3.77Å; P505-Y513 HydrophobicContact CG-CE2 4.48Å; F506-Y513 AromaticContact CD2-CD2 4Å; F506-Y513 HydrophobicContact CD2-CD2 4Å; F506-Y513 AromaticContact CD2-CE2 3.43Å; F506-Y513 HydrophobicContact CD2-CE2 3.43Å; F506-Y513 VanDerWaalsContact CD2-CE2 3.43Å; F506-Y513 AromaticContact CD2-CZ 3.78Å; F506-Y513 HydrophobicContact CE2-CD2 4.12Å; F506-Y513 HydrophobicContact CE2-CE1 4.26Å; F506-Y513 AromaticContact CE2-CE2 3.77Å; F506-Y513 HydrophobicContact CE2-CE2 3.77Å; F506-Y513 AromaticContact CE2-CZ 3.82Å; D509-Y513 PolarHBondContact OD2-OH 3.19Å; H511-Y513 HydrophobicContact CB-CD2 4.31Å; H511-Y513 HydrophobicContact CB-CE2 4.08Å; H511-Y513 AromaticContact CD2-CD1 3.82Å; H511-Y513 AromaticContact CD2-CD2 3.7Å; H511-Y513 AromaticContact CD2-CE2 3.93Å; H511-Y513 AromaticContact CD2-CG 3.64Å; H511-Y513 PolarHBondContact CD2-N 3.32Å; H511-Y513 VanDerWaalsContact CD2-N 3.29Å; H511-Y513 VanDerWaalsContact O-CD2 3.22Å; H511-Y513 WeakPolarHBondContact O-CD2 3.33Å; H511-Y513 WeakPolarHBondContact O-CE2 3.39Å
514	S	85.3	Confident	84.2	Confident	34 Å²	34	79 Å²	79	24%	0.238	44%	0.437	C	S	.	.			trans	-98.1	147.1	176.9	-176.8	0	0	0	0	110.5	D512 D516 N517	D512-S514 PolarHBondContact O-N 3.04Å; S514-D516 PolarHBondContact O-N 3.01Å; S514-D516 PolarHBondContact OG-N 3.01Å; S514-N517 CarbonylContact O-C 3.48Å; S514-N517 PolarHBondContact O-N 3.46Å; S514-N517 VanDerWaalsContact O-N 3.15Å
515	E	84	Confident	83.9	Confident	98 Å²	98	79.8 Å²	79.8	46%	0.458	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-31.5	174.3	-174.6	172.4	177.5	0	0	112.6	W199 R218 N517	W199-E515 HydrophobicContact CD2-CB 4.28Å; W199-E515 HydrophobicContact CZ2-CB 3.9Å; W199-E515 HydrophobicContact CZ2-CG 3.78Å; R218-E515 IonicContact NH2-OE2 3.92Å; E515-N517 VanDerWaalsContact C-N 3.27Å; E515-N517 PolarHBondContact O-N 2.88Å
516	D	82.4	Confident	83.6	Confident	138 Å²	138	83.7 Å²	83.7	74%	0.738	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-22.7	-179.4	-61.4	-45	0	0	0	113.5	S514	S514-D516 PolarHBondContact O-N 3.01Å; S514-D516 PolarHBondContact OG-N 3.01Å
517	N	82.1	Confident	83.1	Confident	108 Å²	108	86.9 Å²	86.9	58%	0.578	48%	0.483	S	S	*	.	S	Bend	trans	-134.5	70.1	-175.4	-71.2	-52.5	0	0	0	110.5	H511 S514 E515	H511-N517 PolarHBondContact CE1-O 3.27Å; S514-N517 CarbonylContact O-C 3.48Å; S514-N517 PolarHBondContact O-N 3.46Å; S514-N517 VanDerWaalsContact O-N 3.15Å; E515-N517 VanDerWaalsContact C-N 3.27Å; E515-N517 PolarHBondContact O-N 2.88Å
518	P	82.4	Confident	83.1	Confident	45 Å²	45	78.6 Å²	78.6	29%	0.292	45%	0.45	S	S	.	.			trans	-73.6	151.6	-178.5	30.2	-34.6	0	0	0	112.5	H195 W199 L520	H195-P518 HydrophobicContact CB-CB 3.88Å; W199-P518 HydrophobicContact CH2-CB 3.91Å; W199-P518 HydrophobicContact CZ3-CB 4.1Å; P518-L520 PolarHBondContact O-N 2.8Å
519	R	79.3	Confident	82.9	Confident	86 Å²	86	77.9 Å²	77.9	33%	0.325	42%	0.415	S	S	.	.			trans	-79.3	115.6	166.6	-75.6	172.3	175.7	167	-7.7	109.1	H195 E198 D509	H195-R519 WeakPolarHBondContact CA-O 3.17Å; H195-R519 VanDerWaalsContact CB-O 3.23Å; H195-R519 WeakPolarHBondContact CB-O 3.48Å; E198-R519 IonicContact OE2-CZ 3.87Å; E198-R519 IonicContact OE2-NH1 2.9Å; E198-R519 PolarHBondContact OE2-NH1 2.95Å; D509-R519 IonicContact OD1-CZ 2.67Å; D509-R519 IonicContact OD1-NH2 2.67Å; D509-R519 PolarHBondContact OD1-NH2 3.46Å; D509-R519 IonicContact OD2-CZ 2.73Å; D509-R519 IonicContact OD2-NH1 3.6Å; D509-R519 IonicContact OD2-NH2 3.35Å; D509-R519 PolarHBondContact OD2-NH2 3.48Å
520	L	76.8	Confident	82.6	Confident	109 Å²	109	81.8 Å²	81.8	57%	0.571	44%	0.436	S	S	*	.	B	Isolated β-bridge	trans	-68.4	138	170.9	-61.1	174	0	0	0	109.6	H193 H195 P518	H193-L520 HydrophobicContact CB-CD2 4.3Å; H195-L520 HydrophobicContact CB-CD2 4.47Å; P518-L520 PolarHBondContact O-N 2.8Å
521	L	70.7	Confident	82.1	Confident	146 Å²	146	78.7 Å²	78.7	76%	0.764	41%	0.407	S	S	*	.			trans	-77.8	0	179.3	-81.5	166.8	0	0	0	113.2	E187 Q194 T196	E187-L521 HydrophobicContact CB-CD1 4.44Å; E187-L521 HydrophobicContact CG-CD1 3.92Å; Q194-L521 HydrophobicContact CB-CD1 4.45Å; Q194-L521 HydrophobicContact CG-CD1 3.97Å; Q194-L521 WeakPolarHBondContact O-CB 3.42Å; Q194-L521 PolarHBondContact O-N 2.92Å; T196-L521 HydrophobicContact CG2-CD1 3.93Å; T196-L521 HydrophobicContact CG2-CD2 3.92Å; T196-L521 HydrophobicContact CG2-CG 4.11Å

Retrieved 521 of 521 residues in 790.7 ms (Link to these results)

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