A0A3Q0KU76_SCHMA Loading...

Vacuolar protein sorting-associated protein 52 homolog

AlphaFold DB , UniProt , Accession A0A3Q0KU76, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 802 aa.

						>A0A3Q0KU76_SCHMA|A0A3Q0KU76
MNADVISESLKTEIEEIALKSGIDVRDYAAQVESELTKIEESLIKTYITVSPEVASLHNQIISCDAILERIENILTNFHEDLGAISTEIQDLQSKSLQMNTRLQNRQVVRSNLSQFLSDTAIPEELIRHIIYTPVTEQEFLENLHELNHKMNFSLEQSMVDYKSFNDVSVLLKKLRIKAVAKIREFLLGKIYSLRKPLTNYQVPQNQMLKFRFYNSFLLAHDREIAKEVRVEYINTMSKVYYAYFKAYGGKLTKLQLDTTYEKDDLLGKNPDKYNSSSSTSSLMFNSITNVTNNSTVSVSSNSGTRVGLFGLSDRALRVLSKSNLESAIILPHVASNVDAKYPIEVLFRSIHYALLDTACREYYFLSDFFLLSTETESVDSPPSCDQSAPNQGRTQSGLALAHLFEQVMSRSLSWIHKFTGTFMISSCSHDAIGLLICLQLLHALLRLAKERGVPVLDNFWGKMTETLWVRVTDRLDVHIASMLQYLDVSSFSTDARDIMKSNLSTLNVSAPTNTTGNTTVGLHPKMYALIRPHSIARRYAELAASLHSIGHQFPGTPLFDDSTSKSKSSESSNLQYSLHTEPTFQQNHANLKPALDPRILSRLAQLQTQFEHVLNSLAKTFSRPKLAHIFLINNYDLVISVLTEHGAADSSEVVRCREAVAKHMTSYIDEALSPYFGCLISFVRDVEARSTSESRHQSKNQDELTQNIRSEEARVTRIVKGFNIDWKNSIEKIHDEIMMEFANFTLGTQIFQGLLAQLIQHYHRFQKVMTQSPYKNMPIRNQLVNIHQITNEMKKCKTNFS
					

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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	46.4	Very low	59.6	Low	229 Å²	229	113.7 Å²	113.7	100%	1.128	62%	0.622	S	S	*	*				0	-31.6	0	-123.7	176.3	160.6	0	0	113.7
2	N	56.9	Low	59.9	Low	122 Å²	122	111.4 Å²	111.4	65%	0.652	61%	0.614	S	S	*	*	H	α-helix	trans	-80.2	-21.9	179.3	-93.2	0.9	0	0	0	115.8	D4 I6	N2-D4 PolarHBondContact O-N 3.21Å; N2-I6 HydrophobicContact CB-CD1 3.88Å; N2-I6 WeakPolarHBondContact O-CB 3.43Å; N2-I6 WeakPolarHBondContact O-CD1 3.34Å; N2-I6 WeakPolarHBondContact O-CG1 3.44Å; N2-I6 PolarHBondContact O-N 3.35Å
3	A	55.7	Low	60.3	Low	74 Å²	74	111 Å²	111	61%	0.612	61%	0.605	S	S	*	*	H	α-helix	trans	-63.5	-41.6	-171.3	0	0	0	0	0	113.2	I6 S7	A3-I6 PolarHBondContact O-N 2.65Å; A3-S7 WeakPolarHBondContact O-CB 3.42Å; A3-S7 PolarHBondContact O-N 2.99Å
4	D	58.8	Low	60.4	Low	128 Å²	128	108.1 Å²	108.1	68%	0.684	59%	0.588	S	S	*	*	H	α-helix	trans	-69.8	-43.1	-177.6	-69.3	-29.2	0	0	0	112.2	N2 I6 S7 E8	N2-D4 PolarHBondContact O-N 3.21Å; D4-I6 VanDerWaalsContact C-N 3.35Å; D4-I6 PolarHBondContact O-N 2.94Å; D4-S7 PolarHBondContact O-N 3.42Å; D4-S7 VanDerWaalsContact O-N 3.17Å; D4-S7 PolarHBondContact O-OG 3.33Å; D4-E8 PolarHBondContact O-N 3.04Å
5	V	61.8	Low	60.6	Low	101 Å²	101	109.1 Å²	109.1	61%	0.612	59%	0.586	S	S	*	*	H	α-helix	trans	-64.3	-40.1	176.4	-178.1	0	0	0	0	111.3	S7 E8 S9	V5-S7 VanDerWaalsContact C-N 3.33Å; V5-E8 PolarHBondContact O-N 3.1Å; V5-S9 WeakPolarHBondContact O-CB 3.46Å; V5-S9 PolarHBondContact O-N 3.13Å
6	I	59.2	Low	60.6	Low	88 Å²	88	108.7 Å²	108.7	45%	0.451	58%	0.58	S	S	.	*	H	α-helix	trans	-64.5	-40.9	174.7	-67.4	166	0	0	0	110.1	N2 A3 D4 E8 L10	N2-I6 HydrophobicContact CB-CD1 3.88Å; N2-I6 WeakPolarHBondContact O-CB 3.43Å; N2-I6 WeakPolarHBondContact O-CD1 3.34Å; N2-I6 WeakPolarHBondContact O-CG1 3.44Å; N2-I6 PolarHBondContact O-N 3.35Å; A3-I6 PolarHBondContact O-N 2.65Å; D4-I6 VanDerWaalsContact C-N 3.35Å; D4-I6 PolarHBondContact O-N 2.94Å; I6-E8 PolarHBondContact O-N 3.44Å; I6-L10 HydrophobicContact CG2-CD1 3.61Å; I6-L10 HydrophobicContact CG2-CG 4.32Å; I6-L10 VanDerWaalsContact O-CB 3.28Å; I6-L10 WeakPolarHBondContact O-CB 3.36Å; I6-L10 WeakPolarHBondContact O-CG 3.35Å; I6-L10 PolarHBondContact O-N 3.45Å
7	S	61.4	Low	60.7	Low	66 Å²	66	106.1 Å²	106.1	46%	0.462	57%	0.565	S	S	.	*	H	α-helix	trans	-64.2	-40.8	179.9	81.9	0	0	0	0	112.1	A3 D4 V5 K11	A3-S7 WeakPolarHBondContact O-CB 3.42Å; A3-S7 PolarHBondContact O-N 2.99Å; D4-S7 PolarHBondContact O-N 3.42Å; D4-S7 VanDerWaalsContact O-N 3.17Å; D4-S7 PolarHBondContact O-OG 3.33Å; V5-S7 VanDerWaalsContact C-N 3.33Å; S7-K11 WeakPolarHBondContact O-CB 3.14Å; S7-K11 PolarHBondContact O-N 2.96Å
8	E	64.6	Low	60.5	Low	144 Å²	144	101.3 Å²	101.3	67%	0.673	54%	0.543	S	S	*	.	H	α-helix	trans	-74.1	-40.2	-178.8	-154.8	166.3	-151.6	0	0	111	D4 V5 I6 K11 T12	D4-E8 PolarHBondContact O-N 3.04Å; V5-E8 PolarHBondContact O-N 3.1Å; I6-E8 PolarHBondContact O-N 3.44Å; E8-K11 PolarHBondContact O-N 2.89Å; E8-T12 PolarHBondContact O-N 3.3Å; E8-T12 PolarHBondContact O-OG1 3.47Å
9	S	64.7	Low	60.3	Low	72 Å²	72	104.1 Å²	104.1	50%	0.503	56%	0.557	S	S	.	*	H	α-helix	trans	-61	-47.1	171.7	-170.4	0	0	0	0	112.1	V5 K11 T12 E13	V5-S9 WeakPolarHBondContact O-CB 3.46Å; V5-S9 PolarHBondContact O-N 3.13Å; S9-K11 VanDerWaalsContact C-N 3.34Å; S9-K11 PolarHBondContact O-N 3.37Å; S9-T12 PolarHBondContact O-N 3.5Å; S9-E13 WeakPolarHBondContact O-CB 3.46Å; S9-E13 PolarHBondContact O-N 3.49Å
10	L	61.7	Low	60.1	Low	85 Å²	85	107.1 Å²	107.1	45%	0.445	57%	0.565	S	S	.	*	H	α-helix	trans	-62.7	-40.8	177	-85.6	164	0	0	0	111.4	I6 T12 E13 I14	I6-L10 HydrophobicContact CG2-CD1 3.61Å; I6-L10 HydrophobicContact CG2-CG 4.32Å; I6-L10 VanDerWaalsContact O-CB 3.28Å; I6-L10 WeakPolarHBondContact O-CB 3.36Å; I6-L10 WeakPolarHBondContact O-CG 3.35Å; I6-L10 PolarHBondContact O-N 3.45Å; L10-T12 VanDerWaalsContact C-N 3.32Å; L10-T12 PolarHBondContact O-N 3.47Å; L10-E13 PolarHBondContact O-N 2.83Å; L10-I14 WeakPolarHBondContact O-CB 3.4Å; L10-I14 WeakPolarHBondContact O-CD1 3.39Å; L10-I14 WeakPolarHBondContact O-CG1 3.23Å; L10-I14 PolarHBondContact O-N 2.94Å
11	K	64.3	Low	59.9	Low	142 Å²	142	104.5 Å²	104.5	62%	0.617	56%	0.556	S	S	*	*	H	α-helix	trans	-63.2	-42.1	178.2	-138.9	179.7	-177.9	-168.8	0	111.3	S7 E8 S9 I14 E15	S7-K11 WeakPolarHBondContact O-CB 3.14Å; S7-K11 PolarHBondContact O-N 2.96Å; E8-K11 PolarHBondContact O-N 2.89Å; S9-K11 VanDerWaalsContact C-N 3.34Å; S9-K11 PolarHBondContact O-N 3.37Å; K11-I14 PolarHBondContact O-N 2.89Å; K11-E15 WeakPolarHBondContact O-CB 3.34Å; K11-E15 WeakPolarHBondContact O-CG 3.34Å; K11-E15 PolarHBondContact O-N 2.94Å
12	T	63.6	Low	60.3	Low	86 Å²	86	97 Å²	97	53%	0.528	54%	0.538	S	S	.	.	H	α-helix	trans	-66.8	-39.6	177.5	-39.7	0	0	0	0	111.1	E8 S9 L10 E15 E16	E8-T12 PolarHBondContact O-N 3.3Å; E8-T12 PolarHBondContact O-OG1 3.47Å; S9-T12 PolarHBondContact O-N 3.5Å; L10-T12 VanDerWaalsContact C-N 3.32Å; L10-T12 PolarHBondContact O-N 3.47Å; T12-E15 PolarHBondContact O-N 2.94Å; T12-E16 WeakPolarHBondContact O-CB 3.36Å; T12-E16 PolarHBondContact O-N 3.48Å
13	E	64.7	Low	60.3	Low	106 Å²	106	95.7 Å²	95.7	50%	0.495	53%	0.529	S	S	.	.	H	α-helix	trans	-69.9	-39	177.7	-165.3	169.9	-159.5	0	0	112	S9 L10 E16 I17	S9-E13 WeakPolarHBondContact O-CB 3.46Å; S9-E13 PolarHBondContact O-N 3.49Å; L10-E13 PolarHBondContact O-N 2.83Å; E13-E16 PolarHBondContact O-N 2.66Å; E13-I17 HydrophobicContact CG-CD1 4.14Å; E13-I17 WeakPolarHBondContact O-CB 3.42Å; E13-I17 WeakPolarHBondContact O-CG1 3.35Å; E13-I17 PolarHBondContact O-N 3.15Å
14	I	62	Low	60.4	Low	71 Å²	71	96.8 Å²	96.8	36%	0.364	53%	0.525	S	S	.	.	H	α-helix	trans	-64.4	-43.8	172.8	-68.3	163	0	0	0	110.5	L10 K11 I17 A18 V25	L10-I14 WeakPolarHBondContact O-CB 3.4Å; L10-I14 WeakPolarHBondContact O-CD1 3.39Å; L10-I14 WeakPolarHBondContact O-CG1 3.23Å; L10-I14 PolarHBondContact O-N 2.94Å; K11-I14 PolarHBondContact O-N 2.89Å; I14-I17 PolarHBondContact O-N 3.49Å; I14-A18 VanDerWaalsContact O-CB 3.23Å; I14-A18 WeakPolarHBondContact O-CB 3.37Å; I14-A18 PolarHBondContact O-N 3.48Å; I14-V25 HydrophobicContact CG2-CG1 4.15Å
15	E	62.5	Low	60.3	Low	122 Å²	122	94.1 Å²	94.1	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-63.8	-40.7	175.4	-78.6	-179.6	-176.4	0	0	111.6	K11 T12 A18 L19	K11-E15 WeakPolarHBondContact O-CB 3.34Å; K11-E15 WeakPolarHBondContact O-CG 3.34Å; K11-E15 PolarHBondContact O-N 2.94Å; T12-E15 PolarHBondContact O-N 2.94Å; E15-A18 PolarHBondContact O-N 3.47Å; E15-L19 WeakPolarHBondContact O-CB 3.46Å; E15-L19 PolarHBondContact O-N 2.89Å
16	E	62	Low	60.3	Low	103 Å²	103	99 Å²	99	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-42.5	176.7	-162.4	-170.8	162.5	0	0	112.2	T12 E13 L19 K20	T12-E16 WeakPolarHBondContact O-CB 3.36Å; T12-E16 PolarHBondContact O-N 3.48Å; E13-E16 PolarHBondContact O-N 2.66Å; E16-L19 PolarHBondContact O-N 3.03Å; E16-K20 HydrophobicContact CG-CD 4.38Å; E16-K20 WeakPolarHBondContact O-CB 3.45Å; E16-K20 PolarHBondContact O-N 3.37Å; E16-K20 WeakPolarHBondContact OE1-CE 3.44Å; E16-K20 IonicContact OE1-NZ 3.35Å; E16-K20 PolarHBondContact OE1-NZ 3.22Å
17	I	60.8	Low	60.5	Low	64 Å²	64	100.1 Å²	100.1	33%	0.328	53%	0.528	S	S	.	.	H	α-helix	trans	-64.9	-43.2	176.1	-68.9	166.6	0	0	0	110.4	E13 I14 K20 S21 Y28	E13-I17 HydrophobicContact CG-CD1 4.14Å; E13-I17 WeakPolarHBondContact O-CB 3.42Å; E13-I17 WeakPolarHBondContact O-CG1 3.35Å; E13-I17 PolarHBondContact O-N 3.15Å; I14-I17 PolarHBondContact O-N 3.49Å; I17-K20 PolarHBondContact O-N 2.92Å; I17-S21 WeakPolarHBondContact O-CB 3.38Å; I17-S21 PolarHBondContact O-N 2.97Å; I17-S21 PolarHBondContact O-OG 3.06Å; I17-Y28 HydrophobicContact CG2-CE2 4.43Å
18	A	57.1	Low	60.6	Low	21 Å²	21	101.8 Å²	101.8	17%	0.174	52%	0.524	C	S	.	.	H	α-helix	trans	-62.1	-43.9	177.7	0	0	0	0	0	111.9	I14 E15 G22 V25	I14-A18 VanDerWaalsContact O-CB 3.23Å; I14-A18 WeakPolarHBondContact O-CB 3.37Å; I14-A18 PolarHBondContact O-N 3.48Å; E15-A18 PolarHBondContact O-N 3.47Å; A18-G22 PolarHBondContact O-N 3.33Å; A18-V25 HydrophobicContact CB-CG2 3.75Å
19	L	57.1	Low	60.7	Low	154 Å²	154	97.4 Å²	97.4	81%	0.806	51%	0.513	S	S	*	.	H	α-helix	trans	-71.4	-38.6	179.7	-118.8	134.3	0	0	0	112.8	E15 E16	E15-L19 WeakPolarHBondContact O-CB 3.46Å; E15-L19 PolarHBondContact O-N 2.89Å; E16-L19 PolarHBondContact O-N 3.03Å
20	K	56.9	Low	60.9	Low	163 Å²	163	96.6 Å²	96.6	71%	0.709	51%	0.51	S	S	*	.	H	α-helix	trans	-72	-31.9	178.6	-88.2	178.2	173.5	163.7	0	113.4	E16 I17	E16-K20 HydrophobicContact CG-CD 4.38Å; E16-K20 WeakPolarHBondContact O-CB 3.45Å; E16-K20 PolarHBondContact O-N 3.37Å; E16-K20 WeakPolarHBondContact OE1-CE 3.44Å; E16-K20 IonicContact OE1-NZ 3.35Å; E16-K20 PolarHBondContact OE1-NZ 3.22Å; I17-K20 PolarHBondContact O-N 2.92Å
21	S	56.3	Low	61.4	Low	53 Å²	53	98.9 Å²	98.9	37%	0.371	52%	0.519	S	S	.	.	H	α-helix	trans	-94.2	-13.1	-174.6	62.8	0	0	0	0	114.3	I17 I23	I17-S21 WeakPolarHBondContact O-CB 3.38Å; I17-S21 PolarHBondContact O-N 2.97Å; I17-S21 PolarHBondContact O-OG 3.06Å; S21-I23 WeakPolarHBondContact O-CG1 3.34Å; S21-I23 PolarHBondContact O-N 3.22Å; S21-I23 VanDerWaalsContact O-N 3.15Å
22	G	54.2	Low	61.8	Low	73 Å²	73	95.1 Å²	95.1	75%	0.753	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	21.9	-179	0	0	0	0	0	113.1	A18	A18-G22 PolarHBondContact O-N 3.33Å
23	I	57.6	Low	62.4	Low	93 Å²	93	97.8 Å²	97.8	48%	0.477	51%	0.514	S	S	.	.			trans	-106.2	132.6	-179.3	-66.4	161.1	0	0	0	107.9	S21 V25	S21-I23 WeakPolarHBondContact O-CG1 3.34Å; S21-I23 PolarHBondContact O-N 3.22Å; S21-I23 VanDerWaalsContact O-N 3.15Å; I23-V25 PolarHBondContact O-N 3.48Å
24	D	56.2	Low	63	Low	98 Å²	98	95.5 Å²	95.5	52%	0.524	51%	0.51	S	S	.	.			trans	-59.9	129.3	179.4	-167	-29.2	0	0	0	110.7	R26 D27 Y28	D24-R26 PolarHBondContact O-N 3Å; D24-R26 VanDerWaalsContact O-N 3.1Å; D24-R26 PolarHBondContact OD1-N 3.17Å; D24-D27 PolarHBondContact O-N 3.48Å; D24-Y28 PolarHBondContact O-N 3Å
25	V	56.8	Low	63.8	Low	72 Å²	72	96.8 Å²	96.8	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-57.6	-27.3	-176	-164.4	0	0	0	0	112	I14 A18 I23 A29	I14-V25 HydrophobicContact CG2-CG1 4.15Å; A18-V25 HydrophobicContact CB-CG2 3.75Å; I23-V25 PolarHBondContact O-N 3.48Å; V25-A29 WeakPolarHBondContact O-CB 3.13Å; V25-A29 PolarHBondContact O-N 2.73Å
26	R	63.5	Low	64.5	Low	204 Å²	204	95.6 Å²	95.6	77%	0.77	51%	0.512	S	S	*	.	H	α-helix	trans	-67.6	-38.9	177.7	-67.2	-179.2	-178.1	-176.6	2.1	112.4	D24 A30	D24-R26 PolarHBondContact O-N 3Å; D24-R26 VanDerWaalsContact O-N 3.1Å; D24-R26 PolarHBondContact OD1-N 3.17Å; R26-A30 WeakPolarHBondContact O-CB 3.42Å; R26-A30 PolarHBondContact O-N 3Å; R26-A30 VanDerWaalsContact O-N 3.13Å
27	D	63.5	Low	65.2	Low	111 Å²	111	94.1 Å²	94.1	59%	0.594	51%	0.509	S	S	*	.	H	α-helix	trans	-72.2	-38	177.9	-72.5	-18.7	0	0	0	110.6	D24 A30 Q31	D24-D27 PolarHBondContact O-N 3.48Å; D27-A30 PolarHBondContact O-N 3.46Å; D27-Q31 PolarHBondContact O-N 2.9Å
28	Y	62.6	Low	66.1	Low	100 Å²	100	96.8 Å²	96.8	39%	0.392	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-43.1	175.7	-168.6	-98.8	0	0	0	112.5	I17 D24 A30 Q31 V32	I17-Y28 HydrophobicContact CG2-CE2 4.43Å; D24-Y28 PolarHBondContact O-N 3Å; Y28-A30 PolarHBondContact O-N 3.03Å; Y28-Q31 PolarHBondContact O-N 3.32Å; Y28-V32 HydrophobicContact CD1-CG2 4.04Å; Y28-V32 HydrophobicContact CE1-CG2 3.68Å; Y28-V32 WeakPolarHBondContact O-CG2 3.28Å; Y28-V32 PolarHBondContact O-N 3.47Å
29	A	66.5	Low	67.1	Low	52 Å²	52	100.2 Å²	100.2	43%	0.43	53%	0.533	S	S	.	.	H	α-helix	trans	-61.1	-44.1	176.1	0	0	0	0	0	111.8	V25 Q31 V32 E33	V25-A29 WeakPolarHBondContact O-CB 3.13Å; V25-A29 PolarHBondContact O-N 2.73Å; A29-Q31 VanDerWaalsContact C-N 3.28Å; A29-Q31 PolarHBondContact O-N 2.67Å; A29-V32 PolarHBondContact O-N 3.41Å; A29-E33 WeakPolarHBondContact O-CB 3.21Å; A29-E33 PolarHBondContact O-N 2.89Å
30	A	69.6	Low	67.9	Low	55 Å²	55	98.1 Å²	98.1	46%	0.455	52%	0.519	S	S	.	.	H	α-helix	trans	-62.2	-35.9	176.4	0	0	0	0	0	112.3	R26 D27 Y28 S34	R26-A30 WeakPolarHBondContact O-CB 3.42Å; R26-A30 PolarHBondContact O-N 3Å; R26-A30 VanDerWaalsContact O-N 3.13Å; D27-A30 PolarHBondContact O-N 3.46Å; Y28-A30 PolarHBondContact O-N 3.03Å; A30-S34 WeakPolarHBondContact O-CB 3.42Å; A30-S34 PolarHBondContact O-N 2.87Å
31	Q	72.7	Confident	69	Low	133 Å²	133	96.9 Å²	96.9	62%	0.621	52%	0.516	S	S	*	.	H	α-helix	trans	-71.5	-41.1	177.2	-173.3	152.4	2.6	0	0	112.7	D27 Y28 A29 S34 E35	D27-Q31 PolarHBondContact O-N 2.9Å; Y28-Q31 PolarHBondContact O-N 3.32Å; A29-Q31 VanDerWaalsContact C-N 3.28Å; A29-Q31 PolarHBondContact O-N 2.67Å; Q31-S34 PolarHBondContact O-N 3.16Å; Q31-E35 PolarHBondContact O-N 2.97Å
32	V	72.7	Confident	70	Confident	64 Å²	64	97.6 Å²	97.6	39%	0.388	52%	0.521	S	S	.	.	H	α-helix	trans	-64.4	-42.6	174.4	174.1	0	0	0	0	110.8	Y28 A29 S34 E35 L36	Y28-V32 HydrophobicContact CD1-CG2 4.04Å; Y28-V32 HydrophobicContact CE1-CG2 3.68Å; Y28-V32 WeakPolarHBondContact O-CG2 3.28Å; Y28-V32 PolarHBondContact O-N 3.47Å; A29-V32 PolarHBondContact O-N 3.41Å; V32-S34 VanDerWaalsContact C-N 3.28Å; V32-S34 PolarHBondContact O-N 3.02Å; V32-E35 PolarHBondContact O-N 2.84Å; V32-E35 VanDerWaalsContact O-N 3.16Å; V32-L36 VanDerWaalsContact O-CB 3.32Å; V32-L36 WeakPolarHBondContact O-CB 3.36Å; V32-L36 PolarHBondContact O-N 3.31Å
33	E	76	Confident	71	Confident	142 Å²	142	99.4 Å²	99.4	66%	0.664	51%	0.513	S	S	*	.	H	α-helix	trans	-63.5	-36	177.4	-155.5	168	-149	0	0	111.4	A29 T37	A29-E33 WeakPolarHBondContact O-CB 3.21Å; A29-E33 PolarHBondContact O-N 2.89Å; E33-T37 WeakPolarHBondContact O-CB 3.32Å; E33-T37 WeakPolarHBondContact O-CG2 3.34Å; E33-T37 PolarHBondContact O-N 2.93Å; E33-T37 PolarHBondContact O-OG1 2.76Å
34	S	76.8	Confident	71.9	Confident	58 Å²	58	99.8 Å²	99.8	41%	0.406	52%	0.515	S	S	.	.	H	α-helix	trans	-69.1	-35	172.3	-177	0	0	0	0	113.8	A30 Q31 V32 T37 K38	A30-S34 WeakPolarHBondContact O-CB 3.42Å; A30-S34 PolarHBondContact O-N 2.87Å; Q31-S34 PolarHBondContact O-N 3.16Å; V32-S34 VanDerWaalsContact C-N 3.28Å; V32-S34 PolarHBondContact O-N 3.02Å; S34-T37 WeakPolarHBondContact CA-OG1 3.44Å; S34-T37 PolarHBondContact O-OG1 3.28Å; S34-T37 VanDerWaalsContact O-OG1 3.06Å; S34-K38 WeakPolarHBondContact O-CG 3.37Å; S34-K38 PolarHBondContact O-N 3.4Å
35	E	77.6	Confident	72.9	Confident	97 Å²	97	102.1 Å²	102.1	45%	0.453	52%	0.52	S	S	.	.	H	α-helix	trans	-73.1	-38.7	175.5	-77.9	-74.1	124	0	0	111.1	Q31 V32 K38 I39	Q31-E35 PolarHBondContact O-N 2.97Å; V32-E35 PolarHBondContact O-N 2.84Å; V32-E35 VanDerWaalsContact O-N 3.16Å; E35-K38 WeakPolarHBondContact O-CB 3.47Å; E35-K38 PolarHBondContact O-N 3.33Å; E35-K38 IonicContact OE1-NZ 3.6Å; E35-I39 WeakPolarHBondContact O-CG1 3.27Å; E35-I39 PolarHBondContact O-N 3.06Å
36	L	77.7	Confident	73.7	Confident	98 Å²	98	102.2 Å²	102.2	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-69.2	-41.6	-178.9	-150.5	145.7	0	0	0	111.4	V32 K38 I39 E40	V32-L36 VanDerWaalsContact O-CB 3.32Å; V32-L36 WeakPolarHBondContact O-CB 3.36Å; V32-L36 PolarHBondContact O-N 3.31Å; L36-K38 VanDerWaalsContact C-N 3.33Å; L36-K38 PolarHBondContact O-N 2.83Å; L36-I39 PolarHBondContact O-N 3.23Å; L36-E40 HydrophobicContact CD2-CG 4.35Å; L36-E40 WeakPolarHBondContact O-CB 3.48Å; L36-E40 PolarHBondContact O-N 3.46Å
37	T	77.8	Confident	74.1	Confident	71 Å²	71	101.4 Å²	101.4	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-62.8	-37.4	172.2	45.9	0	0	0	0	112.3	E33 S34 E41	E33-T37 WeakPolarHBondContact O-CB 3.32Å; E33-T37 WeakPolarHBondContact O-CG2 3.34Å; E33-T37 PolarHBondContact O-N 2.93Å; E33-T37 PolarHBondContact O-OG1 2.76Å; S34-T37 WeakPolarHBondContact CA-OG1 3.44Å; S34-T37 PolarHBondContact O-OG1 3.28Å; S34-T37 VanDerWaalsContact O-OG1 3.06Å; T37-E41 WeakPolarHBondContact O-CB 3.45Å; T37-E41 PolarHBondContact O-N 2.92Å
38	K	79.8	Confident	74.7	Confident	121 Å²	121	101.6 Å²	101.6	53%	0.526	52%	0.519	S	S	.	.	H	α-helix	trans	-64.9	-41.8	172.4	-85.2	179	-177	168	0	113	S34 E35 L36 E41 S42	S34-K38 WeakPolarHBondContact O-CG 3.37Å; S34-K38 PolarHBondContact O-N 3.4Å; E35-K38 WeakPolarHBondContact O-CB 3.47Å; E35-K38 PolarHBondContact O-N 3.33Å; E35-K38 IonicContact OE1-NZ 3.6Å; L36-K38 VanDerWaalsContact C-N 3.33Å; L36-K38 PolarHBondContact O-N 2.83Å; K38-E41 PolarHBondContact O-N 2.93Å; K38-S42 WeakPolarHBondContact O-CB 3.2Å; K38-S42 PolarHBondContact O-N 2.82Å
39	I	76.9	Confident	75.4	Confident	93 Å²	93	101.5 Å²	101.5	48%	0.477	53%	0.529	S	S	.	.	H	α-helix	trans	-69.4	-41.7	178.8	-70.2	165.7	0	0	0	110.5	E35 L36 S42 L43	E35-I39 WeakPolarHBondContact O-CG1 3.27Å; E35-I39 PolarHBondContact O-N 3.06Å; L36-I39 PolarHBondContact O-N 3.23Å; I39-S42 CarbonylContact O-C 3.58Å; I39-S42 WeakPolarHBondContact O-CB 3.43Å; I39-S42 PolarHBondContact O-N 2.8Å; I39-S42 VanDerWaalsContact O-N 3.16Å; I39-L43 HydrophobicContact CG2-CD1 3.86Å; I39-L43 HydrophobicContact CG2-CG 4.35Å; I39-L43 WeakPolarHBondContact O-CB 3.47Å; I39-L43 PolarHBondContact O-N 2.7Å
40	E	75.2	Confident	75.9	Confident	109 Å²	109	102.1 Å²	102.1	51%	0.509	53%	0.527	S	S	.	.	H	α-helix	trans	-60	-47	172.7	-86.3	-169.5	144.2	0	0	111.2	L36 S42 L43 I44	L36-E40 HydrophobicContact CD2-CG 4.35Å; L36-E40 WeakPolarHBondContact O-CB 3.48Å; L36-E40 PolarHBondContact O-N 3.46Å; E40-S42 PolarHBondContact O-N 3.3Å; E40-L43 PolarHBondContact O-N 3.3Å; E40-I44 VanDerWaalsContact O-CB 3.27Å; E40-I44 WeakPolarHBondContact O-CB 3.35Å; E40-I44 WeakPolarHBondContact O-CG1 3.32Å; E40-I44 PolarHBondContact O-N 3.5Å
41	E	78.2	Confident	76.3	Confident	137 Å²	137	102.6 Å²	102.6	64%	0.64	53%	0.527	S	S	*	.	H	α-helix	trans	-58.4	-38.5	174	-97.9	-164.2	139.1	0	0	112	T37 K38 K45	T37-E41 WeakPolarHBondContact O-CB 3.45Å; T37-E41 PolarHBondContact O-N 2.92Å; K38-E41 PolarHBondContact O-N 2.93Å; E41-K45 VanDerWaalsContact O-CB 3.26Å; E41-K45 WeakPolarHBondContact O-CB 3.19Å; E41-K45 PolarHBondContact O-N 2.86Å
42	S	78.3	Confident	76.7	Confident	68 Å²	68	100 Å²	100	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-69.2	-44.2	178.2	-174.8	0	0	0	0	112.5	K38 I39 E40 K45 T46	K38-S42 WeakPolarHBondContact O-CB 3.2Å; K38-S42 PolarHBondContact O-N 2.82Å; I39-S42 CarbonylContact O-C 3.58Å; I39-S42 WeakPolarHBondContact O-CB 3.43Å; I39-S42 PolarHBondContact O-N 2.8Å; I39-S42 VanDerWaalsContact O-N 3.16Å; E40-S42 PolarHBondContact O-N 3.3Å; S42-K45 WeakPolarHBondContact O-CB 3.36Å; S42-K45 PolarHBondContact O-N 3.18Å; S42-T46 WeakPolarHBondContact O-CB 3.44Å; S42-T46 PolarHBondContact O-N 3.49Å; S42-T46 PolarHBondContact O-OG1 2.79Å
43	L	74.2	Confident	77	Confident	112 Å²	112	103.7 Å²	103.7	59%	0.586	54%	0.535	S	S	*	.	H	α-helix	trans	-68.6	-43.4	178.2	-80.1	169	0	0	0	111.5	I39 E40 K45 T46 Y47	I39-L43 HydrophobicContact CG2-CD1 3.86Å; I39-L43 HydrophobicContact CG2-CG 4.35Å; I39-L43 WeakPolarHBondContact O-CB 3.47Å; I39-L43 PolarHBondContact O-N 2.7Å; E40-L43 PolarHBondContact O-N 3.3Å; L43-K45 VanDerWaalsContact C-N 3.32Å; L43-K45 PolarHBondContact O-N 2.87Å; L43-T46 PolarHBondContact O-N 3.4Å; L43-Y47 WeakPolarHBondContact O-CB 3.48Å; L43-Y47 PolarHBondContact O-N 3.16Å
44	I	76.7	Confident	77.2	Confident	100 Å²	100	101.3 Å²	101.3	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-61.3	-44.4	174.1	-68.8	168.7	0	0	0	109.5	E40 T46 Y47 I48	E40-I44 VanDerWaalsContact O-CB 3.27Å; E40-I44 WeakPolarHBondContact O-CB 3.35Å; E40-I44 WeakPolarHBondContact O-CG1 3.32Å; E40-I44 PolarHBondContact O-N 3.5Å; I44-T46 VanDerWaalsContact C-N 3.35Å; I44-T46 PolarHBondContact O-N 3.43Å; I44-Y47 PolarHBondContact O-N 3.25Å; I44-I48 HydrophobicContact CG2-CD1 3.63Å; I44-I48 HydrophobicContact CG2-CG1 4.32Å; I44-I48 WeakPolarHBondContact O-CB 3.44Å; I44-I48 WeakPolarHBondContact O-CG1 3.49Å; I44-I48 PolarHBondContact O-N 2.84Å
45	K	77.5	Confident	77.4	Confident	148 Å²	148	100.7 Å²	100.7	64%	0.643	53%	0.528	S	S	*	.	H	α-helix	trans	-56	-50.5	172.4	-103.6	176.2	174	166.2	0	111.3	E41 S42 L43 Y47 I48 T49	E41-K45 VanDerWaalsContact O-CB 3.26Å; E41-K45 WeakPolarHBondContact O-CB 3.19Å; E41-K45 PolarHBondContact O-N 2.86Å; S42-K45 WeakPolarHBondContact O-CB 3.36Å; S42-K45 PolarHBondContact O-N 3.18Å; L43-K45 VanDerWaalsContact C-N 3.32Å; L43-K45 PolarHBondContact O-N 2.87Å; K45-Y47 VanDerWaalsContact C-N 3.34Å; K45-Y47 PolarHBondContact O-N 3.44Å; K45-I48 WeakPolarHBondContact O-CB 3.26Å; K45-I48 PolarHBondContact O-N 3.33Å; K45-T49 PolarHBondContact O-N 2.73Å; K45-T49 PolarHBondContact O-OG1 2.87Å
46	T	74	Confident	77.8	Confident	73 Å²	73	98.9 Å²	98.9	45%	0.448	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-40.7	-176.9	-47.6	0	0	0	0	111.6	S42 L43 I44 T49 V50	S42-T46 WeakPolarHBondContact O-CB 3.44Å; S42-T46 PolarHBondContact O-N 3.49Å; S42-T46 PolarHBondContact O-OG1 2.79Å; L43-T46 PolarHBondContact O-N 3.4Å; I44-T46 VanDerWaalsContact C-N 3.35Å; I44-T46 PolarHBondContact O-N 3.43Å; T46-T49 WeakPolarHBondContact O-CB 3.41Å; T46-T49 PolarHBondContact O-N 3.47Å; T46-T49 VanDerWaalsContact O-N 3.14Å; T46-V50 WeakPolarHBondContact O-CG2 3.27Å; T46-V50 PolarHBondContact O-N 2.98Å
47	Y	71.1	Confident	78.1	Confident	188 Å²	188	99 Å²	99	74%	0.737	53%	0.527	S	S	*	.	H	α-helix	trans	-67.5	-38.6	176.9	-154.1	-87.4	0	0	0	111.9	L43 I44 K45 T49 V50 S51	L43-Y47 WeakPolarHBondContact O-CB 3.48Å; L43-Y47 PolarHBondContact O-N 3.16Å; I44-Y47 PolarHBondContact O-N 3.25Å; K45-Y47 VanDerWaalsContact C-N 3.34Å; K45-Y47 PolarHBondContact O-N 3.44Å; Y47-T49 VanDerWaalsContact C-N 3.28Å; Y47-T49 PolarHBondContact O-N 2.92Å; Y47-V50 PolarHBondContact O-N 3.38Å; Y47-S51 VanDerWaalsContact O-CB 3.27Å; Y47-S51 WeakPolarHBondContact O-CB 3.41Å; Y47-S51 PolarHBondContact O-N 3.37Å
48	I	77	Confident	78.4	Confident	114 Å²	114	101.1 Å²	101.1	59%	0.585	53%	0.532	S	S	*	.	H	α-helix	trans	-62.3	-37.9	170.5	-72.4	169	0	0	0	110.5	I44 K45 P52	I44-I48 HydrophobicContact CG2-CD1 3.63Å; I44-I48 HydrophobicContact CG2-CG1 4.32Å; I44-I48 WeakPolarHBondContact O-CB 3.44Å; I44-I48 WeakPolarHBondContact O-CG1 3.49Å; I44-I48 PolarHBondContact O-N 2.84Å; K45-I48 WeakPolarHBondContact O-CB 3.26Å; K45-I48 PolarHBondContact O-N 3.33Å; I48-P52 WeakPolarHBondContact O-CD 3.34Å
49	T	77.2	Confident	78.8	Confident	98 Å²	98	100.3 Å²	100.3	60%	0.601	53%	0.533	S	S	*	.	H	α-helix	trans	-68.2	-35.8	177.3	-38	0	0	0	0	112.5	K45 T46 Y47 P52	K45-T49 PolarHBondContact O-N 2.73Å; K45-T49 PolarHBondContact O-OG1 2.87Å; T46-T49 WeakPolarHBondContact O-CB 3.41Å; T46-T49 PolarHBondContact O-N 3.47Å; T46-T49 VanDerWaalsContact O-N 3.14Å; Y47-T49 VanDerWaalsContact C-N 3.28Å; Y47-T49 PolarHBondContact O-N 2.92Å; T49-P52 WeakPolarHBondContact O-CD 3.46Å; T49-P52 VanDerWaalsContact O-CG 3.3Å; T49-P52 WeakPolarHBondContact O-CG 3.34Å
50	V	77.9	Confident	79.3	Confident	65 Å²	65	101.2 Å²	101.2	39%	0.394	54%	0.535	S	S	.	.	H	α-helix	trans	-89.6	-26.6	-176.9	177.2	0	0	0	0	113.3	T46 Y47 P52 E53 V54	T46-V50 WeakPolarHBondContact O-CG2 3.27Å; T46-V50 PolarHBondContact O-N 2.98Å; Y47-V50 PolarHBondContact O-N 3.38Å; V50-P52 VanDerWaalsContact C-CD 3.43Å; V50-P52 VanDerWaalsContact C-N 3.32Å; V50-E53 PolarHBondContact O-N 3.14Å; V50-V54 HydrophobicContact CG1-CG2 3.96Å; V50-V54 PolarHBondContact O-N 3.47Å; V50-V54 VanDerWaalsContact O-N 3.15Å
51	S	77.3	Confident	80	Confident	65 Å²	65	100.3 Å²	100.3	46%	0.455	53%	0.533	S	S	.	.	H	α-helix	trans	-45.8	-44.4	174.5	179.9	0	0	0	0	114.5	Y47 A55	Y47-S51 VanDerWaalsContact O-CB 3.27Å; Y47-S51 WeakPolarHBondContact O-CB 3.41Å; Y47-S51 PolarHBondContact O-N 3.37Å; S51-A55 VanDerWaalsContact O-CB 3.26Å; S51-A55 WeakPolarHBondContact O-CB 3.5Å; S51-A55 PolarHBondContact O-N 3.23Å
52	P	79.9	Confident	80.5	Confident	78 Å²	78	97.8 Å²	97.8	51%	0.506	52%	0.523	S	S	.	.	H	α-helix	trans	-68.1	-32.2	178.3	24	-33.9	0	0	0	113.5	I48 T49 V50 S56	I48-P52 WeakPolarHBondContact O-CD 3.34Å; T49-P52 WeakPolarHBondContact O-CD 3.46Å; T49-P52 VanDerWaalsContact O-CG 3.3Å; T49-P52 WeakPolarHBondContact O-CG 3.34Å; V50-P52 VanDerWaalsContact C-CD 3.43Å; V50-P52 VanDerWaalsContact C-N 3.32Å; P52-S56 VanDerWaalsContact O-CB 3.31Å; P52-S56 WeakPolarHBondContact O-CB 3.1Å; P52-S56 PolarHBondContact O-N 3.03Å
53	E	79.2	Confident	81	Confident	142 Å²	142	97.2 Å²	97.2	66%	0.664	52%	0.519	S	S	*	.	H	α-helix	trans	-70.8	-43.5	177.9	-69.4	-172.5	165.4	0	0	111.9	V50 S56 L57	V50-E53 PolarHBondContact O-N 3.14Å; E53-S56 WeakPolarHBondContact O-CB 3.26Å; E53-S56 PolarHBondContact O-N 3.04Å; E53-L57 PolarHBondContact O-N 3.28Å
54	V	80.2	Confident	81.5	Confident	93 Å²	93	95.3 Å²	95.3	56%	0.564	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-40.6	176.4	177.4	0	0	0	0	111	V50 S56 L57 H58	V50-V54 HydrophobicContact CG1-CG2 3.96Å; V50-V54 PolarHBondContact O-N 3.47Å; V50-V54 VanDerWaalsContact O-N 3.15Å; V54-S56 VanDerWaalsContact C-N 3.31Å; V54-S56 PolarHBondContact O-N 2.98Å; V54-L57 PolarHBondContact O-N 3.15Å; V54-H58 WeakPolarHBondContact O-CB 3.31Å; V54-H58 PolarHBondContact O-N 3Å
55	A	81.2	Confident	82.1	Confident	45 Å²	45	95.1 Å²	95.1	37%	0.372	51%	0.514	S	S	.	.	H	α-helix	trans	-62.1	-39.9	173.6	0	0	0	0	0	111.6	S51 N59	S51-A55 VanDerWaalsContact O-CB 3.26Å; S51-A55 WeakPolarHBondContact O-CB 3.5Å; S51-A55 PolarHBondContact O-N 3.23Å; A55-N59 WeakPolarHBondContact O-CB 3.38Å; A55-N59 PolarHBondContact O-N 2.93Å; A55-N59 PolarHBondContact O-ND2 2.99Å
56	S	86.9	Confident	82.6	Confident	58 Å²	58	90.6 Å²	90.6	41%	0.406	50%	0.504	S	S	.	.	H	α-helix	trans	-61.6	-47	175.3	-178.9	0	0	0	0	112.2	P52 E53 V54 N59 Q60	P52-S56 VanDerWaalsContact O-CB 3.31Å; P52-S56 WeakPolarHBondContact O-CB 3.1Å; P52-S56 PolarHBondContact O-N 3.03Å; E53-S56 WeakPolarHBondContact O-CB 3.26Å; E53-S56 PolarHBondContact O-N 3.04Å; V54-S56 VanDerWaalsContact C-N 3.31Å; V54-S56 PolarHBondContact O-N 2.98Å; S56-N59 PolarHBondContact O-N 3Å; S56-Q60 WeakPolarHBondContact O-CG 3.3Å; S56-Q60 PolarHBondContact O-N 3.38Å
57	L	84.2	Confident	83.3	Confident	102 Å²	102	90.9 Å²	90.9	53%	0.534	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-42.3	178.7	-176.8	65.6	0	0	0	112.2	E53 V54 N59 Q60 I61	E53-L57 PolarHBondContact O-N 3.28Å; V54-L57 PolarHBondContact O-N 3.15Å; L57-N59 VanDerWaalsContact C-N 3.32Å; L57-N59 PolarHBondContact O-N 2.99Å; L57-Q60 PolarHBondContact O-N 3.13Å; L57-Q60 VanDerWaalsContact O-N 3.13Å; L57-I61 HydrophobicContact CG-CD1 4.33Å; L57-I61 PolarHBondContact O-N 3.13Å
58	H	84.5	Confident	84.1	Confident	114 Å²	114	87.1 Å²	87.1	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-61.6	-42.7	176.1	-172.3	57.7	0	0	0	111.4	V54 Q60 I61 I62	V54-H58 WeakPolarHBondContact O-CB 3.31Å; V54-H58 PolarHBondContact O-N 3Å; H58-Q60 VanDerWaalsContact C-N 3.29Å; H58-Q60 PolarHBondContact O-N 2.98Å; H58-I61 PolarHBondContact O-N 2.97Å; H58-I62 VanDerWaalsContact CD2-CD1 3.5Å; H58-I62 WeakPolarHBondContact CD2-CD1 3.32Å; H58-I62 VanDerWaalsContact NE2-CD1 3.34Å; H58-I62 WeakPolarHBondContact NE2-CD1 3.29Å; H58-I62 VanDerWaalsContact O-CG1 3.29Å; H58-I62 WeakPolarHBondContact O-CG1 3.38Å; H58-I62 PolarHBondContact O-N 3.31Å
59	N	87.5	Confident	84.7	Confident	104 Å²	104	87.6 Å²	87.6	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-61.5	-36	174	-74.2	-33.6	0	0	0	112.3	A55 S56 L57 S63	A55-N59 WeakPolarHBondContact O-CB 3.38Å; A55-N59 PolarHBondContact O-N 2.93Å; A55-N59 PolarHBondContact O-ND2 2.99Å; S56-N59 PolarHBondContact O-N 3Å; L57-N59 VanDerWaalsContact C-N 3.32Å; L57-N59 PolarHBondContact O-N 2.99Å; N59-S63 WeakPolarHBondContact O-CB 3.28Å; N59-S63 PolarHBondContact O-N 2.98Å
60	Q	87.7	Confident	85.3	Confident	113 Å²	113	90 Å²	90	53%	0.528	49%	0.492	S	S	.	.	H	α-helix	trans	-68.9	-42.9	175.7	-74.9	-179.6	11.4	0	0	112.7	S56 L57 H58 S63 C64	S56-Q60 WeakPolarHBondContact O-CG 3.3Å; S56-Q60 PolarHBondContact O-N 3.38Å; L57-Q60 PolarHBondContact O-N 3.13Å; L57-Q60 VanDerWaalsContact O-N 3.13Å; H58-Q60 VanDerWaalsContact C-N 3.29Å; H58-Q60 PolarHBondContact O-N 2.98Å; Q60-S63 WeakPolarHBondContact O-CB 3.39Å; Q60-S63 PolarHBondContact O-N 2.99Å; Q60-S63 VanDerWaalsContact O-N 3.13Å; Q60-S63 PolarHBondContact O-OG 3.47Å; Q60-C64 PolarHBondContact O-N 2.89Å; Q60-C64 PolarHBondContact O-SG 2.99Å
61	I	89.5	Confident	85.9	Confident	89 Å²	89	90.8 Å²	90.8	46%	0.456	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-46.3	177.2	-67.7	170.7	0	0	0	110.3	L57 H58 S63 C64 D65	L57-I61 HydrophobicContact CG-CD1 4.33Å; L57-I61 PolarHBondContact O-N 3.13Å; H58-I61 PolarHBondContact O-N 2.97Å; I61-S63 PolarHBondContact O-N 3.46Å; I61-C64 PolarHBondContact O-N 3.19Å; I61-D65 PolarHBondContact O-N 3.07Å
62	I	88.9	Confident	86.4	Confident	85 Å²	85	93.9 Å²	93.9	44%	0.436	50%	0.501	S	S	.	.	H	α-helix	trans	-57.9	-38.9	174.3	-67.9	164.6	0	0	0	110.8	H58 A66	H58-I62 VanDerWaalsContact CD2-CD1 3.5Å; H58-I62 WeakPolarHBondContact CD2-CD1 3.32Å; H58-I62 VanDerWaalsContact NE2-CD1 3.34Å; H58-I62 WeakPolarHBondContact NE2-CD1 3.29Å; H58-I62 VanDerWaalsContact O-CG1 3.29Å; H58-I62 WeakPolarHBondContact O-CG1 3.38Å; H58-I62 PolarHBondContact O-N 3.31Å; I62-A66 VanDerWaalsContact O-CB 3.28Å; I62-A66 WeakPolarHBondContact O-CB 3.49Å; I62-A66 PolarHBondContact O-N 3.31Å
63	S	88.4	Confident	86.9	Confident	56 Å²	56	94.1 Å²	94.1	39%	0.392	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-36.9	176.8	82.3	0	0	0	0	113.2	N59 Q60 I61 I67	N59-S63 WeakPolarHBondContact O-CB 3.28Å; N59-S63 PolarHBondContact O-N 2.98Å; Q60-S63 WeakPolarHBondContact O-CB 3.39Å; Q60-S63 PolarHBondContact O-N 2.99Å; Q60-S63 VanDerWaalsContact O-N 3.13Å; Q60-S63 PolarHBondContact O-OG 3.47Å; I61-S63 PolarHBondContact O-N 3.46Å; S63-I67 WeakPolarHBondContact O-CD1 3.45Å; S63-I67 VanDerWaalsContact O-CG1 3.24Å; S63-I67 WeakPolarHBondContact O-CG1 3.49Å; S63-I67 PolarHBondContact O-N 3.07Å; S63-I67 VanDerWaalsContact O-N 3.07Å
64	C	83.8	Confident	87.4	Confident	71 Å²	71	90.7 Å²	90.7	48%	0.48	48%	0.483	S	S	.	.	H	α-helix	trans	-71.2	-43.4	178.8	-72.9	0	0	0	0	111.8	Q60 I61 A66 I67 L68	Q60-C64 PolarHBondContact O-N 2.89Å; Q60-C64 PolarHBondContact O-SG 2.99Å; I61-C64 PolarHBondContact O-N 3.19Å; C64-A66 VanDerWaalsContact C-N 3.3Å; C64-A66 PolarHBondContact O-N 2.65Å; C64-I67 WeakPolarHBondContact O-CB 3.31Å; C64-I67 PolarHBondContact O-N 3.27Å; C64-I67 VanDerWaalsContact O-N 3.07Å; C64-L68 PolarHBondContact O-N 2.98Å
65	D	90.3	Very high	87.8	Confident	97 Å²	97	91.6 Å²	91.6	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-61.1	-42.3	174.3	-73.7	-17	0	0	0	110.5	I61 I67 L68 E69	I61-D65 PolarHBondContact O-N 3.07Å; D65-I67 PolarHBondContact O-N 3.07Å; D65-L68 PolarHBondContact O-N 2.96Å; D65-E69 WeakPolarHBondContact O-CB 3.33Å; D65-E69 PolarHBondContact O-N 3.45Å
66	A	88.6	Confident	88.2	Confident	52 Å²	52	92.3 Å²	92.3	43%	0.43	48%	0.484	S	S	.	.	H	α-helix	trans	-61.5	-31.2	174.1	0	0	0	0	0	113.1	I62 C64 R70	I62-A66 VanDerWaalsContact O-CB 3.28Å; I62-A66 WeakPolarHBondContact O-CB 3.49Å; I62-A66 PolarHBondContact O-N 3.31Å; C64-A66 VanDerWaalsContact C-N 3.3Å; C64-A66 PolarHBondContact O-N 2.65Å; A66-R70 VanDerWaalsContact O-CB 3.31Å; A66-R70 WeakPolarHBondContact O-CB 3.46Å; A66-R70 PolarHBondContact O-N 3.34Å
67	I	89.1	Confident	88.5	Confident	79 Å²	79	93.4 Å²	93.4	41%	0.405	49%	0.485	S	S	.	.	H	α-helix	trans	-74.4	-41.7	175.6	-69.6	162.5	0	0	0	111.2	S63 C64 D65 R70 I71	S63-I67 WeakPolarHBondContact O-CD1 3.45Å; S63-I67 VanDerWaalsContact O-CG1 3.24Å; S63-I67 WeakPolarHBondContact O-CG1 3.49Å; S63-I67 PolarHBondContact O-N 3.07Å; S63-I67 VanDerWaalsContact O-N 3.07Å; C64-I67 WeakPolarHBondContact O-CB 3.31Å; C64-I67 PolarHBondContact O-N 3.27Å; C64-I67 VanDerWaalsContact O-N 3.07Å; D65-I67 PolarHBondContact O-N 3.07Å; I67-R70 WeakPolarHBondContact O-CB 3.21Å; I67-R70 PolarHBondContact O-N 3.05Å; I67-I71 HydrophobicContact CG2-CD1 4.25Å; I67-I71 WeakPolarHBondContact O-CG1 3.24Å; I67-I71 PolarHBondContact O-N 3.08Å; I67-I71 VanDerWaalsContact O-N 3.08Å
68	L	86.6	Confident	88.8	Confident	109 Å²	109	94.7 Å²	94.7	57%	0.571	49%	0.487	S	S	*	.	H	α-helix	trans	-68.8	-43.9	179.8	-72	173.1	0	0	0	111.6	C64 D65 R70 I71 E72	C64-L68 PolarHBondContact O-N 2.98Å; D65-L68 PolarHBondContact O-N 2.96Å; L68-R70 PolarHBondContact O-N 3.24Å; L68-I71 PolarHBondContact O-N 2.92Å; L68-E72 PolarHBondContact O-N 3.25Å
69	E	90.1	Very high	89	Confident	125 Å²	125	96.2 Å²	96.2	58%	0.584	49%	0.494	S	S	*	.	H	α-helix	trans	-58	-35.8	173	-172.1	179.9	-175.8	0	0	111.1	D65 N73	D65-E69 WeakPolarHBondContact O-CB 3.33Å; D65-E69 PolarHBondContact O-N 3.45Å; E69-N73 WeakPolarHBondContact O-CB 3.2Å; E69-N73 PolarHBondContact O-N 3.02Å; E69-N73 PolarHBondContact O-ND2 3.09Å
70	R	90.3	Very high	89.1	Confident	149 Å²	149	97.8 Å²	97.8	56%	0.562	50%	0.498	S	S	*	.	H	α-helix	trans	-67.3	-39.6	173.8	-175.5	175.5	67.1	105.4	0.5	112.8	A66 I67 L68 I74	A66-R70 VanDerWaalsContact O-CB 3.31Å; A66-R70 WeakPolarHBondContact O-CB 3.46Å; A66-R70 PolarHBondContact O-N 3.34Å; I67-R70 WeakPolarHBondContact O-CB 3.21Å; I67-R70 PolarHBondContact O-N 3.05Å; L68-R70 PolarHBondContact O-N 3.24Å; R70-I74 HydrophobicContact CG-CD1 4.21Å; R70-I74 WeakPolarHBondContact O-CD1 3.39Å; R70-I74 WeakPolarHBondContact O-CG1 3.33Å; R70-I74 PolarHBondContact O-N 3.04Å; R70-I74 VanDerWaalsContact O-N 3.1Å
71	I	88.9	Confident	89.3	Confident	80 Å²	80	96.5 Å²	96.5	41%	0.41	50%	0.495	S	S	.	.	H	α-helix	trans	-71.9	-42.5	179.2	-68	168.7	0	0	0	110.9	I67 L68 N73 I74 L75	I67-I71 HydrophobicContact CG2-CD1 4.25Å; I67-I71 WeakPolarHBondContact O-CG1 3.24Å; I67-I71 PolarHBondContact O-N 3.08Å; I67-I71 VanDerWaalsContact O-N 3.08Å; L68-I71 PolarHBondContact O-N 2.92Å; I71-N73 VanDerWaalsContact C-N 3.33Å; I71-N73 PolarHBondContact O-N 3.02Å; I71-I74 WeakPolarHBondContact O-CB 3.47Å; I71-I74 PolarHBondContact O-N 3.49Å; I71-I74 VanDerWaalsContact O-N 3.09Å; I71-L75 HydrophobicContact CG2-CD1 4.34Å; I71-L75 PolarHBondContact O-N 3.08Å
72	E	88.7	Confident	89.3	Confident	131 Å²	131	98.2 Å²	98.2	61%	0.612	50%	0.504	S	S	*	.	H	α-helix	trans	-56.8	-50.5	175	-176.4	177	179.6	0	0	110.1	L68 I74 L75 T76	L68-E72 PolarHBondContact O-N 3.25Å; E72-I74 VanDerWaalsContact C-N 3.25Å; E72-I74 PolarHBondContact O-N 2.9Å; E72-L75 PolarHBondContact O-N 3.03Å; E72-L75 VanDerWaalsContact O-N 3.08Å; E72-T76 HydrophobicContact CG-CG2 4.48Å; E72-T76 PolarHBondContact O-N 3.28Å; E72-T76 PolarHBondContact O-OG1 3.41Å; E72-T76 VanDerWaalsContact O-OG1 3.05Å
73	N	90.3	Very high	89.5	Confident	82 Å²	82	95.8 Å²	95.8	44%	0.439	50%	0.5	S	S	.	.	H	α-helix	trans	-55.7	-38.8	174.3	-92.4	-39.6	0	0	0	112.7	E69 I71 T76 N77	E69-N73 WeakPolarHBondContact O-CB 3.2Å; E69-N73 PolarHBondContact O-N 3.02Å; E69-N73 PolarHBondContact O-ND2 3.09Å; I71-N73 VanDerWaalsContact C-N 3.33Å; I71-N73 PolarHBondContact O-N 3.02Å; N73-T76 WeakPolarHBondContact CA-OG1 3.42Å; N73-T76 PolarHBondContact O-OG1 2.79Å; N73-N77 WeakPolarHBondContact O-CB 3.4Å; N73-N77 PolarHBondContact O-N 2.96Å; N73-N77 PolarHBondContact O-ND2 3.1Å; N73-N77 PolarHBondContact O-OD1 3.32Å
74	I	90.1	Very high	89.6	Confident	70 Å²	70	95.8 Å²	95.8	36%	0.359	50%	0.503	S	S	.	.	H	α-helix	trans	-66	-42	177.8	-71.2	163	0	0	0	111.4	R70 I71 E72 F78	R70-I74 HydrophobicContact CG-CD1 4.21Å; R70-I74 WeakPolarHBondContact O-CD1 3.39Å; R70-I74 WeakPolarHBondContact O-CG1 3.33Å; R70-I74 PolarHBondContact O-N 3.04Å; R70-I74 VanDerWaalsContact O-N 3.1Å; I71-I74 WeakPolarHBondContact O-CB 3.47Å; I71-I74 PolarHBondContact O-N 3.49Å; I71-I74 VanDerWaalsContact O-N 3.09Å; E72-I74 VanDerWaalsContact C-N 3.25Å; E72-I74 PolarHBondContact O-N 2.9Å; I74-F78 HydrophobicContact CG2-CD2 3.57Å; I74-F78 HydrophobicContact CG2-CE2 3.39Å; I74-F78 WeakPolarHBondContact O-CD2 3.19Å; I74-F78 PolarHBondContact O-N 2.92Å
75	L	88.6	Confident	90	Very high	113 Å²	113	96.6 Å²	96.6	59%	0.592	50%	0.502	S	S	*	.	H	α-helix	trans	-73.2	-39.1	-179	-74.5	172.9	0	0	0	112.9	I71 E72 N77 F78 H79	I71-L75 HydrophobicContact CG2-CD1 4.34Å; I71-L75 PolarHBondContact O-N 3.08Å; E72-L75 PolarHBondContact O-N 3.03Å; E72-L75 VanDerWaalsContact O-N 3.08Å; L75-N77 VanDerWaalsContact C-N 3.32Å; L75-F78 PolarHBondContact O-N 3.4Å; L75-H79 WeakPolarHBondContact O-CB 3.4Å; L75-H79 PolarHBondContact O-N 2.81Å
76	T	90	Very high	89.9	Confident	60 Å²	60	94.7 Å²	94.7	37%	0.368	50%	0.496	S	S	.	.	H	α-helix	trans	-62.6	-43.4	172.9	50	0	0	0	0	110.2	E72 N73 F78 H79 E80	E72-T76 HydrophobicContact CG-CG2 4.48Å; E72-T76 PolarHBondContact O-N 3.28Å; E72-T76 PolarHBondContact O-OG1 3.41Å; E72-T76 VanDerWaalsContact O-OG1 3.05Å; N73-T76 WeakPolarHBondContact CA-OG1 3.42Å; N73-T76 PolarHBondContact O-OG1 2.79Å; T76-F78 PolarHBondContact O-N 3.32Å; T76-H79 PolarHBondContact O-N 3.48Å; T76-E80 WeakPolarHBondContact O-CG 3.49Å; T76-E80 PolarHBondContact O-N 3Å
77	N	92.1	Very high	89.9	Confident	80 Å²	80	96.5 Å²	96.5	43%	0.428	50%	0.502	S	S	.	.	H	α-helix	trans	-61	-44.9	173.8	-68.4	-18.1	0	0	0	111.8	N73 L75 H79 E80 D81	N73-N77 WeakPolarHBondContact O-CB 3.4Å; N73-N77 PolarHBondContact O-N 2.96Å; N73-N77 PolarHBondContact O-ND2 3.1Å; N73-N77 PolarHBondContact O-OD1 3.32Å; L75-N77 VanDerWaalsContact C-N 3.32Å; N77-H79 VanDerWaalsContact C-N 3.33Å; N77-H79 PolarHBondContact O-N 3.32Å; N77-E80 PolarHBondContact O-N 2.74Å; N77-D81 WeakPolarHBondContact O-CB 3.47Å; N77-D81 PolarHBondContact O-N 3.4Å
78	F	90	Very high	90.2	Very high	130 Å²	130	99 Å²	99	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-64.2	-35.1	176.7	-84.4	-55.3	0	0	0	113.5	I74 L75 T76 D81 L82	I74-F78 HydrophobicContact CG2-CD2 3.57Å; I74-F78 HydrophobicContact CG2-CE2 3.39Å; I74-F78 WeakPolarHBondContact O-CD2 3.19Å; I74-F78 PolarHBondContact O-N 2.92Å; L75-F78 PolarHBondContact O-N 3.4Å; T76-F78 PolarHBondContact O-N 3.32Å; F78-D81 PolarHBondContact O-N 3.25Å; F78-L82 PolarHBondContact O-N 2.91Å
79	H	89	Confident	90.4	Very high	146 Å²	146	98.5 Å²	98.5	68%	0.676	51%	0.509	S	S	*	.	H	α-helix	trans	-69.2	-42.7	176.1	-174.3	67.4	0	0	0	111.4	L75 T76 N77 D81 L82 G83	L75-H79 WeakPolarHBondContact O-CB 3.4Å; L75-H79 PolarHBondContact O-N 2.81Å; T76-H79 PolarHBondContact O-N 3.48Å; N77-H79 VanDerWaalsContact C-N 3.33Å; N77-H79 PolarHBondContact O-N 3.32Å; H79-D81 VanDerWaalsContact C-N 3.33Å; H79-L82 PolarHBondContact O-N 2.91Å; H79-G83 PolarHBondContact O-N 3.47Å
80	E	90.9	Very high	90.3	Very high	136 Å²	136	98.6 Å²	98.6	64%	0.636	51%	0.509	S	S	*	.	H	α-helix	trans	-60.9	-42.6	172.1	-74	-175.4	178	0	0	111.2	T76 N77 G83 A84	T76-E80 WeakPolarHBondContact O-CG 3.49Å; T76-E80 PolarHBondContact O-N 3Å; N77-E80 PolarHBondContact O-N 2.74Å; E80-G83 PolarHBondContact O-N 3.37Å; E80-A84 WeakPolarHBondContact O-CB 3.17Å; E80-A84 PolarHBondContact O-N 2.96Å
81	D	91.9	Very high	90.4	Very high	87 Å²	87	95 Å²	95	47%	0.465	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-46.5	176.3	-73.3	-22	0	0	0	111.7	N77 F78 H79 G83 A84 I85	N77-D81 WeakPolarHBondContact O-CB 3.47Å; N77-D81 PolarHBondContact O-N 3.4Å; F78-D81 PolarHBondContact O-N 3.25Å; H79-D81 VanDerWaalsContact C-N 3.33Å; D81-G83 PolarHBondContact O-N 3.5Å; D81-A84 PolarHBondContact O-N 2.86Å; D81-I85 WeakPolarHBondContact O-CB 3.2Å; D81-I85 WeakPolarHBondContact O-CD1 3.32Å; D81-I85 WeakPolarHBondContact O-CG1 3.38Å; D81-I85 PolarHBondContact O-N 3.41Å
82	L	89.4	Confident	90.5	Very high	125 Å²	125	96.8 Å²	96.8	65%	0.654	51%	0.511	S	S	*	.	H	α-helix	trans	-69	-35.6	179.9	-156.5	110	0	0	0	112.1	F78 H79 S86	F78-L82 PolarHBondContact O-N 2.91Å; H79-L82 PolarHBondContact O-N 2.91Å; L82-S86 VanDerWaalsContact O-CB 3.27Å; L82-S86 WeakPolarHBondContact O-CB 3.27Å; L82-S86 PolarHBondContact O-N 3.36Å
83	G	91.5	Very high	90.5	Very high	34 Å²	34	96.3 Å²	96.3	35%	0.351	51%	0.509	S	S	.	.	H	α-helix	trans	-65.7	-44.4	172.9	0	0	0	0	0	111.9	H79 E80 D81 S86 T87	H79-G83 PolarHBondContact O-N 3.47Å; E80-G83 PolarHBondContact O-N 3.37Å; D81-G83 PolarHBondContact O-N 3.5Å; G83-S86 PolarHBondContact O-N 2.93Å; G83-T87 WeakPolarHBondContact O-CB 3.22Å; G83-T87 PolarHBondContact O-N 3.48Å; G83-T87 PolarHBondContact O-OG1 2.86Å
84	A	91.1	Very high	90.5	Very high	56 Å²	56	95 Å²	95	46%	0.463	51%	0.506	S	S	.	.	H	α-helix	trans	-61.1	-48.6	174.3	0	0	0	0	0	110.8	E80 D81 T87 E88	E80-A84 WeakPolarHBondContact O-CB 3.17Å; E80-A84 PolarHBondContact O-N 2.96Å; D81-A84 PolarHBondContact O-N 2.86Å; A84-T87 PolarHBondContact O-N 2.63Å; A84-E88 VanDerWaalsContact O-CB 3.24Å; A84-E88 WeakPolarHBondContact O-CB 3.5Å; A84-E88 PolarHBondContact O-N 2.8Å
85	I	92.1	Very high	90.6	Very high	88 Å²	88	97.2 Å²	97.2	45%	0.451	51%	0.513	S	S	.	.	H	α-helix	trans	-63.7	-42.9	178.5	-68.7	162.3	0	0	0	111.4	D81 E88 I89	D81-I85 WeakPolarHBondContact O-CB 3.2Å; D81-I85 WeakPolarHBondContact O-CD1 3.32Å; D81-I85 WeakPolarHBondContact O-CG1 3.38Å; D81-I85 PolarHBondContact O-N 3.41Å; I85-E88 WeakPolarHBondContact O-CB 3.24Å; I85-E88 PolarHBondContact O-N 3.29Å; I85-I89 HydrophobicContact CG2-CD1 3.86Å; I85-I89 HydrophobicContact CG2-CG1 4.4Å; I85-I89 VanDerWaalsContact O-CG1 3.26Å; I85-I89 WeakPolarHBondContact O-CG1 3.32Å; I85-I89 PolarHBondContact O-N 2.95Å
86	S	87.9	Confident	90.7	Very high	56 Å²	56	95.3 Å²	95.3	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-65.6	-41.8	178.5	-172.9	0	0	0	0	111.8	L82 G83 E88 I89 Q90	L82-S86 VanDerWaalsContact O-CB 3.27Å; L82-S86 WeakPolarHBondContact O-CB 3.27Å; L82-S86 PolarHBondContact O-N 3.36Å; G83-S86 PolarHBondContact O-N 2.93Å; S86-E88 VanDerWaalsContact C-N 3.32Å; S86-I89 PolarHBondContact O-N 3.33Å; S86-Q90 WeakPolarHBondContact O-CG 3.32Å; S86-Q90 PolarHBondContact O-N 3.32Å
87	T	90.3	Very high	90.9	Very high	91 Å²	91	97.5 Å²	97.5	56%	0.558	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-39.7	174.5	-53.6	0	0	0	0	110.7	G83 A84 Q90 D91	G83-T87 WeakPolarHBondContact O-CB 3.22Å; G83-T87 PolarHBondContact O-N 3.48Å; G83-T87 PolarHBondContact O-OG1 2.86Å; A84-T87 PolarHBondContact O-N 2.63Å; T87-Q90 PolarHBondContact O-N 3.4Å; T87-D91 WeakPolarHBondContact O-CB 3.36Å; T87-D91 PolarHBondContact O-N 3.4Å
88	E	93.4	Very high	91	Very high	131 Å²	131	98.3 Å²	98.3	61%	0.612	52%	0.519	S	S	*	.	H	α-helix	trans	-63.6	-42.2	174.5	-171.5	178.5	-173.4	0	0	111.5	A84 I85 S86 D91 L92	A84-E88 VanDerWaalsContact O-CB 3.24Å; A84-E88 WeakPolarHBondContact O-CB 3.5Å; A84-E88 PolarHBondContact O-N 2.8Å; I85-E88 WeakPolarHBondContact O-CB 3.24Å; I85-E88 PolarHBondContact O-N 3.29Å; S86-E88 VanDerWaalsContact C-N 3.32Å; E88-D91 PolarHBondContact O-N 3.4Å; E88-L92 VanDerWaalsContact O-CB 3.22Å; E88-L92 WeakPolarHBondContact O-CB 3.13Å; E88-L92 PolarHBondContact O-N 2.79Å
89	I	91.2	Very high	90.9	Very high	99 Å²	99	98.6 Å²	98.6	51%	0.508	52%	0.524	S	S	.	.	H	α-helix	trans	-63.6	-42.7	174.8	-69.7	165.1	0	0	0	110.9	I85 S86 L92 Q93	I85-I89 HydrophobicContact CG2-CD1 3.86Å; I85-I89 HydrophobicContact CG2-CG1 4.4Å; I85-I89 VanDerWaalsContact O-CG1 3.26Å; I85-I89 WeakPolarHBondContact O-CG1 3.32Å; I85-I89 PolarHBondContact O-N 2.95Å; S86-I89 PolarHBondContact O-N 3.33Å; I89-L92 PolarHBondContact O-N 2.82Å; I89-Q93 WeakPolarHBondContact O-CB 3.26Å; I89-Q93 PolarHBondContact O-N 2.81Å
90	Q	89.2	Confident	91.1	Very high	126 Å²	126	95.6 Å²	95.6	59%	0.589	51%	0.513	S	S	*	.	H	α-helix	trans	-65.2	-42.9	177	-74.5	-175.5	10.7	0	0	111.9	S86 T87 L92 Q93 S94	S86-Q90 WeakPolarHBondContact O-CG 3.32Å; S86-Q90 PolarHBondContact O-N 3.32Å; T87-Q90 PolarHBondContact O-N 3.4Å; Q90-L92 VanDerWaalsContact C-N 3.35Å; Q90-Q93 PolarHBondContact O-N 2.93Å; Q90-S94 WeakPolarHBondContact O-CB 3.33Å; Q90-S94 PolarHBondContact O-N 2.8Å
91	D	91.7	Very high	91.1	Very high	74 Å²	74	92.7 Å²	92.7	40%	0.396	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-42.4	174.8	-175.1	37.1	0	0	0	110.7	T87 E88 Q93 S94 K95	T87-D91 WeakPolarHBondContact O-CB 3.36Å; T87-D91 PolarHBondContact O-N 3.4Å; E88-D91 PolarHBondContact O-N 3.4Å; D91-Q93 PolarHBondContact O-N 2.86Å; D91-S94 PolarHBondContact O-N 3.37Å; D91-K95 VanDerWaalsContact O-CB 3.26Å; D91-K95 WeakPolarHBondContact O-CB 3.45Å; D91-K95 VanDerWaalsContact O-CG 3.22Å; D91-K95 WeakPolarHBondContact O-CG 3.38Å; D91-K95 PolarHBondContact O-N 3.48Å; D91-K95 VanDerWaalsContact OD1-CE 3.32Å; D91-K95 WeakPolarHBondContact OD1-CE 3.49Å; D91-K95 IonicContact OD1-NZ 3.1Å; D91-K95 WeakPolarHBondContact OD2-CE 3.35Å; D91-K95 IonicContact OD2-NZ 3.15Å; D91-K95 PolarHBondContact OD2-NZ 2.82Å
92	L	91.3	Very high	91.2	Very high	117 Å²	117	96.9 Å²	96.9	61%	0.613	51%	0.514	S	S	*	.	H	α-helix	trans	-62.8	-41.4	174.7	-163	84	0	0	0	111.9	E88 I89 Q90 K95 S96	E88-L92 VanDerWaalsContact O-CB 3.22Å; E88-L92 WeakPolarHBondContact O-CB 3.13Å; E88-L92 PolarHBondContact O-N 2.79Å; I89-L92 PolarHBondContact O-N 2.82Å; Q90-L92 VanDerWaalsContact C-N 3.35Å; L92-K95 PolarHBondContact O-N 3.02Å; L92-S96 VanDerWaalsContact O-CB 3.28Å; L92-S96 WeakPolarHBondContact O-CB 3.26Å; L92-S96 PolarHBondContact O-N 2.92Å
93	Q	89.2	Confident	91.4	Very high	121 Å²	121	94.6 Å²	94.6	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-67	-44.4	177.3	-173.7	-176.5	-3.5	0	0	111.3	I89 Q90 D91 S96 L97	I89-Q93 WeakPolarHBondContact O-CB 3.26Å; I89-Q93 PolarHBondContact O-N 2.81Å; Q90-Q93 PolarHBondContact O-N 2.93Å; D91-Q93 PolarHBondContact O-N 2.86Å; Q93-S96 WeakPolarHBondContact O-CB 3.22Å; Q93-S96 PolarHBondContact O-N 3.32Å; Q93-L97 WeakPolarHBondContact O-CG 3.4Å; Q93-L97 PolarHBondContact O-N 2.93Å
94	S	90	Very high	91.4	Very high	56 Å²	56	97.2 Å²	97.2	39%	0.392	51%	0.505	S	S	.	.	H	α-helix	trans	-60.1	-47	174.4	-177.5	0	0	0	0	111	Q90 D91 S96 L97 Q98	Q90-S94 WeakPolarHBondContact O-CB 3.33Å; Q90-S94 PolarHBondContact O-N 2.8Å; D91-S94 PolarHBondContact O-N 3.37Å; S94-S96 VanDerWaalsContact C-N 3.31Å; S94-S96 PolarHBondContact O-N 3.3Å; S94-L97 PolarHBondContact O-N 3.25Å; S94-Q98 WeakPolarHBondContact O-CB 3.22Å; S94-Q98 WeakPolarHBondContact O-CG 3.46Å; S94-Q98 PolarHBondContact O-N 2.79Å
95	K	91.6	Very high	91.4	Very high	116 Å²	116	99.8 Å²	99.8	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-59.9	-39.3	173.5	-76.3	169.8	176.7	167.4	0	111.9	D91 L92 Q98 M99	D91-K95 VanDerWaalsContact O-CB 3.26Å; D91-K95 WeakPolarHBondContact O-CB 3.45Å; D91-K95 VanDerWaalsContact O-CG 3.22Å; D91-K95 WeakPolarHBondContact O-CG 3.38Å; D91-K95 PolarHBondContact O-N 3.48Å; D91-K95 VanDerWaalsContact OD1-CE 3.32Å; D91-K95 WeakPolarHBondContact OD1-CE 3.49Å; D91-K95 IonicContact OD1-NZ 3.1Å; D91-K95 WeakPolarHBondContact OD2-CE 3.35Å; D91-K95 IonicContact OD2-NZ 3.15Å; D91-K95 PolarHBondContact OD2-NZ 2.82Å; L92-K95 PolarHBondContact O-N 3.02Å; K95-Q98 PolarHBondContact O-N 3.47Å; K95-M99 WeakPolarHBondContact O-CB 3.39Å; K95-M99 PolarHBondContact O-N 3.49Å
96	S	91.7	Very high	91.4	Very high	73 Å²	73	105.1 Å²	105.1	51%	0.51	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-44.6	177.2	-177.1	0	0	0	0	112.2	L92 Q93 S94 M99 N100	L92-S96 VanDerWaalsContact O-CB 3.28Å; L92-S96 WeakPolarHBondContact O-CB 3.26Å; L92-S96 PolarHBondContact O-N 2.92Å; Q93-S96 WeakPolarHBondContact O-CB 3.22Å; Q93-S96 PolarHBondContact O-N 3.32Å; S94-S96 VanDerWaalsContact C-N 3.31Å; S94-S96 PolarHBondContact O-N 3.3Å; S96-M99 PolarHBondContact O-N 3.09Å; S96-N100 WeakPolarHBondContact O-CB 3.42Å; S96-N100 PolarHBondContact O-N 3.12Å
97	L	93.9	Very high	91.5	Very high	105 Å²	105	107.1 Å²	107.1	55%	0.55	53%	0.529	S	S	.	.	H	α-helix	trans	-64.9	-42.3	175.3	-70.9	174.2	0	0	0	112	Q93 S94 M99 N100 T101	Q93-L97 WeakPolarHBondContact O-CG 3.4Å; Q93-L97 PolarHBondContact O-N 2.93Å; S94-L97 PolarHBondContact O-N 3.25Å; L97-M99 VanDerWaalsContact C-N 3.33Å; L97-N100 PolarHBondContact O-N 3.35Å; L97-T101 WeakPolarHBondContact O-CG2 3.43Å; L97-T101 PolarHBondContact O-N 2.95Å; L97-T101 PolarHBondContact O-OG1 3.4Å
98	Q	93.2	Very high	91.5	Very high	97 Å²	97	106.9 Å²	106.9	45%	0.453	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-39.6	173.2	-72.7	-174.3	24.1	0	0	111.8	S94 K95 T101 R102	S94-Q98 WeakPolarHBondContact O-CB 3.22Å; S94-Q98 WeakPolarHBondContact O-CG 3.46Å; S94-Q98 PolarHBondContact O-N 2.79Å; K95-Q98 PolarHBondContact O-N 3.47Å; Q98-T101 WeakPolarHBondContact CA-OG1 3.21Å; Q98-T101 PolarHBondContact O-OG1 2.8Å; Q98-R102 WeakPolarHBondContact O-CB 3.28Å; Q98-R102 VanDerWaalsContact O-CG 3.22Å; Q98-R102 WeakPolarHBondContact O-CG 3.49Å; Q98-R102 PolarHBondContact O-N 3.47Å
99	M	88.4	Confident	91.3	Very high	137 Å²	137	105 Å²	105	68%	0.675	52%	0.524	S	S	*	.	H	α-helix	trans	-66.4	-40.8	176.5	-171.5	167.1	112.9	0	0	111.1	K95 S96 L97 R102 L103	K95-M99 WeakPolarHBondContact O-CB 3.39Å; K95-M99 PolarHBondContact O-N 3.49Å; S96-M99 PolarHBondContact O-N 3.09Å; L97-M99 VanDerWaalsContact C-N 3.33Å; M99-R102 PolarHBondContact O-N 3.16Å; M99-L103 VanDerWaalsContact O-CB 3.3Å; M99-L103 WeakPolarHBondContact O-CB 3.45Å; M99-L103 PolarHBondContact O-N 2.75Å
100	N	92.8	Very high	91.1	Very high	82 Å²	82	109.3 Å²	109.3	44%	0.439	53%	0.534	S	S	.	.	H	α-helix	trans	-66	-44.6	177.9	-171.8	40.5	0	0	0	112.1	S96 L97 R102 L103 Q104	S96-N100 WeakPolarHBondContact O-CB 3.42Å; S96-N100 PolarHBondContact O-N 3.12Å; L97-N100 PolarHBondContact O-N 3.35Å; N100-R102 PolarHBondContact O-N 3.45Å; N100-L103 WeakPolarHBondContact O-CB 3.44Å; N100-L103 PolarHBondContact O-N 3.25Å; N100-L103 VanDerWaalsContact O-N 3.15Å; N100-Q104 WeakPolarHBondContact O-CG 3.34Å; N100-Q104 PolarHBondContact O-N 3.5Å
101	T	91.8	Very high	90.8	Very high	76 Å²	76	106.9 Å²	106.9	47%	0.466	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-41.4	175.5	49.6	0	0	0	0	111.9	L97 Q98 L103 Q104 N105	L97-T101 WeakPolarHBondContact O-CG2 3.43Å; L97-T101 PolarHBondContact O-N 2.95Å; L97-T101 PolarHBondContact O-OG1 3.4Å; Q98-T101 WeakPolarHBondContact CA-OG1 3.21Å; Q98-T101 PolarHBondContact O-OG1 2.8Å; T101-L103 VanDerWaalsContact C-N 3.31Å; T101-L103 PolarHBondContact O-N 3.2Å; T101-Q104 PolarHBondContact O-N 3.09Å; T101-N105 WeakPolarHBondContact O-CB 2.98Å; T101-N105 VanDerWaalsContact O-CG 3.27Å; T101-N105 PolarHBondContact O-N 3.4Å
102	R	94.4	Very high	90.5	Very high	175 Å²	175	108.1 Å²	108.1	66%	0.66	54%	0.538	S	S	*	.	H	α-helix	trans	-61.8	-38.9	172.2	-73.2	175.6	-176.7	-178.2	4.1	112.2	Q98 M99 N100 R106	Q98-R102 WeakPolarHBondContact O-CB 3.28Å; Q98-R102 VanDerWaalsContact O-CG 3.22Å; Q98-R102 WeakPolarHBondContact O-CG 3.49Å; Q98-R102 PolarHBondContact O-N 3.47Å; M99-R102 PolarHBondContact O-N 3.16Å; N100-R102 PolarHBondContact O-N 3.45Å; R102-R106 VanDerWaalsContact O-CB 3.29Å; R102-R106 WeakPolarHBondContact O-CB 3.31Å; R102-R106 PolarHBondContact O-N 2.94Å
103	L	92.7	Very high	90.1	Very high	76 Å²	76	106.7 Å²	106.7	40%	0.398	53%	0.53	S	S	.	.	H	α-helix	trans	-65.6	-45.5	177.1	-178	146.4	0	0	0	111.4	M99 N100 T101 R106 Q107	M99-L103 VanDerWaalsContact O-CB 3.3Å; M99-L103 WeakPolarHBondContact O-CB 3.45Å; M99-L103 PolarHBondContact O-N 2.75Å; N100-L103 WeakPolarHBondContact O-CB 3.44Å; N100-L103 PolarHBondContact O-N 3.25Å; N100-L103 VanDerWaalsContact O-N 3.15Å; T101-L103 VanDerWaalsContact C-N 3.31Å; T101-L103 PolarHBondContact O-N 3.2Å; L103-R106 PolarHBondContact O-N 3.38Å; L103-Q107 HydrophobicContact CD2-CG 4.33Å; L103-Q107 VanDerWaalsContact CD2-NE2 3.34Å; L103-Q107 WeakPolarHBondContact O-CG 3.42Å; L103-Q107 PolarHBondContact O-N 3.12Å
104	Q	92	Very high	89.7	Confident	90 Å²	90	104.4 Å²	104.4	42%	0.421	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-47.5	176.1	-70.4	-63.1	-24.6	0	0	112	N100 T101 R106 Q107 V108	N100-Q104 WeakPolarHBondContact O-CG 3.34Å; N100-Q104 PolarHBondContact O-N 3.5Å; T101-Q104 PolarHBondContact O-N 3.09Å; Q104-R106 VanDerWaalsContact C-N 3.28Å; Q104-R106 PolarHBondContact O-N 3.45Å; Q104-Q107 WeakPolarHBondContact O-CB 3.36Å; Q104-Q107 PolarHBondContact O-N 2.92Å; Q104-Q107 VanDerWaalsContact O-N 3.07Å; Q104-V108 PolarHBondContact O-N 3.47Å
105	N	90.7	Very high	89.3	Confident	110 Å²	110	107.6 Å²	107.6	59%	0.588	54%	0.536	S	S	*	.	H	α-helix	trans	-59.4	-40.8	175.9	-71	-13.2	0	0	0	111.5	T101 Q107 V108 V109	T101-N105 WeakPolarHBondContact O-CB 2.98Å; T101-N105 VanDerWaalsContact O-CG 3.27Å; T101-N105 PolarHBondContact O-N 3.4Å; N105-Q107 VanDerWaalsContact C-N 3.35Å; N105-V108 PolarHBondContact O-N 3.2Å; N105-V109 WeakPolarHBondContact O-CG2 3.34Å; N105-V109 PolarHBondContact O-N 3.42Å; N105-V109 VanDerWaalsContact O-N 3.07Å
106	R	92.2	Very high	88.5	Confident	200 Å²	200	104.6 Å²	104.6	76%	0.755	52%	0.524	S	S	*	.	H	α-helix	trans	-67.7	-33.2	176.1	-170.1	173.3	-179.1	-178.2	0.1	112.3	R102 L103 Q104 R110	R102-R106 VanDerWaalsContact O-CB 3.29Å; R102-R106 WeakPolarHBondContact O-CB 3.31Å; R102-R106 PolarHBondContact O-N 2.94Å; L103-R106 PolarHBondContact O-N 3.38Å; Q104-R106 VanDerWaalsContact C-N 3.28Å; Q104-R106 PolarHBondContact O-N 3.45Å; R106-R110 WeakPolarHBondContact O-CB 3.34Å; R106-R110 PolarHBondContact O-N 2.81Å
107	Q	90.4	Very high	87.8	Confident	97 Å²	97	105.5 Å²	105.5	45%	0.453	52%	0.522	S	S	.	.	H	α-helix	trans	-67	-45.8	175.5	-77	176.5	-13.7	0	0	111.9	L103 Q104 N105 R110 S111	L103-Q107 HydrophobicContact CD2-CG 4.33Å; L103-Q107 VanDerWaalsContact CD2-NE2 3.34Å; L103-Q107 WeakPolarHBondContact O-CG 3.42Å; L103-Q107 PolarHBondContact O-N 3.12Å; Q104-Q107 WeakPolarHBondContact O-CB 3.36Å; Q104-Q107 PolarHBondContact O-N 2.92Å; Q104-Q107 VanDerWaalsContact O-N 3.07Å; N105-Q107 VanDerWaalsContact C-N 3.35Å; Q107-R110 PolarHBondContact O-N 3.07Å; Q107-S111 PolarHBondContact O-N 3.29Å
108	V	90.4	Very high	86.8	Confident	86 Å²	86	104.2 Å²	104.2	52%	0.521	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-48.6	177.2	175.8	0	0	0	0	111.1	Q104 N105 R110 S111 N112	Q104-V108 PolarHBondContact O-N 3.47Å; N105-V108 PolarHBondContact O-N 3.2Å; V108-R110 VanDerWaalsContact C-N 3.3Å; V108-R110 PolarHBondContact O-N 3.5Å; V108-S111 WeakPolarHBondContact O-CB 3.29Å; V108-S111 PolarHBondContact O-N 2.96Å; V108-S111 VanDerWaalsContact O-N 3.16Å; V108-N112 PolarHBondContact O-N 2.89Å; V108-N112 VanDerWaalsContact O-N 3.12Å
109	V	88.9	Confident	85.8	Confident	92 Å²	92	101.1 Å²	101.1	56%	0.558	51%	0.509	S	S	*	.	H	α-helix	trans	-62.3	-40.1	176.8	173.5	0	0	0	0	110.9	N105 S111 N112 L113	N105-V109 WeakPolarHBondContact O-CG2 3.34Å; N105-V109 PolarHBondContact O-N 3.42Å; N105-V109 VanDerWaalsContact O-N 3.07Å; V109-S111 VanDerWaalsContact C-N 3.32Å; V109-S111 PolarHBondContact O-N 3.02Å; V109-N112 PolarHBondContact O-N 2.93Å; V109-L113 WeakPolarHBondContact O-CB 3.3Å; V109-L113 PolarHBondContact O-N 3.35Å
110	R	86.8	Confident	85.1	Confident	190 Å²	190	95.2 Å²	95.2	72%	0.717	48%	0.48	S	S	*	.	H	α-helix	trans	-62	-39	175.8	178.3	179.5	166.4	177.9	-3.3	111.7	R106 Q107 V108 S114	R106-R110 WeakPolarHBondContact O-CB 3.34Å; R106-R110 PolarHBondContact O-N 2.81Å; Q107-R110 PolarHBondContact O-N 3.07Å; V108-R110 VanDerWaalsContact C-N 3.3Å; V108-R110 PolarHBondContact O-N 3.5Å; R110-S114 WeakPolarHBondContact O-CA 3.38Å; R110-S114 WeakPolarHBondContact O-CB 2.99Å; R110-S114 PolarHBondContact O-N 2.82Å
111	S	83.3	Confident	84.3	Confident	75 Å²	75	93.9 Å²	93.9	52%	0.524	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-51.8	176.6	-169.6	0	0	0	0	111.3	Q107 V108 V109 L113 S114 Q115	Q107-S111 PolarHBondContact O-N 3.29Å; V108-S111 WeakPolarHBondContact O-CB 3.29Å; V108-S111 PolarHBondContact O-N 2.96Å; V108-S111 VanDerWaalsContact O-N 3.16Å; V109-S111 VanDerWaalsContact C-N 3.32Å; V109-S111 PolarHBondContact O-N 3.02Å; S111-L113 PolarHBondContact O-N 3.43Å; S111-S114 PolarHBondContact O-N 3.33Å; S111-Q115 PolarHBondContact O-N 2.87Å
112	N	84.4	Confident	83.5	Confident	100 Å²	100	91.5 Å²	91.5	54%	0.535	47%	0.465	S	S	.	.	H	α-helix	trans	-64.8	-42.2	180	-66.5	-15.6	0	0	0	111.9	V108 V109 S114 Q115 F116	V108-N112 PolarHBondContact O-N 2.89Å; V108-N112 VanDerWaalsContact O-N 3.12Å; V109-N112 PolarHBondContact O-N 2.93Å; N112-S114 VanDerWaalsContact C-N 3.32Å; N112-Q115 PolarHBondContact O-N 3.15Å; N112-F116 VanDerWaalsContact O-CB 3.28Å; N112-F116 WeakPolarHBondContact O-CB 3.45Å; N112-F116 PolarHBondContact O-N 2.87Å
113	L	83.1	Confident	82.7	Confident	87 Å²	87	85.9 Å²	85.9	46%	0.455	45%	0.451	S	S	.	.	H	α-helix	trans	-66.8	-35.1	176.1	-176.1	61.4	0	0	0	111.3	V109 S111 F116 L117	V109-L113 WeakPolarHBondContact O-CB 3.3Å; V109-L113 PolarHBondContact O-N 3.35Å; S111-L113 PolarHBondContact O-N 3.43Å; L113-F116 HydrophobicContact CD1-CD1 4.38Å; L113-L117 HydrophobicContact CD1-CD1 4.18Å; L113-L117 HydrophobicContact CD1-CG 4.05Å; L113-L117 HydrophobicContact CD2-CD1 4.47Å; L113-L117 HydrophobicContact CG-CD1 3.86Å; L113-L117 HydrophobicContact CG-CG 4.18Å; L113-L117 WeakPolarHBondContact O-CB 3.17Å; L113-L117 WeakPolarHBondContact O-CG 3.4Å; L113-L117 PolarHBondContact O-N 3.37Å
114	S	81.5	Confident	82	Confident	72 Å²	72	90.4 Å²	90.4	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-68.1	-41.2	176.3	-171.6	0	0	0	0	111.7	R110 S111 N112 S118	R110-S114 WeakPolarHBondContact O-CA 3.38Å; R110-S114 WeakPolarHBondContact O-CB 2.99Å; R110-S114 PolarHBondContact O-N 2.82Å; S111-S114 PolarHBondContact O-N 3.33Å; N112-S114 VanDerWaalsContact C-N 3.32Å; S114-S118 WeakPolarHBondContact O-CB 3.13Å; S114-S118 PolarHBondContact O-N 3.42Å
115	Q	80.9	Confident	81.4	Confident	123 Å²	123	92.6 Å²	92.6	58%	0.575	48%	0.48	S	S	*	.	H	α-helix	trans	-64	-49.2	174.2	-175.2	174.9	3.5	0	0	110.3	S111 N112 L117 S118 D119	S111-Q115 PolarHBondContact O-N 2.87Å; N112-Q115 PolarHBondContact O-N 3.15Å; Q115-L117 PolarHBondContact O-N 2.79Å; Q115-S118 WeakPolarHBondContact O-CB 3.06Å; Q115-S118 PolarHBondContact O-N 3.44Å; Q115-S118 VanDerWaalsContact O-N 3.08Å; Q115-D119 VanDerWaalsContact O-CG 3.28Å; Q115-D119 PolarHBondContact O-N 2.87Å
116	F	75.9	Confident	80.8	Confident	54 Å²	54	87.4 Å²	87.4	24%	0.237	45%	0.452	C	S	.	.	H	α-helix	trans	-59.3	-43	177.2	178.5	-93.7	0	0	0	113.3	N112 L113 D119 T120 F153 M159 F165	N112-F116 VanDerWaalsContact O-CB 3.28Å; N112-F116 WeakPolarHBondContact O-CB 3.45Å; N112-F116 PolarHBondContact O-N 2.87Å; L113-F116 HydrophobicContact CD1-CD1 4.38Å; F116-D119 PolarHBondContact O-N 3.41Å; F116-T120 WeakPolarHBondContact O-CB 3.15Å; F116-T120 PolarHBondContact O-N 3.29Å; F116-T120 PolarHBondContact O-OG1 3.1Å; F116-F153 HydrophobicContact CD2-CZ 4.49Å; F116-M159 HydrophobicContact CE2-CE 4.39Å; F116-M159 HydrophobicContact CE2-SD 3.96Å; F116-F165 AromaticContact CE2-CE2 3.75Å; F116-F165 HydrophobicContact CE2-CE2 3.75Å; F116-F165 AromaticContact CE2-CZ 3.47Å; F116-F165 HydrophobicContact CE2-CZ 3.47Å; F116-F165 VanDerWaalsContact CE2-CZ 3.47Å; F116-F165 AromaticContact CZ-CE2 3.45Å; F116-F165 HydrophobicContact CZ-CE2 3.45Å; F116-F165 VanDerWaalsContact CZ-CE2 3.45Å; F116-F165 AromaticContact CZ-CZ 3.44Å; F116-F165 HydrophobicContact CZ-CZ 3.44Å; F116-F165 VanDerWaalsContact CZ-CZ 3.44Å
117	L	76.8	Confident	80	Confident	91 Å²	91	80 Å²	80	48%	0.476	43%	0.427	S	S	.	.	H	α-helix	trans	-68.6	-36.6	174.6	-74.8	173.9	0	0	0	111.2	L113 Q115 D119 T120 A121	L113-L117 HydrophobicContact CD1-CD1 4.18Å; L113-L117 HydrophobicContact CD1-CG 4.05Å; L113-L117 HydrophobicContact CD2-CD1 4.47Å; L113-L117 HydrophobicContact CG-CD1 3.86Å; L113-L117 HydrophobicContact CG-CG 4.18Å; L113-L117 WeakPolarHBondContact O-CB 3.17Å; L113-L117 WeakPolarHBondContact O-CG 3.4Å; L113-L117 PolarHBondContact O-N 3.37Å; Q115-L117 PolarHBondContact O-N 2.79Å; L117-D119 VanDerWaalsContact C-N 3.29Å; L117-D119 PolarHBondContact O-N 2.78Å; L117-T120 PolarHBondContact O-N 3.42Å; L117-A121 WeakPolarHBondContact O-CA 3.49Å; L117-A121 WeakPolarHBondContact O-CB 2.93Å; L117-A121 PolarHBondContact O-N 3.47Å
118	S	72.8	Confident	79.3	Confident	78 Å²	78	81.3 Å²	81.3	55%	0.545	43%	0.428	S	S	.	.	H	α-helix	trans	-62.9	-39.1	174.6	-176.3	0	0	0	0	111.4	S114 Q115 K150	S114-S118 WeakPolarHBondContact O-CB 3.13Å; S114-S118 PolarHBondContact O-N 3.42Å; Q115-S118 WeakPolarHBondContact O-CB 3.06Å; Q115-S118 PolarHBondContact O-N 3.44Å; Q115-S118 VanDerWaalsContact O-N 3.08Å; S118-K150 PolarHBondContact O-NZ 2.79Å
119	D	72.6	Confident	78.8	Confident	33 Å²	33	78.3 Å²	78.3	18%	0.176	41%	0.408	C	S	.	.	H	α-helix	trans	-75.9	-39.2	180	-62.8	-23	0	0	0	111.3	Q115 F116 L117 K150 F153	Q115-D119 VanDerWaalsContact O-CG 3.28Å; Q115-D119 PolarHBondContact O-N 2.87Å; F116-D119 PolarHBondContact O-N 3.41Å; L117-D119 VanDerWaalsContact C-N 3.29Å; L117-D119 PolarHBondContact O-N 2.78Å; D119-K150 WeakPolarHBondContact O-CG 3.24Å; D119-K150 PolarHBondContact O-NZ 3.49Å; D119-K150 VanDerWaalsContact O-NZ 3.09Å; D119-F153 HydrophobicContact CB-CD1 3.9Å; D119-F153 HydrophobicContact CB-CD2 4.5Å; D119-F153 HydrophobicContact CB-CE1 3.75Å; D119-F153 HydrophobicContact CB-CE2 4.37Å; D119-F153 HydrophobicContact CB-CG 4.27Å; D119-F153 HydrophobicContact CB-CZ 4Å
120	T	73.5	Confident	78.2	Confident	13 Å²	13	74 Å²	74	8%	0.08	38%	0.382	C	S	.	.	H	α-helix	trans	-83.5	-38.4	-177.4	-53.9	0	0	0	0	113.6	F116 L117 I122 F165 V168	F116-T120 WeakPolarHBondContact O-CB 3.15Å; F116-T120 PolarHBondContact O-N 3.29Å; F116-T120 PolarHBondContact O-OG1 3.1Å; L117-T120 PolarHBondContact O-N 3.42Å; T120-I122 PolarHBondContact O-N 2.72Å; T120-F165 HydrophobicContact CG2-CD1 4.47Å; T120-F165 HydrophobicContact CG2-CE1 4.09Å; T120-F165 HydrophobicContact CG2-CZ 4.5Å; T120-V168 HydrophobicContact CG2-CG1 4.49Å; T120-V168 HydrophobicContact CG2-CG2 4.09Å
121	A	75.7	Confident	77.8	Confident	53 Å²	53	67.8 Å²	67.8	44%	0.438	36%	0.362	S	S	.	.			trans	-69	131.5	-178.8	0	0	0	0	0	109.3	L117 P123 K150	L117-A121 WeakPolarHBondContact O-CA 3.49Å; L117-A121 WeakPolarHBondContact O-CB 2.93Å; L117-A121 PolarHBondContact O-N 3.47Å; A121-P123 WeakPolarHBondContact O-CD 3.36Å; A121-K150 PolarHBondContact O-NZ 3.32Å
122	I	74.5	Confident	77.6	Confident	27 Å²	27	72.3 Å²	72.3	14%	0.138	37%	0.369	C	S	.	.			trans	-100.2	108.4	175.7	-68	164.1	0	0	0	106.3	T120 L126 I127 K150 V168 L171 L172 L175	T120-I122 PolarHBondContact O-N 2.72Å; I122-L126 HydrophobicContact CG2-CB 4.46Å; I122-L126 HydrophobicContact CG2-CD2 4.15Å; I122-I127 HydrophobicContact CG2-CD1 3.92Å; I122-I127 HydrophobicContact CG2-CG1 3.61Å; I122-K150 HydrophobicContact CG1-CD 4.47Å; I122-V168 HydrophobicContact CD1-CG1 3.74Å; I122-V168 HydrophobicContact CG1-CG1 4.4Å; I122-L171 HydrophobicContact CD1-CB 4.41Å; I122-L171 HydrophobicContact CD1-CD2 3.84Å; I122-L171 HydrophobicContact CD1-CG 4.12Å; I122-L171 HydrophobicContact CG2-CD2 4.38Å; I122-L172 HydrophobicContact CD1-CD2 3.52Å; I122-L172 HydrophobicContact CD1-CG 3.77Å; I122-L172 HydrophobicContact CG1-CD2 4.09Å; I122-L175 HydrophobicContact CG2-CD1 4.18Å
123	P	78.4	Confident	77.3	Confident	57 Å²	57	68.1 Å²	68.1	37%	0.37	35%	0.347	S	S	.	.			trans	-57.9	142.3	175.8	-23.8	34.6	0	0	0	110.9	A121 E125 L126 I127	A121-P123 WeakPolarHBondContact O-CD 3.36Å; P123-E125 PolarHBondContact O-N 2.99Å; P123-L126 HydrophobicContact CB-CB 4.45Å; P123-L126 VanDerWaalsContact O-CB 3.29Å; P123-L126 WeakPolarHBondContact O-CB 3.27Å; P123-L126 PolarHBondContact O-N 2.9Å; P123-I127 PolarHBondContact O-N 2.81Å
124	E	76.7	Confident	77	Confident	170 Å²	170	67.3 Å²	67.3	79%	0.794	35%	0.347	S	S	*	.	H	α-helix	trans	-60.9	-28.7	175.4	-68.6	-174.3	-179	0	0	111.7	L126 I127 R128	E124-L126 VanDerWaalsContact C-N 3.35Å; E124-L126 PolarHBondContact O-N 3.38Å; E124-I127 WeakPolarHBondContact O-CB 3.42Å; E124-I127 PolarHBondContact O-N 2.85Å; E124-R128 WeakPolarHBondContact O-CB 3.19Å; E124-R128 PolarHBondContact O-N 3.11Å
125	E	79.1	Confident	76.7	Confident	137 Å²	137	64.5 Å²	64.5	64%	0.64	33%	0.327	S	S	*	.	H	α-helix	trans	-58.9	-44	171.2	-66.3	-175	174.7	0	0	111.5	P123 I127 R128 H129	P123-E125 PolarHBondContact O-N 2.99Å; E125-I127 VanDerWaalsContact C-N 3.32Å; E125-I127 PolarHBondContact O-N 3.02Å; E125-R128 PolarHBondContact O-N 3.33Å; E125-H129 PolarHBondContact O-N 3.03Å; E125-H129 PolarHBondContact O-ND1 3.5Å
126	L	78.7	Confident	76.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-58.5	-46.1	176.7	-177.8	60	0	0	0	110.9	I122 P123 E124 I130 N143 E146 K150	I122-L126 HydrophobicContact CG2-CB 4.46Å; I122-L126 HydrophobicContact CG2-CD2 4.15Å; P123-L126 HydrophobicContact CB-CB 4.45Å; P123-L126 VanDerWaalsContact O-CB 3.29Å; P123-L126 WeakPolarHBondContact O-CB 3.27Å; P123-L126 PolarHBondContact O-N 2.9Å; E124-L126 VanDerWaalsContact C-N 3.35Å; E124-L126 PolarHBondContact O-N 3.38Å; L126-I130 HydrophobicContact CD1-CD1 3.74Å; L126-I130 HydrophobicContact CD1-CG1 4.33Å; L126-I130 HydrophobicContact CG-CD1 3.81Å; L126-I130 WeakPolarHBondContact O-CB 3.32Å; L126-I130 WeakPolarHBondContact O-CD1 3.47Å; L126-I130 WeakPolarHBondContact O-CG1 3.28Å; L126-I130 PolarHBondContact O-N 3.49Å; L126-N143 WeakPolarHBondContact CA-OD1 3.5Å; L126-N143 HydrophobicContact CD1-CB 3.61Å; L126-N143 WeakPolarHBondContact CD1-O 3.08Å; L126-N143 VanDerWaalsContact CD1-OD1 3.26Å; L126-N143 WeakPolarHBondContact CD1-OD1 3.13Å; L126-E146 HydrophobicContact CD1-CB 4.26Å; L126-E146 HydrophobicContact CD2-CG 4.24Å; L126-K150 HydrophobicContact CD2-CD 3.84Å
127	I	76.2	Confident	76.2	Confident	44 Å²	44	64.5 Å²	64.5	23%	0.226	33%	0.333	C	S	.	.	H	α-helix	trans	-61.3	-47.5	176.6	-59.1	174.6	0	0	0	110.2	I122 P123 E124 E125 I130 I131 L171 L175	I122-I127 HydrophobicContact CG2-CD1 3.92Å; I122-I127 HydrophobicContact CG2-CG1 3.61Å; P123-I127 PolarHBondContact O-N 2.81Å; E124-I127 WeakPolarHBondContact O-CB 3.42Å; E124-I127 PolarHBondContact O-N 2.85Å; E125-I127 VanDerWaalsContact C-N 3.32Å; E125-I127 PolarHBondContact O-N 3.02Å; I127-I130 PolarHBondContact O-N 3.49Å; I127-I131 HydrophobicContact CG2-CD1 3.55Å; I127-I131 HydrophobicContact CG2-CG1 4.37Å; I127-I131 WeakPolarHBondContact O-CB 3.37Å; I127-I131 VanDerWaalsContact O-CG1 3.23Å; I127-I131 WeakPolarHBondContact O-CG1 3.46Å; I127-I131 PolarHBondContact O-N 2.93Å; I127-L171 HydrophobicContact CD1-CD2 3.93Å; I127-L175 HydrophobicContact CB-CD2 4.46Å; I127-L175 HydrophobicContact CG1-CD1 4.18Å; I127-L175 HydrophobicContact CG1-CD2 4.4Å; I127-L175 HydrophobicContact CG2-CD2 4.23Å
128	R	75.7	Confident	76.2	Confident	126 Å²	126	66.5 Å²	66.5	48%	0.475	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-43.6	-177.1	-159.3	-168.3	71.3	76.4	8	111.1	E124 E125 I131 Y132	E124-R128 WeakPolarHBondContact O-CB 3.19Å; E124-R128 PolarHBondContact O-N 3.11Å; E125-R128 PolarHBondContact O-N 3.33Å; R128-I131 PolarHBondContact O-N 3.12Å; R128-Y132 HydrophobicContact CB-CD2 4.43Å; R128-Y132 HydrophobicContact CG-CD2 3.64Å; R128-Y132 HydrophobicContact CG-CE2 4.18Å; R128-Y132 WeakPolarHBondContact O-CB 3.37Å; R128-Y132 WeakPolarHBondContact O-CD2 3.47Å; R128-Y132 PolarHBondContact O-N 2.84Å
129	H	78.6	Confident	76.4	Confident	23 Å²	23	67.5 Å²	67.5	11%	0.106	34%	0.336	C	S	.	.	H	α-helix	trans	-68.5	-42	178.6	-64.4	109.5	0	0	0	111.4	E125 I131 T133 E139 N143	E125-H129 PolarHBondContact O-N 3.03Å; E125-H129 PolarHBondContact O-ND1 3.5Å; H129-I131 VanDerWaalsContact C-N 3.34Å; H129-I131 PolarHBondContact O-N 2.97Å; H129-T133 WeakPolarHBondContact CA-OG1 3.5Å; H129-T133 PolarHBondContact CD2-OG1 2.9Å; H129-T133 VanDerWaalsContact CD2-OG1 3.31Å; H129-T133 WeakPolarHBondContact O-CA 3.5Å; H129-T133 WeakPolarHBondContact O-CB 3.23Å; H129-T133 PolarHBondContact O-N 3.07Å; H129-T133 PolarHBondContact O-OG1 3.2Å; H129-E139 IonicContact CD2-OE2 3.85Å; H129-E139 IonicContact NE2-OE2 3.7Å; H129-N143 HydrophobicContact CB-CB 4.2Å; H129-N143 WeakPolarHBondContact CB-ND2 3.5Å
130	I	77.9	Confident	77	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-41.1	176.1	-66.6	161.7	0	0	0	111.3	L126 I127 L147 L175 A179 K182	L126-I130 HydrophobicContact CD1-CD1 3.74Å; L126-I130 HydrophobicContact CD1-CG1 4.33Å; L126-I130 HydrophobicContact CG-CD1 3.81Å; L126-I130 WeakPolarHBondContact O-CB 3.32Å; L126-I130 WeakPolarHBondContact O-CD1 3.47Å; L126-I130 WeakPolarHBondContact O-CG1 3.28Å; L126-I130 PolarHBondContact O-N 3.49Å; I127-I130 PolarHBondContact O-N 3.49Å; I130-L147 HydrophobicContact CD1-CB 4.1Å; I130-L147 HydrophobicContact CD1-CD1 4.06Å; I130-L147 HydrophobicContact CD1-CD2 3.83Å; I130-L147 HydrophobicContact CD1-CG 4.2Å; I130-L175 HydrophobicContact CB-CD2 4.3Å; I130-L175 HydrophobicContact CD1-CB 4.49Å; I130-L175 HydrophobicContact CD1-CD1 4.34Å; I130-L175 HydrophobicContact CD1-CD2 4.22Å; I130-L175 HydrophobicContact CG2-CD2 4.14Å; I130-A179 HydrophobicContact CG2-CB 4.09Å; I130-K182 WeakPolarHBondContact O-CD 3.34Å; I130-K182 WeakPolarHBondContact O-CE 3.45Å; I130-K182 PolarHBondContact O-NZ 3.42Å
131	I	77.6	Confident	77.3	Confident	60 Å²	60	67.2 Å²	67.2	31%	0.308	33%	0.334	S	S	.	.	H	α-helix	trans	-79.3	-43.6	-176	-65.4	176	0	0	0	112.5	I127 R128 H129 K182	I127-I131 HydrophobicContact CG2-CD1 3.55Å; I127-I131 HydrophobicContact CG2-CG1 4.37Å; I127-I131 WeakPolarHBondContact O-CB 3.37Å; I127-I131 VanDerWaalsContact O-CG1 3.23Å; I127-I131 WeakPolarHBondContact O-CG1 3.46Å; I127-I131 PolarHBondContact O-N 2.93Å; R128-I131 PolarHBondContact O-N 3.12Å; H129-I131 VanDerWaalsContact C-N 3.34Å; H129-I131 PolarHBondContact O-N 2.97Å; I131-K182 WeakPolarHBondContact O-CE 3.37Å; I131-K182 PolarHBondContact O-NZ 3.47Å
132	Y	78.5	Confident	77.6	Confident	171 Å²	171	69.8 Å²	69.8	67%	0.671	34%	0.336	S	S	*	.	H	α-helix	trans	-107.7	-33.2	-168.7	-60.1	-70.7	0	0	0	114	R128	R128-Y132 HydrophobicContact CB-CD2 4.43Å; R128-Y132 HydrophobicContact CG-CD2 3.64Å; R128-Y132 HydrophobicContact CG-CE2 4.18Å; R128-Y132 WeakPolarHBondContact O-CB 3.37Å; R128-Y132 WeakPolarHBondContact O-CD2 3.47Å; R128-Y132 PolarHBondContact O-N 2.84Å
133	T	79.6	Confident	77.9	Confident	11 Å²	11	69.3 Å²	69.3	7%	0.067	33%	0.334	C	S	.	.	S	Bend	trans	-68.5	135.4	-177.8	-57.1	0	0	0	0	110.6	H129 E137 E139 F140 K182	H129-T133 WeakPolarHBondContact CA-OG1 3.5Å; H129-T133 PolarHBondContact CD2-OG1 2.9Å; H129-T133 VanDerWaalsContact CD2-OG1 3.31Å; H129-T133 WeakPolarHBondContact O-CA 3.5Å; H129-T133 WeakPolarHBondContact O-CB 3.23Å; H129-T133 PolarHBondContact O-N 3.07Å; H129-T133 PolarHBondContact O-OG1 3.2Å; T133-E137 HydrophobicContact CG2-CB 3.87Å; T133-E137 HydrophobicContact CG2-CG 4.14Å; T133-E139 HydrophobicContact CG2-CB 4.31Å; T133-F140 HydrophobicContact CG2-CB 4.25Å; T133-K182 PolarHBondContact O-NZ 2.88Å
134	P	76.2	Confident	78.2	Confident	71 Å²	71	66.6 Å²	66.6	46%	0.461	32%	0.317	S	S	.	.			trans	-69.1	147.1	175.8	23.1	-26.2	0	0	0	111	T136 E137	P134-T136 PolarHBondContact O-N 3.16Å; P134-E137 HydrophobicContact CG-CG 3.97Å; P134-E137 PolarHBondContact O-N 3.21Å; P134-E137 VanDerWaalsContact O-N 3.17Å
135	V	73.9	Confident	78.5	Confident	13 Å²	13	62.6 Å²	62.6	8%	0.079	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-10.4	-176	-177.9	0	0	0	0	113	F140 K182 F186 Y214	V135-F140 HydrophobicContact CB-CD1 4.32Å; V135-F140 HydrophobicContact CB-CE1 4.35Å; V135-F140 HydrophobicContact CG1-CD1 4.12Å; V135-F140 HydrophobicContact CG1-CE1 3.98Å; V135-F140 HydrophobicContact CG2-CD1 4.39Å; V135-F140 HydrophobicContact CG2-CE1 4.07Å; V135-F140 HydrophobicContact CG2-CZ 4.14Å; V135-K182 HydrophobicContact CG2-CB 3.78Å; V135-K182 HydrophobicContact CG2-CD 4.24Å; V135-K182 HydrophobicContact CG2-CG 4.44Å; V135-F186 HydrophobicContact CB-CB 4.21Å; V135-F186 HydrophobicContact CB-CD2 4.23Å; V135-F186 HydrophobicContact CB-CG 4.14Å; V135-F186 HydrophobicContact CG1-CB 3.9Å; V135-F186 HydrophobicContact CG1-CD1 3.84Å; V135-F186 HydrophobicContact CG1-CD2 4.21Å; V135-F186 HydrophobicContact CG1-CE1 4.42Å; V135-F186 HydrophobicContact CG1-CG 3.71Å; V135-F186 HydrophobicContact CG2-CB 4.48Å; V135-Y214 HydrophobicContact CG1-CD2 4.02Å; V135-Y214 HydrophobicContact CG1-CE2 3.22Å; V135-Y214 PolarHBondContact O-OH 3.15Å
136	T	70.6	Confident	78.7	Confident	77 Å²	77	59.4 Å²	59.4	47%	0.472	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-25	177.4	47.4	0	0	0	0	113.7	P134 F186	P134-T136 PolarHBondContact O-N 3.16Å; T136-F186 HydrophobicContact CG2-CE2 3.84Å
137	E	76.2	Confident	78.9	Confident	99 Å²	99	59.4 Å²	59.4	46%	0.463	28%	0.283	S	S	.	.	S	Bend	trans	-82.4	147.3	-174.2	-60	-54.8	140	0	0	112.2	T133 P134 E139 F140	T133-E137 HydrophobicContact CG2-CB 3.87Å; T133-E137 HydrophobicContact CG2-CG 4.14Å; P134-E137 HydrophobicContact CG-CG 3.97Å; P134-E137 PolarHBondContact O-N 3.21Å; P134-E137 VanDerWaalsContact O-N 3.17Å; E137-E139 PolarHBondContact O-N 2.91Å; E137-F140 PolarHBondContact O-N 3.37Å
138	Q	77.9	Confident	79.2	Confident	134 Å²	134	58.8 Å²	58.8	63%	0.626	28%	0.28	S	S	*	.	H	α-helix	trans	-62.1	-34.6	176.4	-178.3	172.1	-24.8	0	0	111.9	F140 L141 E142	Q138-F140 PolarHBondContact O-N 3.1Å; Q138-L141 WeakPolarHBondContact O-CB 3.2Å; Q138-L141 PolarHBondContact O-N 3.33Å; Q138-E142 HydrophobicContact CG-CG 4.29Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.39Å; Q138-E142 PolarHBondContact NE2-OE1 3.41Å; Q138-E142 PolarHBondContact O-N 3.12Å
139	E	77.4	Confident	79.5	Confident	98 Å²	98	58 Å²	58	46%	0.458	28%	0.281	S	S	.	.	H	α-helix	trans	-54.9	-40.4	175.4	-65.1	176.8	-178.4	0	0	111.8	H129 T133 E137 L141 N143	H129-E139 IonicContact CD2-OE2 3.85Å; H129-E139 IonicContact NE2-OE2 3.7Å; T133-E139 HydrophobicContact CG2-CB 4.31Å; E137-E139 PolarHBondContact O-N 2.91Å; E139-L141 VanDerWaalsContact C-N 3.35Å; E139-L141 PolarHBondContact O-N 3.03Å; E139-N143 VanDerWaalsContact O-CB 3.29Å; E139-N143 WeakPolarHBondContact O-CB 3.21Å; E139-N143 PolarHBondContact O-N 3.34Å; E139-N143 PolarHBondContact O-ND2 2.96Å
140	F	84.3	Confident	79.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.1	-38.9	178.1	-179.6	-93.6	0	0	0	111.6	T133 V135 E137 Q138 L144 K182 I183 Y214	T133-F140 HydrophobicContact CG2-CB 4.25Å; V135-F140 HydrophobicContact CB-CD1 4.32Å; V135-F140 HydrophobicContact CB-CE1 4.35Å; V135-F140 HydrophobicContact CG1-CD1 4.12Å; V135-F140 HydrophobicContact CG1-CE1 3.98Å; V135-F140 HydrophobicContact CG2-CD1 4.39Å; V135-F140 HydrophobicContact CG2-CE1 4.07Å; V135-F140 HydrophobicContact CG2-CZ 4.14Å; E137-F140 PolarHBondContact O-N 3.37Å; Q138-F140 PolarHBondContact O-N 3.1Å; F140-L144 HydrophobicContact CE1-CD2 4.38Å; F140-L144 VanDerWaalsContact O-CB 3.24Å; F140-L144 WeakPolarHBondContact O-CB 2.93Å; F140-L144 PolarHBondContact O-N 3.38Å; F140-K182 HydrophobicContact CE2-CD 4.18Å; F140-I183 HydrophobicContact CE1-CD1 4.46Å; F140-I183 HydrophobicContact CE1-CG1 4.12Å; F140-I183 HydrophobicContact CZ-CG1 4.34Å; F140-Y214 HydrophobicContact CD1-CE1 4.17Å; F140-Y214 HydrophobicContact CE1-CE1 4.17Å
141	L	79.3	Confident	79.4	Confident	41 Å²	41	58.3 Å²	58.3	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-66.3	-44.6	178.4	177.4	64.1	0	0	0	111.8	Q138 E139 L144 H145 F213 Y214	Q138-L141 WeakPolarHBondContact O-CB 3.2Å; Q138-L141 PolarHBondContact O-N 3.33Å; E139-L141 VanDerWaalsContact C-N 3.35Å; E139-L141 PolarHBondContact O-N 3.03Å; L141-L144 WeakPolarHBondContact O-CB 3.4Å; L141-L144 PolarHBondContact O-N 2.88Å; L141-L144 VanDerWaalsContact O-N 3.16Å; L141-H145 PolarHBondContact O-CD2 2.8Å; L141-H145 VanDerWaalsContact O-CD2 3.22Å; L141-H145 PolarHBondContact O-N 3.08Å; L141-F213 HydrophobicContact CD1-CB 3.9Å; L141-F213 HydrophobicContact CD1-CD1 3.55Å; L141-F213 HydrophobicContact CD1-CG 4.09Å; L141-Y214 HydrophobicContact CD1-CD1 4.3Å; L141-Y214 HydrophobicContact CD1-CE1 3.76Å
142	E	82.6	Confident	79.4	Confident	106 Å²	106	58.8 Å²	58.8	50%	0.495	29%	0.286	S	S	.	.	H	α-helix	trans	-62	-47.9	177.6	-70	173.3	-176.5	0	0	111.2	Q138 L144 H145 E146	Q138-E142 HydrophobicContact CG-CG 4.29Å; Q138-E142 WeakPolarHBondContact CG-OE1 3.39Å; Q138-E142 PolarHBondContact NE2-OE1 3.41Å; Q138-E142 PolarHBondContact O-N 3.12Å; E142-L144 VanDerWaalsContact C-N 3.26Å; E142-L144 PolarHBondContact O-N 3.42Å; E142-H145 WeakPolarHBondContact O-CB 3.32Å; E142-H145 PolarHBondContact O-N 2.83Å; E142-H145 VanDerWaalsContact O-N 3.14Å; E142-E146 PolarHBondContact O-N 3.35Å
143	N	81.6	Confident	79.2	Confident	18 Å²	18	52.4 Å²	52.4	10%	0.096	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-31.6	173.9	-79.5	-79.5	0	0	0	112	L126 H129 E139 E146 L147	L126-N143 WeakPolarHBondContact CA-OD1 3.5Å; L126-N143 HydrophobicContact CD1-CB 3.61Å; L126-N143 WeakPolarHBondContact CD1-O 3.08Å; L126-N143 VanDerWaalsContact CD1-OD1 3.26Å; L126-N143 WeakPolarHBondContact CD1-OD1 3.13Å; H129-N143 HydrophobicContact CB-CB 4.2Å; H129-N143 WeakPolarHBondContact CB-ND2 3.5Å; E139-N143 VanDerWaalsContact O-CB 3.29Å; E139-N143 WeakPolarHBondContact O-CB 3.21Å; E139-N143 PolarHBondContact O-N 3.34Å; E139-N143 PolarHBondContact O-ND2 2.96Å; N143-E146 PolarHBondContact O-N 3.33Å; N143-L147 WeakPolarHBondContact O-CB 3.5Å; N143-L147 PolarHBondContact O-N 2.85Å
144	L	83.3	Confident	78.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70	-36.7	174.4	-169.1	71.4	0	0	0	112.2	F140 L141 E142 L147 N148 A179 I183 F213 Y214 F217	F140-L144 HydrophobicContact CE1-CD2 4.38Å; F140-L144 VanDerWaalsContact O-CB 3.24Å; F140-L144 WeakPolarHBondContact O-CB 2.93Å; F140-L144 PolarHBondContact O-N 3.38Å; L141-L144 WeakPolarHBondContact O-CB 3.4Å; L141-L144 PolarHBondContact O-N 2.88Å; L141-L144 VanDerWaalsContact O-N 3.16Å; E142-L144 VanDerWaalsContact C-N 3.26Å; E142-L144 PolarHBondContact O-N 3.42Å; L144-L147 HydrophobicContact CD1-CD2 4.33Å; L144-L147 PolarHBondContact O-N 2.9Å; L144-N148 WeakPolarHBondContact O-CB 3.33Å; L144-N148 PolarHBondContact O-N 3.09Å; L144-A179 HydrophobicContact CD1-CB 4.03Å; L144-I183 HydrophobicContact CD1-CD1 4.01Å; L144-I183 HydrophobicContact CD2-CD1 3.64Å; L144-F213 HydrophobicContact CB-CE1 4.32Å; L144-F213 HydrophobicContact CD2-CD1 3.9Å; L144-F213 HydrophobicContact CD2-CE1 3.87Å; L144-F213 HydrophobicContact CG-CD1 4.44Å; L144-F213 HydrophobicContact CG-CE1 3.93Å; L144-Y214 HydrophobicContact CD2-CD1 3.54Å; L144-Y214 HydrophobicContact CD2-CE1 3.74Å; L144-F217 HydrophobicContact CD1-CD1 4.01Å; L144-F217 HydrophobicContact CD1-CD2 3.88Å; L144-F217 HydrophobicContact CD1-CE1 3.78Å; L144-F217 HydrophobicContact CD1-CE2 3.64Å; L144-F217 HydrophobicContact CD1-CG 4.06Å; L144-F217 HydrophobicContact CD1-CZ 3.6Å; L144-F217 HydrophobicContact CD2-CB 4.19Å; L144-F217 HydrophobicContact CD2-CD1 4.36Å; L144-F217 HydrophobicContact CD2-CD2 4.27Å; L144-F217 HydrophobicContact CD2-CG 4.01Å; L144-F217 HydrophobicContact CG-CD1 4.5Å; L144-F217 HydrophobicContact CG-CD2 3.88Å; L144-F217 HydrophobicContact CG-CE2 4.08Å; L144-F217 HydrophobicContact CG-CG 4.1Å; L144-F217 HydrophobicContact CG-CZ 4.49Å
145	H	83.9	Confident	78.4	Confident	86 Å²	86	54.9 Å²	54.9	40%	0.398	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-44.3	172.2	-82.3	-73.3	0	0	0	111.3	L141 E142 N148 H149 F213	L141-H145 PolarHBondContact O-CD2 2.8Å; L141-H145 VanDerWaalsContact O-CD2 3.22Å; L141-H145 PolarHBondContact O-N 3.08Å; E142-H145 WeakPolarHBondContact O-CB 3.32Å; E142-H145 PolarHBondContact O-N 2.83Å; E142-H145 VanDerWaalsContact O-N 3.14Å; H145-N148 PolarHBondContact O-N 2.68Å; H145-H149 PolarHBondContact O-N 2.78Å; H145-F213 AromaticContact CD2-CE1 3.98Å; H145-F213 AromaticContact CE1-CD1 3.63Å; H145-F213 AromaticContact CE1-CD2 3.24Å; H145-F213 WeakPolarHBondContact CE1-CD2 3.45Å; H145-F213 AromaticContact CE1-CE1 3.61Å; H145-F213 AromaticContact CE1-CE2 3.23Å; H145-F213 WeakPolarHBondContact CE1-CE2 3.37Å; H145-F213 AromaticContact CE1-CG 3.45Å; H145-F213 VanDerWaalsContact CE1-CG 3.45Å; H145-F213 WeakPolarHBondContact CE1-CG 3.24Å; H145-F213 AromaticContact CE1-CZ 3.42Å; H145-F213 VanDerWaalsContact CE1-CZ 3.42Å; H145-F213 WeakPolarHBondContact CE1-CZ 3.5Å; H145-F213 AromaticContact CG-CE1 3.79Å; H145-F213 AromaticContact CG-CZ 3.87Å; H145-F213 AromaticContact ND1-CD2 3.92Å; H145-F213 AromaticContact ND1-CE1 3.56Å; H145-F213 AromaticContact ND1-CE2 3.41Å; H145-F213 WeakPolarHBondContact ND1-CE2 3.42Å; H145-F213 AromaticContact ND1-CZ 3.21Å; H145-F213 WeakPolarHBondContact ND1-CZ 3.35Å; H145-F213 AromaticContact NE2-CD1 3.6Å; H145-F213 AromaticContact NE2-CD2 3.89Å; H145-F213 AromaticContact NE2-CE1 3.87Å; H145-F213 AromaticContact NE2-CG 3.6Å
146	E	82.3	Confident	78.1	Confident	69 Å²	69	60 Å²	60	32%	0.322	30%	0.295	S	S	.	.	H	α-helix	trans	-62.7	-44.7	175.3	-171.1	-178.3	165.6	0	0	111.4	L126 E142 N143 N148 H149 K150	L126-E146 HydrophobicContact CD1-CB 4.26Å; L126-E146 HydrophobicContact CD2-CG 4.24Å; E142-E146 PolarHBondContact O-N 3.35Å; N143-E146 PolarHBondContact O-N 3.33Å; E146-N148 VanDerWaalsContact C-N 3.35Å; E146-N148 PolarHBondContact O-N 2.77Å; E146-H149 PolarHBondContact O-N 3.36Å; E146-K150 HydrophobicContact CG-CD 4.13Å; E146-K150 HydrophobicContact CG-CG 4.49Å; E146-K150 WeakPolarHBondContact O-CB 3.48Å; E146-K150 WeakPolarHBondContact O-CG 2.93Å; E146-K150 PolarHBondContact O-N 3.32Å; E146-K150 WeakPolarHBondContact OE1-CE 3.39Å; E146-K150 IonicContact OE1-NZ 2.67Å
147	L	82.6	Confident	77.5	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.6	-45.5	175	-178.3	68.8	0	0	0	111.7	I130 N143 L144 K150 M151 L172 L175 A179 F217	I130-L147 HydrophobicContact CD1-CB 4.1Å; I130-L147 HydrophobicContact CD1-CD1 4.06Å; I130-L147 HydrophobicContact CD1-CD2 3.83Å; I130-L147 HydrophobicContact CD1-CG 4.2Å; N143-L147 WeakPolarHBondContact O-CB 3.5Å; N143-L147 PolarHBondContact O-N 2.85Å; L144-L147 HydrophobicContact CD1-CD2 4.33Å; L144-L147 PolarHBondContact O-N 2.9Å; L147-K150 PolarHBondContact O-N 3.24Å; L147-M151 WeakPolarHBondContact O-CB 3.42Å; L147-M151 PolarHBondContact O-N 3.26Å; L147-L172 HydrophobicContact CD1-CD2 3.77Å; L147-L175 HydrophobicContact CD1-CB 3.97Å; L147-L175 HydrophobicContact CD1-CD1 4.11Å; L147-L175 HydrophobicContact CD2-CB 4.42Å; L147-A179 HydrophobicContact CD2-CB 4.13Å; L147-F217 HydrophobicContact CD2-CE2 4.45Å; L147-F217 HydrophobicContact CD2-CZ 4.07Å
148	N	82.4	Confident	76.6	Confident	31 Å²	31	64.7 Å²	64.7	17%	0.166	32%	0.321	C	S	.	.	H	α-helix	trans	-61.7	-44.2	177.5	176.9	53.5	0	0	0	111.4	L144 H145 E146 M151 N152 F213 F217 H221	L144-N148 WeakPolarHBondContact O-CB 3.33Å; L144-N148 PolarHBondContact O-N 3.09Å; H145-N148 PolarHBondContact O-N 2.68Å; E146-N148 VanDerWaalsContact C-N 3.35Å; E146-N148 PolarHBondContact O-N 2.77Å; N148-M151 PolarHBondContact O-N 2.97Å; N148-N152 WeakPolarHBondContact O-CB 3.31Å; N148-N152 PolarHBondContact O-N 3.29Å; N148-N152 PolarHBondContact O-ND2 3Å; N148-N152 PolarHBondContact OD1-ND2 3.49Å; N148-N152 VanDerWaalsContact OD1-ND2 3.16Å; N148-F213 HydrophobicContact CB-CZ 4.2Å; N148-F217 HydrophobicContact CB-CD2 4.08Å; N148-F217 HydrophobicContact CB-CE2 4.11Å; N148-H221 PolarHBondContact OD1-CE1 3.47Å
149	H	82.5	Confident	75.5	Confident	109 Å²	109	60.4 Å²	60.4	51%	0.505	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-48.9	176.7	-177.6	63.8	0	0	0	111.5	H145 E146 M151 N152 F153	H145-H149 PolarHBondContact O-N 2.78Å; E146-H149 PolarHBondContact O-N 3.36Å; H149-M151 VanDerWaalsContact C-N 3.29Å; H149-M151 PolarHBondContact O-N 2.83Å; H149-N152 PolarHBondContact O-N 3.35Å; H149-F153 WeakPolarHBondContact O-CB 3.28Å; H149-F153 PolarHBondContact O-N 2.98Å
150	K	78.4	Confident	74.6	Confident	12 Å²	12	59.9 Å²	59.9	5%	0.052	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-34.6	176.9	-68.8	179.8	178.8	-72.1	0	112.6	S118 D119 A121 I122 L126 E146 L147 S154 L172	S118-K150 PolarHBondContact O-NZ 2.79Å; D119-K150 WeakPolarHBondContact O-CG 3.24Å; D119-K150 PolarHBondContact O-NZ 3.49Å; D119-K150 VanDerWaalsContact O-NZ 3.09Å; A121-K150 PolarHBondContact O-NZ 3.32Å; I122-K150 HydrophobicContact CG1-CD 4.47Å; L126-K150 HydrophobicContact CD2-CD 3.84Å; E146-K150 HydrophobicContact CG-CD 4.13Å; E146-K150 HydrophobicContact CG-CG 4.49Å; E146-K150 WeakPolarHBondContact O-CB 3.48Å; E146-K150 WeakPolarHBondContact O-CG 2.93Å; E146-K150 PolarHBondContact O-N 3.32Å; E146-K150 WeakPolarHBondContact OE1-CE 3.39Å; E146-K150 IonicContact OE1-NZ 2.67Å; L147-K150 PolarHBondContact O-N 3.24Å; K150-S154 WeakPolarHBondContact O-CB 3.33Å; K150-S154 PolarHBondContact O-N 3.5Å; K150-L172 HydrophobicContact CB-CD2 4.34Å
151	M	75.9	Confident	73.6	Confident	19 Å²	19	67.2 Å²	67.2	9%	0.094	34%	0.344	C	S	.	.	H	α-helix	trans	-73.7	-38.6	177.5	-149	-175.7	83	0	0	112.5	L147 N148 H149 S154 L155 R176 H221	L147-M151 WeakPolarHBondContact O-CB 3.42Å; L147-M151 PolarHBondContact O-N 3.26Å; N148-M151 PolarHBondContact O-N 2.97Å; H149-M151 VanDerWaalsContact C-N 3.29Å; H149-M151 PolarHBondContact O-N 2.83Å; M151-S154 PolarHBondContact O-N 3.22Å; M151-L155 HydrophobicContact CE-CD1 4.13Å; M151-L155 WeakPolarHBondContact O-CG 3.21Å; M151-L155 PolarHBondContact O-N 3.45Å; M151-L155 VanDerWaalsContact O-N 3.12Å; M151-R176 HydrophobicContact SD-CB 4.14Å; M151-R176 HydrophobicContact SD-CG 4.13Å; M151-H221 WeakPolarHBondContact CE-CD2 3.33Å; M151-H221 WeakPolarHBondContact CE-NE2 3.23Å; M151-H221 PolarHBondContact SD-CD2 3.39Å
152	N	78.9	Confident	73.1	Confident	70 Å²	70	71.4 Å²	71.4	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-65.1	-42.4	173.2	-67	-31.7	0	0	0	110.8	N148 H149 S154 L155 E156	N148-N152 WeakPolarHBondContact O-CB 3.31Å; N148-N152 PolarHBondContact O-N 3.29Å; N148-N152 PolarHBondContact O-ND2 3Å; N148-N152 PolarHBondContact OD1-ND2 3.49Å; N148-N152 VanDerWaalsContact OD1-ND2 3.16Å; H149-N152 PolarHBondContact O-N 3.35Å; N152-S154 VanDerWaalsContact C-N 3.32Å; N152-S154 PolarHBondContact O-N 3.45Å; N152-L155 PolarHBondContact O-N 3.03Å; N152-E156 PolarHBondContact O-N 3.45Å; N152-E156 VanDerWaalsContact O-N 3.1Å
153	F	74.4	Confident	72.6	Confident	36 Å²	36	75 Å²	75	16%	0.158	37%	0.372	C	S	.	.	H	α-helix	trans	-60.4	-40.1	173.8	-171.6	-100.8	0	0	0	112.2	F116 D119 H149 L155 E156 F165	F116-F153 HydrophobicContact CD2-CZ 4.49Å; D119-F153 HydrophobicContact CB-CD1 3.9Å; D119-F153 HydrophobicContact CB-CD2 4.5Å; D119-F153 HydrophobicContact CB-CE1 3.75Å; D119-F153 HydrophobicContact CB-CE2 4.37Å; D119-F153 HydrophobicContact CB-CG 4.27Å; D119-F153 HydrophobicContact CB-CZ 4Å; H149-F153 WeakPolarHBondContact O-CB 3.28Å; H149-F153 PolarHBondContact O-N 2.98Å; F153-L155 PolarHBondContact O-N 3.4Å; F153-E156 PolarHBondContact O-N 2.96Å; F153-F165 HydrophobicContact CE1-CE1 4.42Å; F153-F165 HydrophobicContact CE1-CZ 4.36Å
154	S	70.5	Confident	72	Confident	19 Å²	19	76.9 Å²	76.9	13%	0.133	39%	0.387	C	S	.	.	H	α-helix	trans	-68.1	-19.8	174.5	-178.7	0	0	0	0	114	K150 M151 N152	K150-S154 WeakPolarHBondContact O-CB 3.33Å; K150-S154 PolarHBondContact O-N 3.5Å; M151-S154 PolarHBondContact O-N 3.22Å; N152-S154 VanDerWaalsContact C-N 3.32Å; N152-S154 PolarHBondContact O-N 3.45Å
155	L	67.4	Low	71.3	Confident	116 Å²	116	77.3 Å²	77.3	61%	0.607	39%	0.389	S	S	*	.	H	α-helix	trans	-92.5	-17.2	177.9	-74.8	170.4	0	0	0	112.9	M151 N152 F153 Q157	M151-L155 HydrophobicContact CE-CD1 4.13Å; M151-L155 WeakPolarHBondContact O-CG 3.21Å; M151-L155 PolarHBondContact O-N 3.45Å; M151-L155 VanDerWaalsContact O-N 3.12Å; N152-L155 PolarHBondContact O-N 3.03Å; F153-L155 PolarHBondContact O-N 3.4Å; L155-Q157 PolarHBondContact O-N 2.82Å
156	E	68.5	Low	70.7	Confident	119 Å²	119	77.7 Å²	77.7	56%	0.556	39%	0.394	S	S	*	.	S	Bend	trans	-60.2	122.2	176.3	-76.6	-171	171.4	0	0	110.2	N152 F153 S158 M159	N152-E156 PolarHBondContact O-N 3.45Å; N152-E156 VanDerWaalsContact O-N 3.1Å; F153-E156 PolarHBondContact O-N 2.96Å; E156-S158 PolarHBondContact O-N 2.82Å; E156-M159 PolarHBondContact O-N 2.83Å
157	Q	57.6	Low	70.5	Confident	189 Å²	189	80.3 Å²	80.3	88%	0.883	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-18.3	-162.4	-108.2	169.1	-4.4	0	0	115.7	L155 M159	L155-Q157 PolarHBondContact O-N 2.82Å; Q157-M159 VanDerWaalsContact C-N 3.32Å; Q157-M159 PolarHBondContact O-N 3.45Å
158	S	57.2	Low	70.3	Confident	87 Å²	87	81.9 Å²	81.9	61%	0.608	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-7.6	-173.1	61.1	0	0	0	0	114.6	E156	E156-S158 PolarHBondContact O-N 2.82Å
159	M	55.2	Low	70.1	Confident	43 Å²	43	81.6 Å²	81.6	21%	0.212	42%	0.42	C	S	.	.	S	Bend	trans	-118.4	-1.7	-165.6	-64.9	-65.9	177.6	0	0	115.2	F116 E156 Q157 D161 Y162 F165	F116-M159 HydrophobicContact CE2-CE 4.39Å; F116-M159 HydrophobicContact CE2-SD 3.96Å; E156-M159 PolarHBondContact O-N 2.83Å; Q157-M159 VanDerWaalsContact C-N 3.32Å; Q157-M159 PolarHBondContact O-N 3.45Å; M159-D161 PolarHBondContact O-N 3.17Å; M159-D161 VanDerWaalsContact O-N 3.09Å; M159-Y162 HydrophobicContact SD-CD2 4.48Å; M159-Y162 HydrophobicContact SD-CE2 3.95Å; M159-F165 HydrophobicContact CB-CD2 4.07Å; M159-F165 HydrophobicContact CB-CE1 4.32Å; M159-F165 HydrophobicContact CB-CE2 3.64Å; M159-F165 HydrophobicContact CB-CZ 3.78Å; M159-F165 HydrophobicContact CG-CE2 4.2Å; M159-F165 HydrophobicContact CG-CZ 4.11Å; M159-F165 WeakPolarHBondContact O-CD2 3.44Å; M159-F165 HydrophobicContact SD-CE2 4.11Å; M159-F165 HydrophobicContact SD-CZ 4.3Å
160	V	58.5	Low	70.1	Confident	87 Å²	87	80 Å²	80	53%	0.527	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.5	-171.3	-174	0	0	0	0	113.3	Y162	V160-Y162 PolarHBondContact O-N 2.76Å
161	D	63	Low	70.3	Confident	154 Å²	154	82.4 Å²	82.4	82%	0.824	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-12.9	-172.7	-68.2	-28.6	0	0	0	115.1	M159	M159-D161 PolarHBondContact O-N 3.17Å; M159-D161 VanDerWaalsContact O-N 3.09Å
162	Y	67.8	Low	70.5	Confident	130 Å²	130	81.7 Å²	81.7	51%	0.51	43%	0.427	S	S	.	.			trans	-85	134.4	-179.2	-49.6	-90.6	0	0	0	112.8	M159 V160 S164 F165	M159-Y162 HydrophobicContact SD-CD2 4.48Å; M159-Y162 HydrophobicContact SD-CE2 3.95Å; V160-Y162 PolarHBondContact O-N 2.76Å; Y162-S164 PolarHBondContact O-N 2.72Å; Y162-F165 AromaticContact CD2-CD2 3.77Å; Y162-F165 HydrophobicContact CD2-CD2 3.77Å; Y162-F165 AromaticContact CD2-CE2 3.72Å; Y162-F165 HydrophobicContact CD2-CE2 3.72Å; Y162-F165 HydrophobicContact CG-CD2 4.19Å; Y162-F165 HydrophobicContact CG-CE2 4.36Å; Y162-F165 WeakPolarHBondContact O-CB 3.29Å; Y162-F165 PolarHBondContact O-N 2.86Å
163	K	72	Confident	70.7	Confident	180 Å²	180	83.5 Å²	83.5	78%	0.783	43%	0.432	S	S	*	.	H	α-helix	trans	-55.3	-36.9	177.6	-67.3	-178.3	-180	177.9	0	113.3	F165 N166	K163-F165 VanDerWaalsContact C-N 3.26Å; K163-F165 PolarHBondContact O-N 2.91Å; K163-N166 WeakPolarHBondContact O-CB 3.42Å; K163-N166 PolarHBondContact O-N 3.16Å; K163-N166 VanDerWaalsContact O-N 3.12Å
164	S	69	Low	71.2	Confident	59 Å²	59	88.4 Å²	88.4	41%	0.413	45%	0.453	S	S	.	.	H	α-helix	trans	-60.7	-33.2	175.8	48.4	0	0	0	0	112.9	Y162 N166 V168	Y162-S164 PolarHBondContact O-N 2.72Å; S164-N166 VanDerWaalsContact C-N 3.35Å; S164-V168 VanDerWaalsContact O-CG2 3.31Å; S164-V168 WeakPolarHBondContact O-CG2 3.45Å; S164-V168 PolarHBondContact O-N 3.27Å; S164-V168 VanDerWaalsContact O-N 3.16Å
165	F	68.6	Low	71.9	Confident	8 Å²	8	87.8 Å²	87.8	4%	0.035	45%	0.448	C	S	.	.	H	α-helix	trans	-70.9	-29.4	175.6	-78	-71.2	0	0	0	112.6	F116 T120 F153 M159 Y162 K163 S169	F116-F165 AromaticContact CE2-CE2 3.75Å; F116-F165 HydrophobicContact CE2-CE2 3.75Å; F116-F165 AromaticContact CE2-CZ 3.47Å; F116-F165 HydrophobicContact CE2-CZ 3.47Å; F116-F165 VanDerWaalsContact CE2-CZ 3.47Å; F116-F165 AromaticContact CZ-CE2 3.45Å; F116-F165 HydrophobicContact CZ-CE2 3.45Å; F116-F165 VanDerWaalsContact CZ-CE2 3.45Å; F116-F165 AromaticContact CZ-CZ 3.44Å; F116-F165 HydrophobicContact CZ-CZ 3.44Å; F116-F165 VanDerWaalsContact CZ-CZ 3.44Å; T120-F165 HydrophobicContact CG2-CD1 4.47Å; T120-F165 HydrophobicContact CG2-CE1 4.09Å; T120-F165 HydrophobicContact CG2-CZ 4.5Å; F153-F165 HydrophobicContact CE1-CE1 4.42Å; F153-F165 HydrophobicContact CE1-CZ 4.36Å; M159-F165 HydrophobicContact CB-CD2 4.07Å; M159-F165 HydrophobicContact CB-CE1 4.32Å; M159-F165 HydrophobicContact CB-CE2 3.64Å; M159-F165 HydrophobicContact CB-CZ 3.78Å; M159-F165 HydrophobicContact CG-CE2 4.2Å; M159-F165 HydrophobicContact CG-CZ 4.11Å; M159-F165 WeakPolarHBondContact O-CD2 3.44Å; M159-F165 HydrophobicContact SD-CE2 4.11Å; M159-F165 HydrophobicContact SD-CZ 4.3Å; Y162-F165 AromaticContact CD2-CD2 3.77Å; Y162-F165 HydrophobicContact CD2-CD2 3.77Å; Y162-F165 AromaticContact CD2-CE2 3.72Å; Y162-F165 HydrophobicContact CD2-CE2 3.72Å; Y162-F165 HydrophobicContact CG-CD2 4.19Å; Y162-F165 HydrophobicContact CG-CE2 4.36Å; Y162-F165 WeakPolarHBondContact O-CB 3.29Å; Y162-F165 PolarHBondContact O-N 2.86Å; K163-F165 VanDerWaalsContact C-N 3.26Å; K163-F165 PolarHBondContact O-N 2.91Å; F165-S169 WeakPolarHBondContact O-CA 3.36Å; F165-S169 WeakPolarHBondContact O-CB 3.48Å; F165-S169 PolarHBondContact O-N 3.17Å
166	N	73	Confident	72.8	Confident	94 Å²	94	86 Å²	86	50%	0.503	43%	0.433	S	S	.	.	H	α-helix	trans	-63.9	-44.5	175.5	-73.7	-38	0	0	0	111.4	K163 S164 S169 V170	K163-N166 WeakPolarHBondContact O-CB 3.42Å; K163-N166 PolarHBondContact O-N 3.16Å; K163-N166 VanDerWaalsContact O-N 3.12Å; S164-N166 VanDerWaalsContact C-N 3.35Å; N166-S169 PolarHBondContact O-N 3.06Å; N166-V170 WeakPolarHBondContact O-CG2 3.36Å; N166-V170 PolarHBondContact O-N 2.94Å; N166-V170 VanDerWaalsContact O-N 3.09Å
167	D	76.8	Confident	73.7	Confident	125 Å²	125	85.5 Å²	85.5	67%	0.668	43%	0.433	S	S	*	.	H	α-helix	trans	-66.7	-45.6	179.3	-65.9	-23	0	0	0	111.5	V170 L171	D167-V170 PolarHBondContact O-N 3.25Å; D167-L171 PolarHBondContact O-N 3.42Å
168	V	79.3	Confident	75.1	Confident	32 Å²	32	81.3 Å²	81.3	19%	0.194	41%	0.412	C	S	.	.	H	α-helix	trans	-65.2	-40.9	176.9	173.7	0	0	0	0	111.1	T120 I122 S164 V170 L171 L172	T120-V168 HydrophobicContact CG2-CG1 4.49Å; T120-V168 HydrophobicContact CG2-CG2 4.09Å; I122-V168 HydrophobicContact CD1-CG1 3.74Å; I122-V168 HydrophobicContact CG1-CG1 4.4Å; S164-V168 VanDerWaalsContact O-CG2 3.31Å; S164-V168 WeakPolarHBondContact O-CG2 3.45Å; S164-V168 PolarHBondContact O-N 3.27Å; S164-V168 VanDerWaalsContact O-N 3.16Å; V168-V170 VanDerWaalsContact C-N 3.33Å; V168-V170 PolarHBondContact O-N 2.91Å; V168-L171 PolarHBondContact O-N 2.72Å; V168-L171 VanDerWaalsContact O-N 3.12Å; V168-L172 HydrophobicContact CG1-CD1 3.91Å; V168-L172 HydrophobicContact CG1-CG 4.12Å; V168-L172 WeakPolarHBondContact O-CG 3.48Å; V168-L172 PolarHBondContact O-N 3.06Å
169	S	78.4	Confident	76.4	Confident	25 Å²	25	77.1 Å²	77.1	18%	0.175	38%	0.383	C	S	.	.	H	α-helix	trans	-61.9	-39.8	178.1	-175.3	0	0	0	0	111.8	F165 N166 L171 L172 K173	F165-S169 WeakPolarHBondContact O-CA 3.36Å; F165-S169 WeakPolarHBondContact O-CB 3.48Å; F165-S169 PolarHBondContact O-N 3.17Å; N166-S169 PolarHBondContact O-N 3.06Å; S169-L171 VanDerWaalsContact C-N 3.33Å; S169-L171 PolarHBondContact O-N 3.09Å; S169-L172 PolarHBondContact O-N 2.92Å; S169-K173 WeakPolarHBondContact O-CB 3.43Å; S169-K173 WeakPolarHBondContact O-CD 3.39Å; S169-K173 WeakPolarHBondContact O-CG 3.23Å; S169-K173 PolarHBondContact O-N 3.27Å; S169-K173 WeakPolarHBondContact OG-CE 3.37Å; S169-K173 PolarHBondContact OG-NZ 2.92Å
170	V	82	Confident	78	Confident	75 Å²	75	75.4 Å²	75.4	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-62.2	-42.8	174.5	171.8	0	0	0	0	110.7	N166 D167 V168 K174	N166-V170 WeakPolarHBondContact O-CG2 3.36Å; N166-V170 PolarHBondContact O-N 2.94Å; N166-V170 VanDerWaalsContact O-N 3.09Å; D167-V170 PolarHBondContact O-N 3.25Å; V168-V170 VanDerWaalsContact C-N 3.33Å; V168-V170 PolarHBondContact O-N 2.91Å; V170-K174 WeakPolarHBondContact O-CG 3.37Å; V170-K174 PolarHBondContact O-N 3.33Å; V170-K174 VanDerWaalsContact O-N 3.1Å
171	L	81.3	Confident	79.4	Confident	63 Å²	63	73.4 Å²	73.4	33%	0.33	37%	0.368	S	S	.	.	H	α-helix	trans	-67.4	-46.4	177.5	-178	59.1	0	0	0	112.2	I122 I127 D167 V168 S169 K173 K174 L175	I122-L171 HydrophobicContact CD1-CB 4.41Å; I122-L171 HydrophobicContact CD1-CD2 3.84Å; I122-L171 HydrophobicContact CD1-CG 4.12Å; I122-L171 HydrophobicContact CG2-CD2 4.38Å; I127-L171 HydrophobicContact CD1-CD2 3.93Å; D167-L171 PolarHBondContact O-N 3.42Å; V168-L171 PolarHBondContact O-N 2.72Å; V168-L171 VanDerWaalsContact O-N 3.12Å; S169-L171 VanDerWaalsContact C-N 3.33Å; S169-L171 PolarHBondContact O-N 3.09Å; L171-K173 VanDerWaalsContact C-N 3.3Å; L171-K173 PolarHBondContact O-N 3.05Å; L171-K174 WeakPolarHBondContact O-CB 3.37Å; L171-K174 PolarHBondContact O-N 3.42Å; L171-K174 VanDerWaalsContact O-N 3.11Å; L171-L175 HydrophobicContact CD1-CG 4.4Å; L171-L175 HydrophobicContact CG-CD1 4.23Å; L171-L175 WeakPolarHBondContact O-CG 3.19Å; L171-L175 PolarHBondContact O-N 3.37Å
172	L	81.5	Confident	80.5	Confident	4 Å²	4	68 Å²	68	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-57.9	-42.2	175.3	-71	176.1	0	0	0	111.4	I122 L147 K150 V168 S169 K174 L175 R176	I122-L172 HydrophobicContact CD1-CD2 3.52Å; I122-L172 HydrophobicContact CD1-CG 3.77Å; I122-L172 HydrophobicContact CG1-CD2 4.09Å; L147-L172 HydrophobicContact CD1-CD2 3.77Å; K150-L172 HydrophobicContact CB-CD2 4.34Å; V168-L172 HydrophobicContact CG1-CD1 3.91Å; V168-L172 HydrophobicContact CG1-CG 4.12Å; V168-L172 WeakPolarHBondContact O-CG 3.48Å; V168-L172 PolarHBondContact O-N 3.06Å; S169-L172 PolarHBondContact O-N 2.92Å; L172-K174 PolarHBondContact O-N 3.46Å; L172-L175 PolarHBondContact O-N 3.16Å; L172-R176 VanDerWaalsContact O-CB 3.24Å; L172-R176 WeakPolarHBondContact O-CB 3.45Å; L172-R176 PolarHBondContact O-N 2.8Å
173	K	82.6	Confident	81.5	Confident	108 Å²	108	61.8 Å²	61.8	47%	0.47	31%	0.312	S	S	.	.	H	α-helix	trans	-61.6	-41.9	175	-75.9	168.6	-175.4	168.4	0	112	S169 L171 R176 I177	S169-K173 WeakPolarHBondContact O-CB 3.43Å; S169-K173 WeakPolarHBondContact O-CD 3.39Å; S169-K173 WeakPolarHBondContact O-CG 3.23Å; S169-K173 PolarHBondContact O-N 3.27Å; S169-K173 WeakPolarHBondContact OG-CE 3.37Å; S169-K173 PolarHBondContact OG-NZ 2.92Å; L171-K173 VanDerWaalsContact C-N 3.3Å; L171-K173 PolarHBondContact O-N 3.05Å; K173-R176 WeakPolarHBondContact O-CB 3.44Å; K173-R176 PolarHBondContact O-N 3.3Å; K173-I177 VanDerWaalsContact O-CG1 3.27Å; K173-I177 WeakPolarHBondContact O-CG1 3.25Å; K173-I177 PolarHBondContact O-N 2.81Å
174	K	85.3	Confident	82.4	Confident	140 Å²	140	56.1 Å²	56.1	61%	0.609	29%	0.286	S	S	*	.	H	α-helix	trans	-66.1	-44.4	175.9	-73.4	177.1	-179.8	178.5	0	111.8	V170 L171 L172 I177 K178	V170-K174 WeakPolarHBondContact O-CG 3.37Å; V170-K174 PolarHBondContact O-N 3.33Å; V170-K174 VanDerWaalsContact O-N 3.1Å; L171-K174 WeakPolarHBondContact O-CB 3.37Å; L171-K174 PolarHBondContact O-N 3.42Å; L171-K174 VanDerWaalsContact O-N 3.11Å; L172-K174 PolarHBondContact O-N 3.46Å; K174-I177 PolarHBondContact O-N 2.87Å; K174-K178 PolarHBondContact O-N 3.03Å
175	L	85	Confident	83.3	Confident	6 Å²	6	59.1 Å²	59.1	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-61.9	-43.1	175.3	-72.7	173.7	0	0	0	111.4	I122 I127 I130 L147 L171 L172 K178 A179	I122-L175 HydrophobicContact CG2-CD1 4.18Å; I127-L175 HydrophobicContact CB-CD2 4.46Å; I127-L175 HydrophobicContact CG1-CD1 4.18Å; I127-L175 HydrophobicContact CG1-CD2 4.4Å; I127-L175 HydrophobicContact CG2-CD2 4.23Å; I130-L175 HydrophobicContact CB-CD2 4.3Å; I130-L175 HydrophobicContact CD1-CB 4.49Å; I130-L175 HydrophobicContact CD1-CD1 4.34Å; I130-L175 HydrophobicContact CD1-CD2 4.22Å; I130-L175 HydrophobicContact CG2-CD2 4.14Å; L147-L175 HydrophobicContact CD1-CB 3.97Å; L147-L175 HydrophobicContact CD1-CD1 4.11Å; L147-L175 HydrophobicContact CD2-CB 4.42Å; L171-L175 HydrophobicContact CD1-CG 4.4Å; L171-L175 HydrophobicContact CG-CD1 4.23Å; L171-L175 WeakPolarHBondContact O-CG 3.19Å; L171-L175 PolarHBondContact O-N 3.37Å; L172-L175 PolarHBondContact O-N 3.16Å; L175-K178 PolarHBondContact O-N 3.25Å; L175-A179 VanDerWaalsContact O-CB 3.28Å; L175-A179 WeakPolarHBondContact O-CB 3.38Å; L175-A179 PolarHBondContact O-N 2.86Å
176	R	86.3	Confident	84.3	Confident	79 Å²	79	60.2 Å²	60.2	30%	0.298	30%	0.298	S	S	.	.	H	α-helix	trans	-55.8	-53.1	172.9	177.5	-169.3	73.9	159.7	3.8	111.1	M151 L172 K173 K178 A179 V180 H221	M151-R176 HydrophobicContact SD-CB 4.14Å; M151-R176 HydrophobicContact SD-CG 4.13Å; L172-R176 VanDerWaalsContact O-CB 3.24Å; L172-R176 WeakPolarHBondContact O-CB 3.45Å; L172-R176 PolarHBondContact O-N 2.8Å; K173-R176 WeakPolarHBondContact O-CB 3.44Å; K173-R176 PolarHBondContact O-N 3.3Å; R176-K178 VanDerWaalsContact C-N 3.26Å; R176-K178 PolarHBondContact O-N 3.33Å; R176-A179 PolarHBondContact O-N 2.74Å; R176-V180 HydrophobicContact CG-CG2 4.15Å; R176-V180 VanDerWaalsContact O-CB 3.31Å; R176-V180 WeakPolarHBondContact O-CB 3.26Å; R176-V180 VanDerWaalsContact O-CG2 3.23Å; R176-V180 WeakPolarHBondContact O-CG2 3.41Å; R176-V180 PolarHBondContact O-N 3.46Å; R176-H221 HydrophobicContact CG-CB 4.2Å
177	I	86.8	Confident	85	Confident	108 Å²	108	55.7 Å²	55.7	55%	0.554	27%	0.274	S	S	*	.	H	α-helix	trans	-57.2	-43.3	179.8	-69	163.7	0	0	0	110.4	K173 K174 A181	K173-I177 VanDerWaalsContact O-CG1 3.27Å; K173-I177 WeakPolarHBondContact O-CG1 3.25Å; K173-I177 PolarHBondContact O-N 2.81Å; K174-I177 PolarHBondContact O-N 2.87Å; I177-A181 WeakPolarHBondContact O-CB 3.19Å; I177-A181 PolarHBondContact O-N 2.91Å
178	K	86.6	Confident	85.6	Confident	100 Å²	100	50 Å²	50	44%	0.435	24%	0.244	S	C	.	.	H	α-helix	trans	-67.5	-43	178.6	-171.3	65	175.7	-176.3	0	112.8	K174 L175 R176 A181 K182	K174-K178 PolarHBondContact O-N 3.03Å; L175-K178 PolarHBondContact O-N 3.25Å; R176-K178 VanDerWaalsContact C-N 3.26Å; R176-K178 PolarHBondContact O-N 3.33Å; K178-A181 PolarHBondContact O-N 2.75Å; K178-K182 PolarHBondContact O-N 3.16Å
179	A	86.4	Confident	85.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-48.1	177.8	0	0	0	0	0	111	I130 L144 L147 L175 R176 A181 K182 I183 F217	I130-A179 HydrophobicContact CG2-CB 4.09Å; L144-A179 HydrophobicContact CD1-CB 4.03Å; L147-A179 HydrophobicContact CD2-CB 4.13Å; L175-A179 VanDerWaalsContact O-CB 3.28Å; L175-A179 WeakPolarHBondContact O-CB 3.38Å; L175-A179 PolarHBondContact O-N 2.86Å; R176-A179 PolarHBondContact O-N 2.74Å; A179-A181 PolarHBondContact O-N 3.42Å; A179-K182 PolarHBondContact O-N 3.02Å; A179-I183 WeakPolarHBondContact O-CB 3.26Å; A179-I183 VanDerWaalsContact O-CG1 3.26Å; A179-I183 WeakPolarHBondContact O-CG1 3.43Å; A179-I183 PolarHBondContact O-N 3.25Å; A179-F217 HydrophobicContact CB-CE1 4.2Å; A179-F217 HydrophobicContact CB-CZ 4.38Å
180	V	88.2	Confident	86.3	Confident	6 Å²	6	51.7 Å²	51.7	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-58.4	-45.9	175.7	169.2	0	0	0	0	110.9	R176 K182 I183 R184 F217 L218 H221 D222 I225	R176-V180 HydrophobicContact CG-CG2 4.15Å; R176-V180 VanDerWaalsContact O-CB 3.31Å; R176-V180 WeakPolarHBondContact O-CB 3.26Å; R176-V180 VanDerWaalsContact O-CG2 3.23Å; R176-V180 WeakPolarHBondContact O-CG2 3.41Å; R176-V180 PolarHBondContact O-N 3.46Å; V180-K182 PolarHBondContact O-N 2.66Å; V180-I183 PolarHBondContact O-N 3.33Å; V180-R184 VanDerWaalsContact O-CB 3.26Å; V180-R184 WeakPolarHBondContact O-CB 3.14Å; V180-R184 PolarHBondContact O-N 3.31Å; V180-F217 HydrophobicContact CG2-CE1 3.91Å; V180-L218 HydrophobicContact CB-CD2 4.36Å; V180-L218 HydrophobicContact CG1-CD2 3.85Å; V180-L218 HydrophobicContact CG2-CD2 4.25Å; V180-H221 HydrophobicContact CG2-CB 4.45Å; V180-D222 HydrophobicContact CG1-CB 4.12Å; V180-D222 HydrophobicContact CG2-CB 4.46Å; V180-I225 HydrophobicContact CG1-CB 4.47Å; V180-I225 HydrophobicContact CG1-CD1 3.3Å; V180-I225 HydrophobicContact CG1-CG1 4.43Å; V180-I225 HydrophobicContact CG1-CG2 4.38Å
181	A	87.8	Confident	86.5	Confident	46 Å²	46	48.1 Å²	48.1	38%	0.38	24%	0.235	S	C	.	.	H	α-helix	trans	-60	-46.1	176.9	0	0	0	0	0	112.1	I177 K178 A179 R184 E185	I177-A181 WeakPolarHBondContact O-CB 3.19Å; I177-A181 PolarHBondContact O-N 2.91Å; K178-A181 PolarHBondContact O-N 2.75Å; A179-A181 PolarHBondContact O-N 3.42Å; A181-R184 PolarHBondContact O-N 3.48Å; A181-E185 WeakPolarHBondContact O-CG 3.29Å; A181-E185 PolarHBondContact O-N 2.85Å
182	K	86.6	Confident	86.9	Confident	40 Å²	40	49.8 Å²	49.8	17%	0.174	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-45.1	176.9	-85.3	-171.7	166.3	-171.8	0	112.8	I130 I131 T133 V135 F140 K178 A179 V180 E185 F186	I130-K182 WeakPolarHBondContact O-CD 3.34Å; I130-K182 WeakPolarHBondContact O-CE 3.45Å; I130-K182 PolarHBondContact O-NZ 3.42Å; I131-K182 WeakPolarHBondContact O-CE 3.37Å; I131-K182 PolarHBondContact O-NZ 3.47Å; T133-K182 PolarHBondContact O-NZ 2.88Å; V135-K182 HydrophobicContact CG2-CB 3.78Å; V135-K182 HydrophobicContact CG2-CD 4.24Å; V135-K182 HydrophobicContact CG2-CG 4.44Å; F140-K182 HydrophobicContact CE2-CD 4.18Å; K178-K182 PolarHBondContact O-N 3.16Å; A179-K182 PolarHBondContact O-N 3.02Å; V180-K182 PolarHBondContact O-N 2.66Å; K182-E185 PolarHBondContact O-N 3.09Å; K182-F186 WeakPolarHBondContact O-CB 3.26Å; K182-F186 PolarHBondContact O-N 3.37Å
183	I	87.9	Confident	87	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-44.3	178.6	-71	166.1	0	0	0	110.2	F140 L144 A179 V180 F186 L187 Y214 F217 L218	F140-I183 HydrophobicContact CE1-CD1 4.46Å; F140-I183 HydrophobicContact CE1-CG1 4.12Å; F140-I183 HydrophobicContact CZ-CG1 4.34Å; L144-I183 HydrophobicContact CD1-CD1 4.01Å; L144-I183 HydrophobicContact CD2-CD1 3.64Å; A179-I183 WeakPolarHBondContact O-CB 3.26Å; A179-I183 VanDerWaalsContact O-CG1 3.26Å; A179-I183 WeakPolarHBondContact O-CG1 3.43Å; A179-I183 PolarHBondContact O-N 3.25Å; V180-I183 PolarHBondContact O-N 3.33Å; I183-F186 PolarHBondContact O-N 3.49Å; I183-L187 HydrophobicContact CG2-CD1 3.81Å; I183-L187 HydrophobicContact CG2-CG 4.21Å; I183-L187 WeakPolarHBondContact O-CB 3.39Å; I183-L187 WeakPolarHBondContact O-CG 3.33Å; I183-L187 PolarHBondContact O-N 3.01Å; I183-Y214 HydrophobicContact CD1-CD1 4.36Å; I183-Y214 HydrophobicContact CG1-CD1 4.43Å; I183-Y214 HydrophobicContact CG1-CG 4.27Å; I183-Y214 HydrophobicContact CG2-CD2 4.44Å; I183-Y214 HydrophobicContact CG2-CG 4.18Å; I183-F217 HydrophobicContact CD1-CD1 3.58Å; I183-F217 HydrophobicContact CD1-CE1 4.04Å; I183-F217 HydrophobicContact CD1-CG 4.36Å; I183-L218 HydrophobicContact CB-CD2 4.45Å; I183-L218 HydrophobicContact CG2-CD1 3.82Å; I183-L218 HydrophobicContact CG2-CD2 4.03Å; I183-L218 HydrophobicContact CG2-CG 3.82Å
184	R	90.2	Very high	87.1	Confident	61 Å²	61	46.1 Å²	46.1	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-56.9	-54.2	176.1	-179.7	-177.1	172.9	-80.9	-0.3	111.2	V180 A181 F186 L187 L188 I225 E228	V180-R184 VanDerWaalsContact O-CB 3.26Å; V180-R184 WeakPolarHBondContact O-CB 3.14Å; V180-R184 PolarHBondContact O-N 3.31Å; A181-R184 PolarHBondContact O-N 3.48Å; R184-F186 VanDerWaalsContact C-N 3.28Å; R184-F186 PolarHBondContact O-N 3Å; R184-L187 PolarHBondContact O-N 3.05Å; R184-L188 HydrophobicContact CG-CD1 3.77Å; R184-L188 HydrophobicContact CG-CG 4.28Å; R184-L188 VanDerWaalsContact CZ-CD1 3.48Å; R184-L188 WeakPolarHBondContact O-CB 3.48Å; R184-L188 WeakPolarHBondContact O-CG 3.38Å; R184-L188 PolarHBondContact O-N 3.29Å; R184-I225 HydrophobicContact CB-CG2 3.81Å; R184-I225 HydrophobicContact CG-CG2 3.82Å; R184-E228 IonicContact CZ-OE1 3.48Å; R184-E228 IonicContact CZ-OE2 3.17Å; R184-E228 IonicContact NE-OE1 3.51Å; R184-E228 IonicContact NE-OE2 2.84Å; R184-E228 PolarHBondContact NE-OE2 3.3Å; R184-E228 IonicContact NH2-OE1 2.67Å; R184-E228 PolarHBondContact NH2-OE1 2.87Å; R184-E228 IonicContact NH2-OE2 2.65Å; R184-E228 PolarHBondContact NH2-OE2 3.41Å
185	E	88.9	Confident	87	Confident	121 Å²	121	44.7 Å²	44.7	57%	0.565	22%	0.216	S	C	*	.	H	α-helix	trans	-58.7	-40.8	179.3	-69.8	-55.1	127.4	0	0	111.9	A181 K182 G189	A181-E185 WeakPolarHBondContact O-CG 3.29Å; A181-E185 PolarHBondContact O-N 2.85Å; K182-E185 PolarHBondContact O-N 3.09Å; E185-G189 PolarHBondContact O-N 2.92Å
186	F	89.3	Confident	86.8	Confident	31 Å²	31	51.1 Å²	51.1	14%	0.136	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-50	177.2	177.2	-101.3	0	0	0	112.5	V135 T136 K182 I183 R184 G189 K190 F211 Y214	V135-F186 HydrophobicContact CB-CB 4.21Å; V135-F186 HydrophobicContact CB-CD2 4.23Å; V135-F186 HydrophobicContact CB-CG 4.14Å; V135-F186 HydrophobicContact CG1-CB 3.9Å; V135-F186 HydrophobicContact CG1-CD1 3.84Å; V135-F186 HydrophobicContact CG1-CD2 4.21Å; V135-F186 HydrophobicContact CG1-CE1 4.42Å; V135-F186 HydrophobicContact CG1-CG 3.71Å; V135-F186 HydrophobicContact CG2-CB 4.48Å; T136-F186 HydrophobicContact CG2-CE2 3.84Å; K182-F186 WeakPolarHBondContact O-CB 3.26Å; K182-F186 PolarHBondContact O-N 3.37Å; I183-F186 PolarHBondContact O-N 3.49Å; R184-F186 VanDerWaalsContact C-N 3.28Å; R184-F186 PolarHBondContact O-N 3Å; F186-G189 PolarHBondContact O-N 3.47Å; F186-K190 HydrophobicContact CE1-CG 4.18Å; F186-K190 HydrophobicContact CE2-CG 4.28Å; F186-K190 HydrophobicContact CZ-CD 4.45Å; F186-K190 HydrophobicContact CZ-CG 4.05Å; F186-K190 WeakPolarHBondContact O-CG 3.25Å; F186-K190 PolarHBondContact O-N 3.44Å; F186-F211 HydrophobicContact CE1-CB 4.4Å; F186-F211 HydrophobicContact CE1-CD1 4.17Å; F186-F211 AromaticContact CE1-CD2 3.65Å; F186-F211 HydrophobicContact CE1-CD2 3.65Å; F186-F211 HydrophobicContact CE1-CE1 4.33Å; F186-F211 AromaticContact CE1-CE2 3.88Å; F186-F211 HydrophobicContact CE1-CE2 3.88Å; F186-F211 AromaticContact CE1-CG 3.8Å; F186-F211 HydrophobicContact CE1-CG 3.8Å; F186-F211 HydrophobicContact CE1-CZ 4.19Å; F186-F211 HydrophobicContact CZ-CD1 4.5Å; F186-F211 AromaticContact CZ-CD2 3.83Å; F186-F211 HydrophobicContact CZ-CD2 3.83Å; F186-F211 HydrophobicContact CZ-CE1 4.22Å; F186-F211 AromaticContact CZ-CE2 3.54Å; F186-F211 HydrophobicContact CZ-CE2 3.54Å; F186-F211 HydrophobicContact CZ-CG 4.3Å; F186-F211 AromaticContact CZ-CZ 3.73Å; F186-F211 HydrophobicContact CZ-CZ 3.73Å; F186-Y214 HydrophobicContact CD1-CD2 4.17Å; F186-Y214 HydrophobicContact CD1-CE2 4.13Å; F186-Y214 HydrophobicContact CE1-CD2 4.33Å; F186-Y214 HydrophobicContact CE1-CE2 4.1Å
187	L	87.9	Confident	86	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-43.9	-178.8	-69.9	-179.5	0	0	0	111.6	I183 R184 K190 I191 L218 V229 F369	I183-L187 HydrophobicContact CG2-CD1 3.81Å; I183-L187 HydrophobicContact CG2-CG 4.21Å; I183-L187 WeakPolarHBondContact O-CB 3.39Å; I183-L187 WeakPolarHBondContact O-CG 3.33Å; I183-L187 PolarHBondContact O-N 3.01Å; R184-L187 PolarHBondContact O-N 3.05Å; L187-K190 PolarHBondContact O-N 3.41Å; L187-I191 VanDerWaalsContact O-CG1 3.27Å; L187-I191 WeakPolarHBondContact O-CG1 3.23Å; L187-I191 PolarHBondContact O-N 3.23Å; L187-L218 HydrophobicContact CD1-CD1 3.76Å; L187-V229 HydrophobicContact CB-CG1 4.1Å; L187-V229 HydrophobicContact CB-CG2 4.36Å; L187-V229 HydrophobicContact CD1-CG1 4.12Å; L187-F369 HydrophobicContact CD2-CZ 4.02Å
188	L	88.5	Confident	85	Confident	6 Å²	6	56.6 Å²	56.6	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-43.1	174.7	-69.4	-179.6	0	0	0	111.3	R184 K190 I191 Y192 V229 E232	R184-L188 HydrophobicContact CG-CD1 3.77Å; R184-L188 HydrophobicContact CG-CG 4.28Å; R184-L188 VanDerWaalsContact CZ-CD1 3.48Å; R184-L188 WeakPolarHBondContact O-CB 3.48Å; R184-L188 WeakPolarHBondContact O-CG 3.38Å; R184-L188 PolarHBondContact O-N 3.29Å; L188-K190 VanDerWaalsContact C-N 3.32Å; L188-K190 PolarHBondContact O-N 3.36Å; L188-I191 PolarHBondContact O-N 2.9Å; L188-Y192 HydrophobicContact CB-CD2 4.43Å; L188-Y192 HydrophobicContact CB-CE2 4Å; L188-Y192 WeakPolarHBondContact O-CD2 3.21Å; L188-Y192 VanDerWaalsContact O-CG 3.27Å; L188-Y192 PolarHBondContact O-N 3.41Å; L188-V229 HydrophobicContact CD2-CG2 4.32Å; L188-E232 HydrophobicContact CD2-CB 3.96Å; L188-E232 HydrophobicContact CD2-CG 4.07Å
189	G	87.5	Confident	84.2	Confident	39 Å²	39	54.2 Å²	54.2	40%	0.402	28%	0.28	S	S	.	.	H	α-helix	trans	-58.1	-41.7	174	0	0	0	0	0	112.9	E185 F186 Y192 S193	E185-G189 PolarHBondContact O-N 2.92Å; F186-G189 PolarHBondContact O-N 3.47Å; G189-Y192 PolarHBondContact O-N 3.44Å; G189-S193 PolarHBondContact O-N 3.44Å
190	K	85.9	Confident	83.7	Confident	52 Å²	52	58.1 Å²	58.1	23%	0.226	30%	0.3	C	S	.	.	H	α-helix	trans	-66.3	-42.6	174.2	-71.2	-67.4	-175.6	178	0	112	F186 L187 L188 Y192 S193 L194 M208	F186-K190 HydrophobicContact CE1-CG 4.18Å; F186-K190 HydrophobicContact CE2-CG 4.28Å; F186-K190 HydrophobicContact CZ-CD 4.45Å; F186-K190 HydrophobicContact CZ-CG 4.05Å; F186-K190 WeakPolarHBondContact O-CG 3.25Å; F186-K190 PolarHBondContact O-N 3.44Å; L187-K190 PolarHBondContact O-N 3.41Å; L188-K190 VanDerWaalsContact C-N 3.32Å; L188-K190 PolarHBondContact O-N 3.36Å; K190-Y192 VanDerWaalsContact C-N 3.34Å; K190-Y192 PolarHBondContact O-N 2.8Å; K190-S193 WeakPolarHBondContact O-CB 3.42Å; K190-S193 PolarHBondContact O-N 3.14Å; K190-S193 VanDerWaalsContact O-N 3.16Å; K190-S193 PolarHBondContact O-OG 2.95Å; K190-L194 PolarHBondContact O-N 3.22Å; K190-M208 HydrophobicContact CB-CG 4.13Å; K190-M208 HydrophobicContact CB-SD 4.03Å
191	I	87	Confident	83.2	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-43.9	174.6	-68.6	166.4	0	0	0	110.8	L187 L188 S193 L194 M208 V229 Y233 T236	L187-I191 VanDerWaalsContact O-CG1 3.27Å; L187-I191 WeakPolarHBondContact O-CG1 3.23Å; L187-I191 PolarHBondContact O-N 3.23Å; L188-I191 PolarHBondContact O-N 2.9Å; I191-S193 VanDerWaalsContact C-N 3.29Å; I191-S193 PolarHBondContact O-N 2.86Å; I191-L194 VanDerWaalsContact O-CB 3.29Å; I191-L194 WeakPolarHBondContact O-CB 3.41Å; I191-L194 PolarHBondContact O-N 3.28Å; I191-L194 VanDerWaalsContact O-N 3.14Å; I191-M208 HydrophobicContact CG1-CE 4.06Å; I191-V229 HydrophobicContact CD1-CG1 3.8Å; I191-Y233 HydrophobicContact CD1-CD2 4.45Å; I191-Y233 HydrophobicContact CG1-CD2 4.15Å; I191-T236 HydrophobicContact CG2-CG2 4.1Å; I191-T236 WeakPolarHBondContact CG2-OG1 3.29Å
192	Y	88.1	Confident	82.7	Confident	98 Å²	98	59 Å²	59	38%	0.384	30%	0.296	S	S	.	.	H	α-helix	trans	-68	-29.1	177.1	-63.3	-38.8	0	0	0	112.9	L188 G189 K190 L194 R195 E232	L188-Y192 HydrophobicContact CB-CD2 4.43Å; L188-Y192 HydrophobicContact CB-CE2 4Å; L188-Y192 WeakPolarHBondContact O-CD2 3.21Å; L188-Y192 VanDerWaalsContact O-CG 3.27Å; L188-Y192 PolarHBondContact O-N 3.41Å; G189-Y192 PolarHBondContact O-N 3.44Å; K190-Y192 VanDerWaalsContact C-N 3.34Å; K190-Y192 PolarHBondContact O-N 2.8Å; Y192-L194 PolarHBondContact O-N 3.07Å; Y192-R195 VanDerWaalsContact CE1-NH1 3.35Å; Y192-R195 WeakPolarHBondContact O-CB 3.32Å; Y192-R195 PolarHBondContact O-N 2.96Å; Y192-R195 VanDerWaalsContact O-N 3.09Å; Y192-E232 WeakPolarHBondContact CE1-OE2 3.21Å; Y192-E232 PolarHBondContact OH-OE2 3.19Å
193	S	85.1	Confident	82.5	Confident	32 Å²	32	60.7 Å²	60.7	22%	0.224	31%	0.309	C	S	.	.	H	α-helix	trans	-63.1	-28.1	172.8	81.8	0	0	0	0	112.9	G189 K190 I191 R195 K196	G189-S193 PolarHBondContact O-N 3.44Å; K190-S193 WeakPolarHBondContact O-CB 3.42Å; K190-S193 PolarHBondContact O-N 3.14Å; K190-S193 VanDerWaalsContact O-N 3.16Å; K190-S193 PolarHBondContact O-OG 2.95Å; I191-S193 VanDerWaalsContact C-N 3.29Å; I191-S193 PolarHBondContact O-N 2.86Å; S193-R195 PolarHBondContact O-N 2.99Å; S193-K196 WeakPolarHBondContact O-CB 3.42Å; S193-K196 PolarHBondContact O-N 3.03Å
194	L	83.5	Confident	82	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.021	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-17.1	176.1	-62.3	157.4	0	0	0	112.6	K190 I191 Y192 K196 P204 M208 Y233 T236 M237	K190-L194 PolarHBondContact O-N 3.22Å; I191-L194 VanDerWaalsContact O-CB 3.29Å; I191-L194 WeakPolarHBondContact O-CB 3.41Å; I191-L194 PolarHBondContact O-N 3.28Å; I191-L194 VanDerWaalsContact O-N 3.14Å; Y192-L194 PolarHBondContact O-N 3.07Å; L194-K196 VanDerWaalsContact C-N 3.31Å; L194-P204 HydrophobicContact CD2-CB 3.62Å; L194-P204 HydrophobicContact CD2-CG 3.93Å; L194-P204 HydrophobicContact CG-CB 4.39Å; L194-M208 HydrophobicContact CD1-SD 3.94Å; L194-Y233 HydrophobicContact CD1-CE2 4.5Å; L194-T236 HydrophobicContact CB-CG2 4.37Å; L194-M237 HydrophobicContact CB-CE 3.9Å; L194-M237 HydrophobicContact CD1-CE 3.21Å; L194-M237 HydrophobicContact CD2-CE 3.77Å; L194-M237 HydrophobicContact CG-CE 3.78Å
195	R	83.7	Confident	81.7	Confident	110 Å²	110	58.8 Å²	58.8	42%	0.415	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-18	176.2	-62.7	179.5	177.7	-179.8	1.4	113.1	Y192 S193 E232 T236	Y192-R195 VanDerWaalsContact CE1-NH1 3.35Å; Y192-R195 WeakPolarHBondContact O-CB 3.32Å; Y192-R195 PolarHBondContact O-N 2.96Å; Y192-R195 VanDerWaalsContact O-N 3.09Å; S193-R195 PolarHBondContact O-N 2.99Å; R195-E232 IonicContact CZ-OE2 3.97Å; R195-E232 IonicContact NH2-OE2 2.94Å; R195-E232 PolarHBondContact NH2-OE2 3.38Å; R195-T236 HydrophobicContact CG-CG2 3.49Å; R195-T236 VanDerWaalsContact CG-CG2 3.49Å; R195-T236 PolarHBondContact NE-OG1 2.79Å; R195-T236 VanDerWaalsContact NE-OG1 3.1Å; R195-T236 PolarHBondContact NH2-OG1 3.01Å
196	K	80.1	Confident	81.4	Confident	141 Å²	141	57.7 Å²	57.7	61%	0.613	30%	0.302	S	S	*	.	S	Bend	trans	-65.5	124.9	-176	-70.3	-177.4	179.9	-175.5	0	109.6	S193 L194 T199	S193-K196 WeakPolarHBondContact O-CB 3.42Å; S193-K196 PolarHBondContact O-N 3.03Å; L194-K196 VanDerWaalsContact C-N 3.31Å; K196-T199 VanDerWaalsContact CB-OG1 3.26Å; K196-T199 WeakPolarHBondContact CB-OG1 3.39Å; K196-T199 VanDerWaalsContact O-CB 3.23Å; K196-T199 WeakPolarHBondContact O-CB 3.42Å; K196-T199 PolarHBondContact O-N 2.88Å; K196-T199 PolarHBondContact O-OG1 3.35Å
197	P	69.7	Low	81	Confident	117 Å²	117	60.1 Å²	60.1	76%	0.76	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	151.2	-179.7	26.2	-34.3	0	0	0	110.9	T199	P197-T199 PolarHBondContact O-N 2.88Å
198	L	67.1	Low	80.7	Confident	185 Å²	185	60.2 Å²	60.2	97%	0.969	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	-3.4	-176.3	-56.5	168.3	0	0	0	115.8	N200	L198-N200 PolarHBondContact O-N 3.31Å
199	T	70	Confident	80.4	Confident	50 Å²	50	62 Å²	62	31%	0.307	32%	0.324	S	S	.	.			trans	-65.2	124	172	-51.3	0	0	0	0	108.7	K196 P197 Y201 P204	K196-T199 VanDerWaalsContact CB-OG1 3.26Å; K196-T199 WeakPolarHBondContact CB-OG1 3.39Å; K196-T199 VanDerWaalsContact O-CB 3.23Å; K196-T199 WeakPolarHBondContact O-CB 3.42Å; K196-T199 PolarHBondContact O-N 2.88Å; K196-T199 PolarHBondContact O-OG1 3.35Å; P197-T199 PolarHBondContact O-N 2.88Å; T199-Y201 VanDerWaalsContact C-N 3.26Å; T199-Y201 PolarHBondContact O-N 2.88Å; T199-P204 HydrophobicContact CG2-CG 3.98Å
200	N	74.8	Confident	80	Confident	81 Å²	81	67.8 Å²	67.8	43%	0.433	34%	0.338	S	S	.	.			trans	-68.5	91.3	166.5	-175.2	-6.1	0	0	0	107.9	L198 Q202 V203 P204	L198-N200 PolarHBondContact O-N 3.31Å; N200-Q202 PolarHBondContact O-N 2.68Å; N200-Q202 VanDerWaalsContact OD1-CB 3.22Å; N200-Q202 WeakPolarHBondContact OD1-CB 3.3Å; N200-Q202 VanDerWaalsContact OD1-CG 3.26Å; N200-Q202 WeakPolarHBondContact OD1-CG 3.24Å; N200-Q202 PolarHBondContact OD1-N 3.48Å; N200-Q202 PolarHBondContact OD1-OE1 3.25Å; N200-V203 HydrophobicContact CB-CG2 4.41Å; N200-V203 PolarHBondContact O-N 3.19Å; N200-P204 WeakPolarHBondContact O-CD 3.44Å
201	Y	76.8	Confident	79.6	Confident	25 Å²	25	66.7 Å²	66.7	10%	0.098	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-19.4	-176.6	51.3	-100.4	0	0	0	113.2	T199 V203 P204 Q205 V240 Y241	T199-Y201 VanDerWaalsContact C-N 3.26Å; T199-Y201 PolarHBondContact O-N 2.88Å; Y201-V203 VanDerWaalsContact C-N 3.33Å; Y201-V203 PolarHBondContact O-N 3.32Å; Y201-P204 WeakPolarHBondContact O-CD 3.48Å; Y201-Q205 WeakPolarHBondContact O-CB 3.47Å; Y201-Q205 WeakPolarHBondContact O-CG 3.45Å; Y201-Q205 PolarHBondContact O-N 2.91Å; Y201-V240 HydrophobicContact CD1-CG1 3.66Å; Y201-V240 HydrophobicContact CE1-CG1 4.06Å; Y201-V240 HydrophobicContact CG-CG1 4.24Å; Y201-Y241 HydrophobicContact CD2-CE1 4.17Å; Y201-Y241 HydrophobicContact CE2-CD1 4.37Å; Y201-Y241 AromaticContact CE2-CE1 3.47Å; Y201-Y241 HydrophobicContact CE2-CE1 3.47Å; Y201-Y241 VanDerWaalsContact CE2-CE1 3.47Å; Y201-Y241 AromaticContact CZ-CE1 3.69Å
202	Q	78.9	Confident	79.4	Confident	47 Å²	47	73.6 Å²	73.6	22%	0.22	36%	0.359	C	S	.	.	H	α-helix	trans	-62.9	-37.3	173.5	-56.2	173.7	-19.8	0	0	112.2	N200 N206	N200-Q202 PolarHBondContact O-N 2.68Å; N200-Q202 VanDerWaalsContact OD1-CB 3.22Å; N200-Q202 WeakPolarHBondContact OD1-CB 3.3Å; N200-Q202 VanDerWaalsContact OD1-CG 3.26Å; N200-Q202 WeakPolarHBondContact OD1-CG 3.24Å; N200-Q202 PolarHBondContact OD1-N 3.48Å; N200-Q202 PolarHBondContact OD1-OE1 3.25Å; Q202-N206 WeakPolarHBondContact O-CB 3.29Å; Q202-N206 PolarHBondContact O-N 3.36Å; Q202-N206 PolarHBondContact O-ND2 3.02Å
203	V	81.8	Confident	78.9	Confident	74 Å²	74	70.3 Å²	70.3	45%	0.448	35%	0.347	S	S	.	.	H	α-helix	trans	-68.5	-50.3	-178.6	177.1	0	0	0	0	110.8	N200 Y201 N206 Q207	N200-V203 HydrophobicContact CB-CG2 4.41Å; N200-V203 PolarHBondContact O-N 3.19Å; Y201-V203 VanDerWaalsContact C-N 3.33Å; Y201-V203 PolarHBondContact O-N 3.32Å; V203-N206 PolarHBondContact O-N 2.88Å; V203-Q207 WeakPolarHBondContact O-CG 3.33Å; V203-Q207 PolarHBondContact O-N 2.92Å
204	P	78.2	Confident	78.9	Confident	14 Å²	14	68.8 Å²	68.8	9%	0.091	34%	0.336	C	S	.	.	H	α-helix	trans	-68.3	-32	175.3	-15.9	28.4	0	0	0	114	L194 T199 N200 Y201 Q207 M208	L194-P204 HydrophobicContact CD2-CB 3.62Å; L194-P204 HydrophobicContact CD2-CG 3.93Å; L194-P204 HydrophobicContact CG-CB 4.39Å; T199-P204 HydrophobicContact CG2-CG 3.98Å; N200-P204 WeakPolarHBondContact O-CD 3.44Å; Y201-P204 WeakPolarHBondContact O-CD 3.48Å; P204-Q207 WeakPolarHBondContact O-CB 3.41Å; P204-Q207 PolarHBondContact O-N 3.37Å; P204-M208 VanDerWaalsContact O-CG 3.29Å; P204-M208 WeakPolarHBondContact O-CG 3.46Å; P204-M208 PolarHBondContact O-N 3.39Å
205	Q	83.2	Confident	78.7	Confident	7 Å²	7	69 Å²	69	3%	0.033	34%	0.337	C	S	.	.	H	α-helix	trans	-58.9	-49.1	171.4	-81.5	176.4	-34.3	0	0	111.2	Y201 Q207 M208 L209 Y233 M237 Y241 E362 F365	Y201-Q205 WeakPolarHBondContact O-CB 3.47Å; Y201-Q205 WeakPolarHBondContact O-CG 3.45Å; Y201-Q205 PolarHBondContact O-N 2.91Å; Q205-Q207 VanDerWaalsContact C-N 3.28Å; Q205-Q207 PolarHBondContact O-N 3.19Å; Q205-M208 WeakPolarHBondContact O-CA 3.36Å; Q205-M208 WeakPolarHBondContact O-CB 3.34Å; Q205-M208 PolarHBondContact O-N 2.82Å; Q205-L209 PolarHBondContact O-N 3.39Å; Q205-L209 VanDerWaalsContact O-N 3.17Å; Q205-Y233 PolarHBondContact NE2-OH 3.13Å; Q205-M237 HydrophobicContact CG-CE 3.95Å; Q205-Y241 PolarHBondContact NE2-OH 2.97Å; Q205-E362 PolarHBondContact NE2-OE2 2.87Å; Q205-F365 HydrophobicContact CB-CD2 3.92Å; Q205-F365 HydrophobicContact CB-CE2 3.95Å; Q205-F365 HydrophobicContact CG-CD2 4.31Å; Q205-F365 HydrophobicContact CG-CE2 4.25Å; Q205-F365 HydrophobicContact CG-CZ 4.47Å; Q205-F365 VanDerWaalsContact O-CE2 3.29Å; Q205-F365 WeakPolarHBondContact O-CE2 3.33Å
206	N	81.8	Confident	78.6	Confident	99 Å²	99	65.2 Å²	65.2	53%	0.529	33%	0.327	S	S	.	.	H	α-helix	trans	-61.7	-35	175.8	-78	-34.5	0	0	0	112.8	Q202 V203 M208 L209	Q202-N206 WeakPolarHBondContact O-CB 3.29Å; Q202-N206 PolarHBondContact O-N 3.36Å; Q202-N206 PolarHBondContact O-ND2 3.02Å; V203-N206 PolarHBondContact O-N 2.88Å; N206-M208 VanDerWaalsContact C-N 3.34Å; N206-L209 PolarHBondContact O-N 3.01Å
207	Q	82.6	Confident	78.7	Confident	82 Å²	82	58.5 Å²	58.5	38%	0.383	30%	0.298	S	S	.	.	H	α-helix	trans	-67	-35.4	172.8	-70	172.9	3.8	0	0	112.2	V203 P204 Q205 L209 K210 F211	V203-Q207 WeakPolarHBondContact O-CG 3.33Å; V203-Q207 PolarHBondContact O-N 2.92Å; P204-Q207 WeakPolarHBondContact O-CB 3.41Å; P204-Q207 PolarHBondContact O-N 3.37Å; Q205-Q207 VanDerWaalsContact C-N 3.28Å; Q205-Q207 PolarHBondContact O-N 3.19Å; Q207-L209 VanDerWaalsContact C-N 3.28Å; Q207-L209 PolarHBondContact O-N 3.17Å; Q207-K210 WeakPolarHBondContact O-CB 3.11Å; Q207-K210 PolarHBondContact O-N 3.21Å; Q207-F211 VanDerWaalsContact O-CD2 3.31Å; Q207-F211 WeakPolarHBondContact O-CD2 3.04Å
208	M	81.6	Confident	79.3	Confident	1 Å²	1	53 Å²	53	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-29.2	176.8	-73.8	176.5	68.3	0	0	112.4	K190 I191 L194 P204 Q205 N206 K210 F211 F365 F369	K190-M208 HydrophobicContact CB-CG 4.13Å; K190-M208 HydrophobicContact CB-SD 4.03Å; I191-M208 HydrophobicContact CG1-CE 4.06Å; L194-M208 HydrophobicContact CD1-SD 3.94Å; P204-M208 VanDerWaalsContact O-CG 3.29Å; P204-M208 WeakPolarHBondContact O-CG 3.46Å; P204-M208 PolarHBondContact O-N 3.39Å; Q205-M208 WeakPolarHBondContact O-CA 3.36Å; Q205-M208 WeakPolarHBondContact O-CB 3.34Å; Q205-M208 PolarHBondContact O-N 2.82Å; N206-M208 VanDerWaalsContact C-N 3.34Å; M208-K210 PolarHBondContact O-N 3.16Å; M208-F211 WeakPolarHBondContact O-CA 3.36Å; M208-F211 PolarHBondContact O-N 3.21Å; M208-F365 HydrophobicContact CB-CE2 4.24Å; M208-F365 HydrophobicContact CB-CZ 4.39Å; M208-F369 HydrophobicContact CB-CD2 4.4Å; M208-F369 HydrophobicContact CB-CE2 4.12Å; M208-F369 HydrophobicContact CE-CE1 4.29Å; M208-F369 HydrophobicContact CE-CE2 4.29Å; M208-F369 HydrophobicContact CE-CZ 3.89Å; M208-F369 WeakPolarHBondContact O-CE2 3.15Å
209	L	81.2	Confident	80	Confident	45 Å²	45	48.4 Å²	48.4	24%	0.236	24%	0.238	C	C	.	.	H	α-helix	trans	-60.2	-31.2	175.7	-69.3	175	0	0	0	113.2	Q205 N206 Q207 F211 R212 F365 D368 F369	Q205-L209 PolarHBondContact O-N 3.39Å; Q205-L209 VanDerWaalsContact O-N 3.17Å; N206-L209 PolarHBondContact O-N 3.01Å; Q207-L209 VanDerWaalsContact C-N 3.28Å; Q207-L209 PolarHBondContact O-N 3.17Å; L209-F211 PolarHBondContact O-N 3.27Å; L209-F211 VanDerWaalsContact O-N 3.12Å; L209-R212 WeakPolarHBondContact O-CB 3.38Å; L209-R212 PolarHBondContact O-N 3.37Å; L209-R212 VanDerWaalsContact O-N 3.15Å; L209-F365 HydrophobicContact CD1-CD2 4.43Å; L209-F365 HydrophobicContact CD2-CD2 3.75Å; L209-F365 HydrophobicContact CD2-CE2 3.95Å; L209-F365 HydrophobicContact CG-CD2 3.94Å; L209-F365 HydrophobicContact CG-CE2 4.08Å; L209-D368 HydrophobicContact CD2-CB 3.83Å; L209-F369 HydrophobicContact CD2-CB 4.1Å
210	K	79.3	Confident	80.4	Confident	160 Å²	160	49.4 Å²	49.4	70%	0.696	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.5	173.7	-62.3	-172.8	176.8	-171.9	0	112.6	Q207 M208	Q207-K210 WeakPolarHBondContact O-CB 3.11Å; Q207-K210 PolarHBondContact O-N 3.21Å; M208-K210 PolarHBondContact O-N 3.16Å
211	F	77.6	Confident	80.6	Confident	28 Å²	28	46.5 Å²	46.5	12%	0.123	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	23.1	-176.6	-57	-67.4	0	0	0	112.5	F186 Q207 M208 L209 F213 Y214	F186-F211 HydrophobicContact CE1-CB 4.4Å; F186-F211 HydrophobicContact CE1-CD1 4.17Å; F186-F211 AromaticContact CE1-CD2 3.65Å; F186-F211 HydrophobicContact CE1-CD2 3.65Å; F186-F211 HydrophobicContact CE1-CE1 4.33Å; F186-F211 AromaticContact CE1-CE2 3.88Å; F186-F211 HydrophobicContact CE1-CE2 3.88Å; F186-F211 AromaticContact CE1-CG 3.8Å; F186-F211 HydrophobicContact CE1-CG 3.8Å; F186-F211 HydrophobicContact CE1-CZ 4.19Å; F186-F211 HydrophobicContact CZ-CD1 4.5Å; F186-F211 AromaticContact CZ-CD2 3.83Å; F186-F211 HydrophobicContact CZ-CD2 3.83Å; F186-F211 HydrophobicContact CZ-CE1 4.22Å; F186-F211 AromaticContact CZ-CE2 3.54Å; F186-F211 HydrophobicContact CZ-CE2 3.54Å; F186-F211 HydrophobicContact CZ-CG 4.3Å; F186-F211 AromaticContact CZ-CZ 3.73Å; F186-F211 HydrophobicContact CZ-CZ 3.73Å; Q207-F211 VanDerWaalsContact O-CD2 3.31Å; Q207-F211 WeakPolarHBondContact O-CD2 3.04Å; M208-F211 WeakPolarHBondContact O-CA 3.36Å; M208-F211 PolarHBondContact O-N 3.21Å; L209-F211 PolarHBondContact O-N 3.27Å; L209-F211 VanDerWaalsContact O-N 3.12Å; F211-F213 PolarHBondContact O-N 2.95Å; F211-F213 VanDerWaalsContact O-N 3.15Å; F211-Y214 HydrophobicContact CB-CD2 3.56Å; F211-Y214 HydrophobicContact CB-CE2 3.82Å; F211-Y214 HydrophobicContact CB-CG 4.18Å; F211-Y214 AromaticContact CD1-CD2 3.86Å; F211-Y214 HydrophobicContact CD1-CD2 3.86Å; F211-Y214 AromaticContact CD1-CE2 3.13Å; F211-Y214 HydrophobicContact CD1-CE2 3.13Å; F211-Y214 AromaticContact CD1-CZ 3.56Å; F211-Y214 AromaticContact CE1-CE2 3.89Å; F211-Y214 HydrophobicContact CE1-CE2 3.89Å; F211-Y214 AromaticContact CG-CD2 3.99Å; F211-Y214 HydrophobicContact CG-CD2 3.99Å; F211-Y214 AromaticContact CG-CE2 3.72Å; F211-Y214 HydrophobicContact CG-CE2 3.72Å; F211-Y214 VanDerWaalsContact O-CB 3.29Å; F211-Y214 WeakPolarHBondContact O-CB 3.32Å; F211-Y214 PolarHBondContact O-N 3.28Å
212	R	81.6	Confident	80.9	Confident	145 Å²	145	47.9 Å²	47.9	55%	0.547	24%	0.244	S	C	.	.	H	α-helix	trans	-51	-37.5	177.1	65.1	-177.7	-179	88.3	1.9	113.2	L209 Y214 N215 S216	L209-R212 WeakPolarHBondContact O-CB 3.38Å; L209-R212 PolarHBondContact O-N 3.37Å; L209-R212 VanDerWaalsContact O-N 3.15Å; R212-Y214 PolarHBondContact O-N 2.96Å; R212-N215 PolarHBondContact O-N 3.15Å; R212-S216 PolarHBondContact O-N 3.43Å; R212-S216 PolarHBondContact O-OG 3.33Å
213	F	79.5	Confident	81.2	Confident	29 Å²	29	53.6 Å²	53.6	13%	0.127	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-27.1	-180	-176.1	-108.6	0	0	0	112.7	L141 L144 H145 N148 F211 N215 S216 F217	L141-F213 HydrophobicContact CD1-CB 3.9Å; L141-F213 HydrophobicContact CD1-CD1 3.55Å; L141-F213 HydrophobicContact CD1-CG 4.09Å; L144-F213 HydrophobicContact CB-CE1 4.32Å; L144-F213 HydrophobicContact CD2-CD1 3.9Å; L144-F213 HydrophobicContact CD2-CE1 3.87Å; L144-F213 HydrophobicContact CG-CD1 4.44Å; L144-F213 HydrophobicContact CG-CE1 3.93Å; H145-F213 AromaticContact CD2-CE1 3.98Å; H145-F213 AromaticContact CE1-CD1 3.63Å; H145-F213 AromaticContact CE1-CD2 3.24Å; H145-F213 WeakPolarHBondContact CE1-CD2 3.45Å; H145-F213 AromaticContact CE1-CE1 3.61Å; H145-F213 AromaticContact CE1-CE2 3.23Å; H145-F213 WeakPolarHBondContact CE1-CE2 3.37Å; H145-F213 AromaticContact CE1-CG 3.45Å; H145-F213 VanDerWaalsContact CE1-CG 3.45Å; H145-F213 WeakPolarHBondContact CE1-CG 3.24Å; H145-F213 AromaticContact CE1-CZ 3.42Å; H145-F213 VanDerWaalsContact CE1-CZ 3.42Å; H145-F213 WeakPolarHBondContact CE1-CZ 3.5Å; H145-F213 AromaticContact CG-CE1 3.79Å; H145-F213 AromaticContact CG-CZ 3.87Å; H145-F213 AromaticContact ND1-CD2 3.92Å; H145-F213 AromaticContact ND1-CE1 3.56Å; H145-F213 AromaticContact ND1-CE2 3.41Å; H145-F213 WeakPolarHBondContact ND1-CE2 3.42Å; H145-F213 AromaticContact ND1-CZ 3.21Å; H145-F213 WeakPolarHBondContact ND1-CZ 3.35Å; H145-F213 AromaticContact NE2-CD1 3.6Å; H145-F213 AromaticContact NE2-CD2 3.89Å; H145-F213 AromaticContact NE2-CE1 3.87Å; H145-F213 AromaticContact NE2-CG 3.6Å; N148-F213 HydrophobicContact CB-CZ 4.2Å; F211-F213 PolarHBondContact O-N 2.95Å; F211-F213 VanDerWaalsContact O-N 3.15Å; F213-N215 VanDerWaalsContact C-N 3.3Å; F213-N215 PolarHBondContact O-N 3.18Å; F213-S216 WeakPolarHBondContact O-CB 3.4Å; F213-S216 PolarHBondContact O-N 2.9Å; F213-F217 HydrophobicContact CE1-CB 4.44Å; F213-F217 WeakPolarHBondContact O-CB 3.31Å; F213-F217 PolarHBondContact O-N 2.98Å
214	Y	83.4	Confident	81.5	Confident	1 Å²	1	55.9 Å²	55.9	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-64.3	-39.1	176.4	-66.6	-8.7	0	0	0	111.6	V135 F140 L141 L144 I183 F186 F211 R212 F217 L218	V135-Y214 HydrophobicContact CG1-CD2 4.02Å; V135-Y214 HydrophobicContact CG1-CE2 3.22Å; V135-Y214 PolarHBondContact O-OH 3.15Å; F140-Y214 HydrophobicContact CD1-CE1 4.17Å; F140-Y214 HydrophobicContact CE1-CE1 4.17Å; L141-Y214 HydrophobicContact CD1-CD1 4.3Å; L141-Y214 HydrophobicContact CD1-CE1 3.76Å; L144-Y214 HydrophobicContact CD2-CD1 3.54Å; L144-Y214 HydrophobicContact CD2-CE1 3.74Å; I183-Y214 HydrophobicContact CD1-CD1 4.36Å; I183-Y214 HydrophobicContact CG1-CD1 4.43Å; I183-Y214 HydrophobicContact CG1-CG 4.27Å; I183-Y214 HydrophobicContact CG2-CD2 4.44Å; I183-Y214 HydrophobicContact CG2-CG 4.18Å; F186-Y214 HydrophobicContact CD1-CD2 4.17Å; F186-Y214 HydrophobicContact CD1-CE2 4.13Å; F186-Y214 HydrophobicContact CE1-CD2 4.33Å; F186-Y214 HydrophobicContact CE1-CE2 4.1Å; F211-Y214 HydrophobicContact CB-CD2 3.56Å; F211-Y214 HydrophobicContact CB-CE2 3.82Å; F211-Y214 HydrophobicContact CB-CG 4.18Å; F211-Y214 AromaticContact CD1-CD2 3.86Å; F211-Y214 HydrophobicContact CD1-CD2 3.86Å; F211-Y214 AromaticContact CD1-CE2 3.13Å; F211-Y214 HydrophobicContact CD1-CE2 3.13Å; F211-Y214 AromaticContact CD1-CZ 3.56Å; F211-Y214 AromaticContact CE1-CE2 3.89Å; F211-Y214 HydrophobicContact CE1-CE2 3.89Å; F211-Y214 AromaticContact CG-CD2 3.99Å; F211-Y214 HydrophobicContact CG-CD2 3.99Å; F211-Y214 AromaticContact CG-CE2 3.72Å; F211-Y214 HydrophobicContact CG-CE2 3.72Å; F211-Y214 VanDerWaalsContact O-CB 3.29Å; F211-Y214 WeakPolarHBondContact O-CB 3.32Å; F211-Y214 PolarHBondContact O-N 3.28Å; R212-Y214 PolarHBondContact O-N 2.96Å; Y214-F217 PolarHBondContact O-N 3.46Å; Y214-L218 VanDerWaalsContact O-CG 3.3Å; Y214-L218 WeakPolarHBondContact O-CG 3.47Å; Y214-L218 PolarHBondContact O-N 3.35Å
215	N	80.7	Confident	81.9	Confident	9 Å²	9	56.6 Å²	56.6	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-69.9	-37.3	174.7	-173.5	49.7	0	0	0	111.6	R212 F213 F217 L218 L219 F369 F370	R212-N215 PolarHBondContact O-N 3.15Å; F213-N215 VanDerWaalsContact C-N 3.3Å; F213-N215 PolarHBondContact O-N 3.18Å; N215-F217 VanDerWaalsContact C-N 3.33Å; N215-F217 PolarHBondContact O-N 2.78Å; N215-L218 PolarHBondContact O-N 2.93Å; N215-L219 WeakPolarHBondContact O-CB 3.3Å; N215-L219 PolarHBondContact O-N 2.71Å; N215-F369 HydrophobicContact CB-CE1 4.37Å; N215-F369 HydrophobicContact CB-CZ 4.34Å; N215-F369 PolarHBondContact ND2-O 3.31Å; N215-F370 WeakPolarHBondContact ND2-CA 3.37Å
216	S	81.1	Confident	82	Confident	29 Å²	29	56.7 Å²	56.7	20%	0.203	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-44.5	171.7	-38.1	0	0	0	0	112	R212 F213 L219 A220 L371	R212-S216 PolarHBondContact O-N 3.43Å; R212-S216 PolarHBondContact O-OG 3.33Å; F213-S216 WeakPolarHBondContact O-CB 3.4Å; F213-S216 PolarHBondContact O-N 2.9Å; S216-L219 PolarHBondContact O-N 2.91Å; S216-A220 PolarHBondContact O-N 3.01Å; S216-A220 VanDerWaalsContact O-N 3.09Å; S216-L371 WeakPolarHBondContact OG-CD1 3.4Å
217	F	81.3	Confident	82.3	Confident	1 Å²	1	56.6 Å²	56.6	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-63.7	-47.8	178.4	-176.6	-94.7	0	0	0	111	L144 L147 N148 A179 V180 I183 F213 Y214 N215 L219 A220 H221	L144-F217 HydrophobicContact CD1-CD1 4.01Å; L144-F217 HydrophobicContact CD1-CD2 3.88Å; L144-F217 HydrophobicContact CD1-CE1 3.78Å; L144-F217 HydrophobicContact CD1-CE2 3.64Å; L144-F217 HydrophobicContact CD1-CG 4.06Å; L144-F217 HydrophobicContact CD1-CZ 3.6Å; L144-F217 HydrophobicContact CD2-CB 4.19Å; L144-F217 HydrophobicContact CD2-CD1 4.36Å; L144-F217 HydrophobicContact CD2-CD2 4.27Å; L144-F217 HydrophobicContact CD2-CG 4.01Å; L144-F217 HydrophobicContact CG-CD1 4.5Å; L144-F217 HydrophobicContact CG-CD2 3.88Å; L144-F217 HydrophobicContact CG-CE2 4.08Å; L144-F217 HydrophobicContact CG-CG 4.1Å; L144-F217 HydrophobicContact CG-CZ 4.49Å; L147-F217 HydrophobicContact CD2-CE2 4.45Å; L147-F217 HydrophobicContact CD2-CZ 4.07Å; N148-F217 HydrophobicContact CB-CD2 4.08Å; N148-F217 HydrophobicContact CB-CE2 4.11Å; A179-F217 HydrophobicContact CB-CE1 4.2Å; A179-F217 HydrophobicContact CB-CZ 4.38Å; V180-F217 HydrophobicContact CG2-CE1 3.91Å; I183-F217 HydrophobicContact CD1-CD1 3.58Å; I183-F217 HydrophobicContact CD1-CE1 4.04Å; I183-F217 HydrophobicContact CD1-CG 4.36Å; F213-F217 HydrophobicContact CE1-CB 4.44Å; F213-F217 WeakPolarHBondContact O-CB 3.31Å; F213-F217 PolarHBondContact O-N 2.98Å; Y214-F217 PolarHBondContact O-N 3.46Å; N215-F217 VanDerWaalsContact C-N 3.33Å; N215-F217 PolarHBondContact O-N 2.78Å; F217-L219 VanDerWaalsContact C-N 3.35Å; F217-L219 PolarHBondContact O-N 3.1Å; F217-A220 PolarHBondContact O-N 3.14Å; F217-H221 AromaticContact CD2-CE1 3.39Å; F217-H221 WeakPolarHBondContact CD2-CE1 3.41Å; F217-H221 AromaticContact CD2-ND1 3.69Å; F217-H221 AromaticContact CD2-NE2 3.92Å; F217-H221 AromaticContact CE2-CD2 3.77Å; F217-H221 AromaticContact CE2-CE1 3.23Å; F217-H221 WeakPolarHBondContact CE2-CE1 3.21Å; F217-H221 AromaticContact CE2-ND1 3.72Å; F217-H221 AromaticContact CE2-NE2 3.25Å; F217-H221 WeakPolarHBondContact CE2-NE2 3.27Å; F217-H221 AromaticContact CG-ND1 3.99Å; F217-H221 AromaticContact CZ-CD2 3.64Å; F217-H221 AromaticContact CZ-CE1 3.87Å; F217-H221 AromaticContact CZ-CG 3.94Å; F217-H221 AromaticContact CZ-NE2 3.63Å; F217-H221 WeakPolarHBondContact O-CB 3.45Å; F217-H221 PolarHBondContact O-N 3.4Å; F217-H221 PolarHBondContact O-ND1 2.61Å
218	L	83.7	Confident	82.7	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-45.8	174.5	-71.2	-179.6	0	0	0	111.4	V180 I183 L187 Y214 N215 A220 H221 D222 I225 A226 V229	V180-L218 HydrophobicContact CB-CD2 4.36Å; V180-L218 HydrophobicContact CG1-CD2 3.85Å; V180-L218 HydrophobicContact CG2-CD2 4.25Å; I183-L218 HydrophobicContact CB-CD2 4.45Å; I183-L218 HydrophobicContact CG2-CD1 3.82Å; I183-L218 HydrophobicContact CG2-CD2 4.03Å; I183-L218 HydrophobicContact CG2-CG 3.82Å; L187-L218 HydrophobicContact CD1-CD1 3.76Å; Y214-L218 VanDerWaalsContact O-CG 3.3Å; Y214-L218 WeakPolarHBondContact O-CG 3.47Å; Y214-L218 PolarHBondContact O-N 3.35Å; N215-L218 PolarHBondContact O-N 2.93Å; L218-A220 VanDerWaalsContact C-N 3.28Å; L218-A220 PolarHBondContact O-N 2.94Å; L218-H221 PolarHBondContact O-N 2.88Å; L218-D222 CarbonylContact O-C 3.59Å; L218-D222 WeakPolarHBondContact O-CA 3.29Å; L218-D222 PolarHBondContact O-N 3.36Å; L218-I225 HydrophobicContact CD1-CG2 4.13Å; L218-I225 HydrophobicContact CD2-CG2 3.86Å; L218-A226 HydrophobicContact CB-CB 4.04Å; L218-V229 HydrophobicContact CD1-CG2 4.27Å
219	L	80.1	Confident	83	Confident	89 Å²	89	56 Å²	56	47%	0.466	27%	0.266	S	S	.	.	H	α-helix	trans	-61.4	-36	-179.3	-174.9	62	0	0	0	112.9	N215 S216 F217 R223	N215-L219 WeakPolarHBondContact O-CB 3.3Å; N215-L219 PolarHBondContact O-N 2.71Å; S216-L219 PolarHBondContact O-N 2.91Å; F217-L219 VanDerWaalsContact C-N 3.35Å; F217-L219 PolarHBondContact O-N 3.1Å; L219-R223 HydrophobicContact CD1-CG 4.48Å
220	A	79.3	Confident	83.4	Confident	71 Å²	71	57.1 Å²	57.1	59%	0.587	27%	0.268	S	S	*	.	H	α-helix	trans	-76	-34.3	178.6	0	0	0	0	0	113.3	S216 F217 L218	S216-A220 PolarHBondContact O-N 3.01Å; S216-A220 VanDerWaalsContact O-N 3.09Å; F217-A220 PolarHBondContact O-N 3.14Å; L218-A220 VanDerWaalsContact C-N 3.28Å; L218-A220 PolarHBondContact O-N 2.94Å
221	H	79.6	Confident	84	Confident	20 Å²	20	53.1 Å²	53.1	9%	0.093	26%	0.257	C	S	.	.	H	α-helix	trans	-105.1	-38.7	-168.7	-64.7	67.3	0	0	0	113.8	N148 M151 R176 V180 F217 L218	N148-H221 PolarHBondContact OD1-CE1 3.47Å; M151-H221 WeakPolarHBondContact CE-CD2 3.33Å; M151-H221 WeakPolarHBondContact CE-NE2 3.23Å; M151-H221 PolarHBondContact SD-CD2 3.39Å; R176-H221 HydrophobicContact CG-CB 4.2Å; V180-H221 HydrophobicContact CG2-CB 4.45Å; F217-H221 AromaticContact CD2-CE1 3.39Å; F217-H221 WeakPolarHBondContact CD2-CE1 3.41Å; F217-H221 AromaticContact CD2-ND1 3.69Å; F217-H221 AromaticContact CD2-NE2 3.92Å; F217-H221 AromaticContact CE2-CD2 3.77Å; F217-H221 AromaticContact CE2-CE1 3.23Å; F217-H221 WeakPolarHBondContact CE2-CE1 3.21Å; F217-H221 AromaticContact CE2-ND1 3.72Å; F217-H221 AromaticContact CE2-NE2 3.25Å; F217-H221 WeakPolarHBondContact CE2-NE2 3.27Å; F217-H221 AromaticContact CG-ND1 3.99Å; F217-H221 AromaticContact CZ-CD2 3.64Å; F217-H221 AromaticContact CZ-CE1 3.87Å; F217-H221 AromaticContact CZ-CG 3.94Å; F217-H221 AromaticContact CZ-NE2 3.63Å; F217-H221 WeakPolarHBondContact O-CB 3.45Å; F217-H221 PolarHBondContact O-N 3.4Å; F217-H221 PolarHBondContact O-ND1 2.61Å; L218-H221 PolarHBondContact O-N 2.88Å
222	D	82.6	Confident	84.6	Confident	54 Å²	54	53.8 Å²	53.8	29%	0.289	26%	0.26	S	S	.	.			trans	-146.6	92.9	-175.8	-165.1	-36.9	0	0	0	111.7	V180 L218 E224 I225 A226	V180-D222 HydrophobicContact CG1-CB 4.12Å; V180-D222 HydrophobicContact CG2-CB 4.46Å; L218-D222 CarbonylContact O-C 3.59Å; L218-D222 WeakPolarHBondContact O-CA 3.29Å; L218-D222 PolarHBondContact O-N 3.36Å; D222-E224 VanDerWaalsContact C-N 3.28Å; D222-E224 PolarHBondContact O-N 2.96Å; D222-E224 PolarHBondContact OD1-N 3.09Å; D222-E224 VanDerWaalsContact OD1-N 3.09Å; D222-I225 HydrophobicContact CB-CB 4.4Å; D222-I225 PolarHBondContact OD1-N 3.45Å; D222-I225 WeakPolarHBondContact OD2-CD1 3.41Å; D222-A226 PolarHBondContact O-N 3.16Å; D222-A226 VanDerWaalsContact O-N 3.16Å
223	R	85.3	Confident	85.1	Confident	168 Å²	168	47 Å²	47	63%	0.634	23%	0.234	S	C	*	.	H	α-helix	trans	-69.8	-23.2	-177.8	-167.2	163.1	-179.4	156.8	-2.6	113.3	L219 K227	L219-R223 HydrophobicContact CD1-CG 4.48Å; R223-K227 VanDerWaalsContact O-CG 3.25Å; R223-K227 WeakPolarHBondContact O-CG 3.36Å; R223-K227 PolarHBondContact O-N 3.26Å
224	E	87.5	Confident	85.7	Confident	121 Å²	121	46.2 Å²	46.2	57%	0.565	23%	0.231	S	C	*	.	H	α-helix	trans	-75	-43.1	179.7	-66.5	-54.9	119.1	0	0	110.7	D222 K227 E228	D222-E224 VanDerWaalsContact C-N 3.28Å; D222-E224 PolarHBondContact O-N 2.96Å; D222-E224 PolarHBondContact OD1-N 3.09Å; D222-E224 VanDerWaalsContact OD1-N 3.09Å; E224-K227 WeakPolarHBondContact O-CB 3.32Å; E224-K227 PolarHBondContact O-N 3.31Å; E224-K227 IonicContact OE1-NZ 2.63Å; E224-K227 PolarHBondContact OE1-NZ 3.48Å; E224-K227 IonicContact OE2-NZ 3.99Å; E224-E228 PolarHBondContact O-N 3.44Å
225	I	87.5	Confident	86.2	Confident	29 Å²	29	49.5 Å²	49.5	15%	0.149	25%	0.249	C	C	.	.	H	α-helix	trans	-67	-37.9	174.1	-69.5	175.4	0	0	0	111.2	V180 R184 L218 D222 K227 E228 V229	V180-I225 HydrophobicContact CG1-CB 4.47Å; V180-I225 HydrophobicContact CG1-CD1 3.3Å; V180-I225 HydrophobicContact CG1-CG1 4.43Å; V180-I225 HydrophobicContact CG1-CG2 4.38Å; R184-I225 HydrophobicContact CB-CG2 3.81Å; R184-I225 HydrophobicContact CG-CG2 3.82Å; L218-I225 HydrophobicContact CD1-CG2 4.13Å; L218-I225 HydrophobicContact CD2-CG2 3.86Å; D222-I225 HydrophobicContact CB-CB 4.4Å; D222-I225 PolarHBondContact OD1-N 3.45Å; D222-I225 WeakPolarHBondContact OD2-CD1 3.41Å; I225-K227 VanDerWaalsContact C-N 3.33Å; I225-K227 PolarHBondContact O-N 3.4Å; I225-E228 WeakPolarHBondContact O-CB 3.05Å; I225-E228 PolarHBondContact O-N 2.91Å; I225-V229 HydrophobicContact CG2-CG2 4.47Å; I225-V229 WeakPolarHBondContact O-CG2 3.33Å; I225-V229 PolarHBondContact O-N 3.4Å
226	A	84.2	Confident	86.7	Confident	9 Å²	9	49.1 Å²	49.1	7%	0.074	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-42.5	173.3	0	0	0	0	0	112	L218 D222 R230	L218-A226 HydrophobicContact CB-CB 4.04Å; D222-A226 PolarHBondContact O-N 3.16Å; D222-A226 VanDerWaalsContact O-N 3.16Å; A226-R230 WeakPolarHBondContact O-CB 3.26Å; A226-R230 PolarHBondContact O-N 3.3Å; A226-R230 VanDerWaalsContact O-N 3.07Å
227	K	88	Confident	87.1	Confident	97 Å²	97	47.8 Å²	47.8	42%	0.422	24%	0.237	S	C	.	.	H	α-helix	trans	-63.3	-43.3	173.6	-74.9	169.1	-175.5	169.4	0	111.7	R223 E224 I225 R230 V231	R223-K227 VanDerWaalsContact O-CG 3.25Å; R223-K227 WeakPolarHBondContact O-CG 3.36Å; R223-K227 PolarHBondContact O-N 3.26Å; E224-K227 WeakPolarHBondContact O-CB 3.32Å; E224-K227 PolarHBondContact O-N 3.31Å; E224-K227 IonicContact OE1-NZ 2.63Å; E224-K227 PolarHBondContact OE1-NZ 3.48Å; E224-K227 IonicContact OE2-NZ 3.99Å; I225-K227 VanDerWaalsContact C-N 3.33Å; I225-K227 PolarHBondContact O-N 3.4Å; K227-R230 PolarHBondContact O-N 3.24Å; K227-V231 WeakPolarHBondContact O-CG2 3.47Å; K227-V231 PolarHBondContact O-N 3.25Å
228	E	91.6	Very high	87.7	Confident	70 Å²	70	48 Å²	48	33%	0.327	24%	0.24	S	C	.	.	H	α-helix	trans	-58.2	-50.9	178	-176	-174.9	-169.4	0	0	111.6	R184 E224 I225 R230 V231 E232	R184-E228 IonicContact CZ-OE1 3.48Å; R184-E228 IonicContact CZ-OE2 3.17Å; R184-E228 IonicContact NE-OE1 3.51Å; R184-E228 IonicContact NE-OE2 2.84Å; R184-E228 PolarHBondContact NE-OE2 3.3Å; R184-E228 IonicContact NH2-OE1 2.67Å; R184-E228 PolarHBondContact NH2-OE1 2.87Å; R184-E228 IonicContact NH2-OE2 2.65Å; R184-E228 PolarHBondContact NH2-OE2 3.41Å; E224-E228 PolarHBondContact O-N 3.44Å; I225-E228 WeakPolarHBondContact O-CB 3.05Å; I225-E228 PolarHBondContact O-N 2.91Å; E228-R230 VanDerWaalsContact C-N 3.3Å; E228-R230 PolarHBondContact O-N 3.02Å; E228-V231 PolarHBondContact O-N 3.01Å; E228-E232 PolarHBondContact O-N 3.36Å
229	V	89	Confident	88.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.9	-42.8	177.6	172.7	0	0	0	0	110.9	L187 L188 I191 L218 I225 Y233	L187-V229 HydrophobicContact CB-CG1 4.1Å; L187-V229 HydrophobicContact CB-CG2 4.36Å; L187-V229 HydrophobicContact CD1-CG1 4.12Å; L188-V229 HydrophobicContact CD2-CG2 4.32Å; I191-V229 HydrophobicContact CD1-CG1 3.8Å; L218-V229 HydrophobicContact CD1-CG2 4.27Å; I225-V229 HydrophobicContact CG2-CG2 4.47Å; I225-V229 WeakPolarHBondContact O-CG2 3.33Å; I225-V229 PolarHBondContact O-N 3.4Å; V229-Y233 VanDerWaalsContact O-CB 3.32Å; V229-Y233 WeakPolarHBondContact O-CB 3.34Å; V229-Y233 PolarHBondContact O-N 2.97Å
230	R	89.2	Confident	88.6	Confident	70 Å²	70	50.7 Å²	50.7	26%	0.264	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-48.4	175.6	176.8	175.6	173.9	148.4	-0.8	111.9	A226 K227 E228 Y233 I234 F370 L404	A226-R230 WeakPolarHBondContact O-CB 3.26Å; A226-R230 PolarHBondContact O-N 3.3Å; A226-R230 VanDerWaalsContact O-N 3.07Å; K227-R230 PolarHBondContact O-N 3.24Å; E228-R230 VanDerWaalsContact C-N 3.3Å; E228-R230 PolarHBondContact O-N 3.02Å; R230-Y233 WeakPolarHBondContact O-CB 3.43Å; R230-Y233 PolarHBondContact O-N 2.99Å; R230-I234 HydrophobicContact CG-CD1 3.85Å; R230-I234 WeakPolarHBondContact O-CD1 3.36Å; R230-I234 WeakPolarHBondContact O-CG1 3.47Å; R230-I234 PolarHBondContact O-N 3.12Å; R230-F370 HydrophobicContact CB-CE1 3.91Å; R230-F370 HydrophobicContact CB-CZ 4.41Å; R230-F370 HydrophobicContact CG-CE1 4.17Å; R230-F370 HydrophobicContact CG-CZ 4.46Å; R230-L404 HydrophobicContact CG-CD1 4.31Å
231	V	91.3	Very high	89.2	Confident	76 Å²	76	47.4 Å²	47.4	46%	0.461	22%	0.222	S	C	.	.	H	α-helix	trans	-64.2	-44.1	-179.8	169.7	0	0	0	0	111.2	K227 E228 Y233 I234 N235	K227-V231 WeakPolarHBondContact O-CG2 3.47Å; K227-V231 PolarHBondContact O-N 3.25Å; E228-V231 PolarHBondContact O-N 3.01Å; V231-Y233 VanDerWaalsContact C-N 3.33Å; V231-Y233 PolarHBondContact O-N 3.4Å; V231-I234 PolarHBondContact O-N 3.24Å; V231-N235 WeakPolarHBondContact CG1-ND2 3.48Å; V231-N235 WeakPolarHBondContact O-CB 3.28Å; V231-N235 VanDerWaalsContact O-CG 3.26Å; V231-N235 PolarHBondContact O-N 3.28Å; V231-N235 PolarHBondContact O-ND2 3.16Å
232	E	90.7	Very high	89.9	Confident	42 Å²	42	49.2 Å²	49.2	20%	0.196	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-36.1	177.1	-81.1	-58.1	111.4	0	0	112.5	L188 Y192 R195 E228 T236	L188-E232 HydrophobicContact CD2-CB 3.96Å; L188-E232 HydrophobicContact CD2-CG 4.07Å; Y192-E232 WeakPolarHBondContact CE1-OE2 3.21Å; Y192-E232 PolarHBondContact OH-OE2 3.19Å; R195-E232 IonicContact CZ-OE2 3.97Å; R195-E232 IonicContact NH2-OE2 2.94Å; R195-E232 PolarHBondContact NH2-OE2 3.38Å; E228-E232 PolarHBondContact O-N 3.36Å; E232-T236 WeakPolarHBondContact O-CB 3.13Å; E232-T236 PolarHBondContact O-N 3.12Å; E232-T236 PolarHBondContact O-OG1 3.32Å
233	Y	91.9	Very high	90.3	Very high	1 Å²	1	49.2 Å²	49.2	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-52.4	172.4	-178	-92.1	0	0	0	110.9	I191 L194 Q205 V229 R230 V231 N235 T236 M237 E362 F365 L366 F370	I191-Y233 HydrophobicContact CD1-CD2 4.45Å; I191-Y233 HydrophobicContact CG1-CD2 4.15Å; L194-Y233 HydrophobicContact CD1-CE2 4.5Å; Q205-Y233 PolarHBondContact NE2-OH 3.13Å; V229-Y233 VanDerWaalsContact O-CB 3.32Å; V229-Y233 WeakPolarHBondContact O-CB 3.34Å; V229-Y233 PolarHBondContact O-N 2.97Å; R230-Y233 WeakPolarHBondContact O-CB 3.43Å; R230-Y233 PolarHBondContact O-N 2.99Å; V231-Y233 VanDerWaalsContact C-N 3.33Å; V231-Y233 PolarHBondContact O-N 3.4Å; Y233-N235 PolarHBondContact O-N 2.83Å; Y233-T236 PolarHBondContact O-N 3.25Å; Y233-T236 VanDerWaalsContact O-N 3.16Å; Y233-M237 HydrophobicContact CD1-CG 4.25Å; Y233-M237 HydrophobicContact CD2-CG 4.36Å; Y233-M237 HydrophobicContact CE1-CB 4.33Å; Y233-M237 HydrophobicContact CE1-CG 3.71Å; Y233-M237 HydrophobicContact CE2-CE 3.84Å; Y233-M237 HydrophobicContact CE2-CG 3.84Å; Y233-M237 VanDerWaalsContact CZ-CG 3.45Å; Y233-M237 PolarHBondContact O-N 3.46Å; Y233-E362 WeakPolarHBondContact CE1-OE1 3.47Å; Y233-E362 PolarHBondContact OH-OE1 3.15Å; Y233-E362 PolarHBondContact OH-OE2 2.87Å; Y233-E362 VanDerWaalsContact OH-OE2 3.12Å; Y233-F365 HydrophobicContact CE1-CD1 4.38Å; Y233-F365 AromaticContact CE1-CE1 3.99Å; Y233-F365 HydrophobicContact CE1-CE1 3.99Å; Y233-F365 HydrophobicContact CE2-CD1 4.44Å; Y233-F365 AromaticContact CE2-CE1 3.54Å; Y233-F365 HydrophobicContact CE2-CE1 3.54Å; Y233-F365 AromaticContact CE2-CZ 3.97Å; Y233-F365 HydrophobicContact CE2-CZ 3.97Å; Y233-F365 AromaticContact CZ-CD1 3.76Å; Y233-F365 AromaticContact CZ-CE1 3.25Å; Y233-F365 WeakPolarHBondContact OH-CD1 3.12Å; Y233-F365 WeakPolarHBondContact OH-CE1 3.38Å; Y233-L366 HydrophobicContact CD1-CD2 4.39Å; Y233-L366 HydrophobicContact CE1-CD2 3.78Å; Y233-F370 AromaticContact CD1-CE2 3.99Å; Y233-F370 HydrophobicContact CD1-CE2 3.99Å; Y233-F370 HydrophobicContact CD1-CZ 4.16Å; Y233-F370 HydrophobicContact CE1-CE2 4.27Å; Y233-F370 HydrophobicContact CG-CE2 4.41Å; Y233-F370 HydrophobicContact CG-CZ 4.2Å
234	I	91.6	Very high	90.6	Very high	13 Å²	13	44.8 Å²	44.8	7%	0.067	22%	0.22	C	C	.	.	H	α-helix	trans	-57.2	-50.5	179.4	-66.5	161.9	0	0	0	110.6	R230 V231 T236 M237 S238 L404 Q407 V408	R230-I234 HydrophobicContact CG-CD1 3.85Å; R230-I234 WeakPolarHBondContact O-CD1 3.36Å; R230-I234 WeakPolarHBondContact O-CG1 3.47Å; R230-I234 PolarHBondContact O-N 3.12Å; V231-I234 PolarHBondContact O-N 3.24Å; I234-T236 PolarHBondContact O-N 3.05Å; I234-M237 PolarHBondContact O-N 2.87Å; I234-S238 WeakPolarHBondContact O-CB 3.21Å; I234-S238 PolarHBondContact O-N 3.45Å; I234-L404 HydrophobicContact CD1-CD1 3.43Å; I234-L404 VanDerWaalsContact CD1-CD1 3.43Å; I234-L404 HydrophobicContact CG1-CD1 3.69Å; I234-Q407 HydrophobicContact CG2-CB 3.96Å; I234-V408 HydrophobicContact CB-CG2 4.37Å; I234-V408 HydrophobicContact CG1-CG2 3.95Å; I234-V408 HydrophobicContact CG2-CG2 4.35Å
235	N	93.5	Very high	90.8	Very high	71 Å²	71	39 Å²	39	38%	0.38	19%	0.193	S	C	.	.	H	α-helix	trans	-60.1	-36.3	-179.8	-76.4	-26.2	0	0	0	112.4	V231 Y233 K239	V231-N235 WeakPolarHBondContact CG1-ND2 3.48Å; V231-N235 WeakPolarHBondContact O-CB 3.28Å; V231-N235 VanDerWaalsContact O-CG 3.26Å; V231-N235 PolarHBondContact O-N 3.28Å; V231-N235 PolarHBondContact O-ND2 3.16Å; Y233-N235 PolarHBondContact O-N 2.83Å; N235-K239 WeakPolarHBondContact O-CD 3.06Å; N235-K239 VanDerWaalsContact O-CG 3.3Å; N235-K239 WeakPolarHBondContact O-CG 3.11Å
236	T	91.5	Very high	91.1	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-74.2	-54.1	179.5	-61.2	0	0	0	0	111	I191 L194 R195 E232 Y233 I234 S238 K239 V240	I191-T236 HydrophobicContact CG2-CG2 4.1Å; I191-T236 WeakPolarHBondContact CG2-OG1 3.29Å; L194-T236 HydrophobicContact CB-CG2 4.37Å; R195-T236 HydrophobicContact CG-CG2 3.49Å; R195-T236 VanDerWaalsContact CG-CG2 3.49Å; R195-T236 PolarHBondContact NE-OG1 2.79Å; R195-T236 VanDerWaalsContact NE-OG1 3.1Å; R195-T236 PolarHBondContact NH2-OG1 3.01Å; E232-T236 WeakPolarHBondContact O-CB 3.13Å; E232-T236 PolarHBondContact O-N 3.12Å; E232-T236 PolarHBondContact O-OG1 3.32Å; Y233-T236 PolarHBondContact O-N 3.25Å; Y233-T236 VanDerWaalsContact O-N 3.16Å; I234-T236 PolarHBondContact O-N 3.05Å; T236-S238 VanDerWaalsContact C-N 3.35Å; T236-S238 PolarHBondContact O-N 3.27Å; T236-K239 PolarHBondContact O-N 3.41Å; T236-K239 VanDerWaalsContact O-N 3.16Å; T236-V240 HydrophobicContact CG2-CG2 4.38Å; T236-V240 WeakPolarHBondContact O-CG2 3.32Å; T236-V240 PolarHBondContact O-N 3.19Å
237	M	90.2	Very high	91.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-39.4	-178.4	-76.9	-56.6	165.7	0	0	112.7	L194 Q205 Y233 I234 K239 V240 Y241 V408	L194-M237 HydrophobicContact CB-CE 3.9Å; L194-M237 HydrophobicContact CD1-CE 3.21Å; L194-M237 HydrophobicContact CD2-CE 3.77Å; L194-M237 HydrophobicContact CG-CE 3.78Å; Q205-M237 HydrophobicContact CG-CE 3.95Å; Y233-M237 HydrophobicContact CD1-CG 4.25Å; Y233-M237 HydrophobicContact CD2-CG 4.36Å; Y233-M237 HydrophobicContact CE1-CB 4.33Å; Y233-M237 HydrophobicContact CE1-CG 3.71Å; Y233-M237 HydrophobicContact CE2-CE 3.84Å; Y233-M237 HydrophobicContact CE2-CG 3.84Å; Y233-M237 VanDerWaalsContact CZ-CG 3.45Å; Y233-M237 PolarHBondContact O-N 3.46Å; I234-M237 PolarHBondContact O-N 2.87Å; M237-K239 VanDerWaalsContact C-N 3.26Å; M237-K239 PolarHBondContact O-N 3.45Å; M237-V240 PolarHBondContact O-N 3.17Å; M237-V240 VanDerWaalsContact O-N 3.16Å; M237-Y241 HydrophobicContact CB-CD2 4.1Å; M237-Y241 HydrophobicContact CB-CE2 3.93Å; M237-Y241 HydrophobicContact CG-CE2 4.33Å; M237-Y241 WeakPolarHBondContact O-CB 3.36Å; M237-Y241 WeakPolarHBondContact O-CD2 3.29Å; M237-Y241 PolarHBondContact O-N 3.16Å; M237-Y241 HydrophobicContact SD-CE2 4.09Å; M237-V408 HydrophobicContact CB-CG1 3.7Å
238	S	92.6	Very high	91.6	Very high	7 Å²	7	40.6 Å²	40.6	5%	0.049	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-38.4	175.8	-166.1	0	0	0	0	112.1	I234 T236 Y242 V408 R411	I234-S238 WeakPolarHBondContact O-CB 3.21Å; I234-S238 PolarHBondContact O-N 3.45Å; T236-S238 VanDerWaalsContact C-N 3.35Å; T236-S238 PolarHBondContact O-N 3.27Å; S238-Y242 WeakPolarHBondContact O-CB 3.49Å; S238-Y242 PolarHBondContact O-N 3.03Å; S238-Y242 VanDerWaalsContact O-N 3.14Å; S238-V408 VanDerWaalsContact CA-O 3.28Å; S238-V408 WeakPolarHBondContact CA-O 3.3Å; S238-V408 VanDerWaalsContact CB-O 3.24Å; S238-V408 WeakPolarHBondContact CB-O 3.4Å; S238-V408 PolarHBondContact OG-O 3.34Å; S238-V408 VanDerWaalsContact OG-O 3.05Å; S238-R411 WeakPolarHBondContact OG-CD 3.39Å
239	K	92.4	Very high	91.4	Very high	117 Å²	117	37.2 Å²	37.2	51%	0.509	19%	0.191	S	C	.	.	H	α-helix	trans	-71.7	-42.2	174.7	-71.8	173.3	-173.8	173.7	0	112.3	N235 T236 M237 A243	N235-K239 WeakPolarHBondContact O-CD 3.06Å; N235-K239 VanDerWaalsContact O-CG 3.3Å; N235-K239 WeakPolarHBondContact O-CG 3.11Å; T236-K239 PolarHBondContact O-N 3.41Å; T236-K239 VanDerWaalsContact O-N 3.16Å; M237-K239 VanDerWaalsContact C-N 3.26Å; M237-K239 PolarHBondContact O-N 3.45Å; K239-A243 VanDerWaalsContact O-CB 3.28Å; K239-A243 WeakPolarHBondContact O-CB 3.49Å; K239-A243 PolarHBondContact O-N 3.28Å
240	V	90.6	Very high	91.4	Very high	27 Å²	27	39 Å²	39	16%	0.164	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-51.4	-179.5	171	0	0	0	0	110.8	Y201 T236 M237 Y242 A243 Y244	Y201-V240 HydrophobicContact CD1-CG1 3.66Å; Y201-V240 HydrophobicContact CE1-CG1 4.06Å; Y201-V240 HydrophobicContact CG-CG1 4.24Å; T236-V240 HydrophobicContact CG2-CG2 4.38Å; T236-V240 WeakPolarHBondContact O-CG2 3.32Å; T236-V240 PolarHBondContact O-N 3.19Å; M237-V240 PolarHBondContact O-N 3.17Å; M237-V240 VanDerWaalsContact O-N 3.16Å; V240-Y242 PolarHBondContact O-N 2.88Å; V240-A243 PolarHBondContact O-N 3.04Å; V240-Y244 WeakPolarHBondContact O-CB 3.45Å; V240-Y244 PolarHBondContact O-N 3.29Å
241	Y	92.3	Very high	91.4	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-63.2	-43.6	177.9	-69.3	-50.9	0	0	0	112	Y201 Q205 M237 A243 Y244 F245 T358 E362 V408 M409 S412	Y201-Y241 HydrophobicContact CD2-CE1 4.17Å; Y201-Y241 HydrophobicContact CE2-CD1 4.37Å; Y201-Y241 AromaticContact CE2-CE1 3.47Å; Y201-Y241 HydrophobicContact CE2-CE1 3.47Å; Y201-Y241 VanDerWaalsContact CE2-CE1 3.47Å; Y201-Y241 AromaticContact CZ-CE1 3.69Å; Q205-Y241 PolarHBondContact NE2-OH 2.97Å; M237-Y241 HydrophobicContact CB-CD2 4.1Å; M237-Y241 HydrophobicContact CB-CE2 3.93Å; M237-Y241 HydrophobicContact CG-CE2 4.33Å; M237-Y241 WeakPolarHBondContact O-CB 3.36Å; M237-Y241 WeakPolarHBondContact O-CD2 3.29Å; M237-Y241 PolarHBondContact O-N 3.16Å; M237-Y241 HydrophobicContact SD-CE2 4.09Å; Y241-A243 VanDerWaalsContact C-N 3.34Å; Y241-A243 PolarHBondContact O-N 2.94Å; Y241-Y244 PolarHBondContact O-N 2.77Å; Y241-F245 VanDerWaalsContact O-CD2 3.23Å; Y241-F245 WeakPolarHBondContact O-CD2 3.26Å; Y241-F245 PolarHBondContact O-N 3.43Å; Y241-T358 HydrophobicContact CD1-CG2 3.47Å; Y241-T358 VanDerWaalsContact CD1-CG2 3.47Å; Y241-T358 HydrophobicContact CE1-CG2 3.22Å; Y241-T358 HydrophobicContact CG-CG2 4.33Å; Y241-E362 HydrophobicContact CE2-CG 4.17Å; Y241-E362 PolarHBondContact OH-OE2 2.91Å; Y241-V408 HydrophobicContact CD2-CG1 3.91Å; Y241-V408 HydrophobicContact CE2-CG1 3.91Å; Y241-M409 HydrophobicContact CD2-SD 3.84Å; Y241-M409 HydrophobicContact CE2-SD 4.32Å; Y241-M409 HydrophobicContact CG-SD 4.13Å; Y241-S412 VanDerWaalsContact CB-OG 3.26Å; Y241-S412 WeakPolarHBondContact CB-OG 3.38Å
242	Y	93.7	Very high	91.2	Very high	58 Å²	58	36 Å²	36	23%	0.227	19%	0.191	C	C	.	.	H	α-helix	trans	-58.9	-46.2	176.5	172.7	-95.7	0	0	0	111.6	S238 V240 K246 R411 S412 W415	S238-Y242 WeakPolarHBondContact O-CB 3.49Å; S238-Y242 PolarHBondContact O-N 3.03Å; S238-Y242 VanDerWaalsContact O-N 3.14Å; V240-Y242 PolarHBondContact O-N 2.88Å; Y242-K246 HydrophobicContact CE1-CD 3.89Å; Y242-K246 WeakPolarHBondContact O-CB 3.33Å; Y242-K246 PolarHBondContact O-N 3.24Å; Y242-R411 HydrophobicContact CD2-CB 4.18Å; Y242-S412 PolarHBondContact N-OG 3.2Å; Y242-S412 VanDerWaalsContact N-OG 3.17Å; Y242-W415 HydrophobicContact CD2-CB 4.06Å; Y242-W415 HydrophobicContact CD2-CG 4.39Å; Y242-W415 HydrophobicContact CE2-CB 3.82Å; Y242-W415 AromaticContact CE2-CD1 3.74Å; Y242-W415 AromaticContact CE2-CG 3.86Å; Y242-W415 HydrophobicContact CE2-CG 3.86Å
243	A	91.6	Very high	91	Very high	55 Å²	55	36.3 Å²	36.3	46%	0.455	20%	0.196	S	C	.	.	H	α-helix	trans	-64.3	-41	177.9	0	0	0	0	0	111.9	K239 V240 Y241 A247	K239-A243 VanDerWaalsContact O-CB 3.28Å; K239-A243 WeakPolarHBondContact O-CB 3.49Å; K239-A243 PolarHBondContact O-N 3.28Å; V240-A243 PolarHBondContact O-N 3.04Å; Y241-A243 VanDerWaalsContact C-N 3.34Å; Y241-A243 PolarHBondContact O-N 2.94Å; A243-A247 VanDerWaalsContact O-CB 3.26Å; A243-A247 WeakPolarHBondContact O-CB 3.28Å; A243-A247 PolarHBondContact O-N 3.32Å
244	Y	90.9	Very high	90.6	Very high	74 Å²	74	43.7 Å²	43.7	29%	0.29	23%	0.229	S	C	.	.	H	α-helix	trans	-59.4	-56.8	175.8	172.1	-101	0	0	0	111.5	V240 Y241 K246 A247 Y248	V240-Y244 WeakPolarHBondContact O-CB 3.45Å; V240-Y244 PolarHBondContact O-N 3.29Å; Y241-Y244 PolarHBondContact O-N 2.77Å; Y244-K246 VanDerWaalsContact C-N 3.34Å; Y244-K246 PolarHBondContact O-N 3.2Å; Y244-A247 PolarHBondContact O-N 3.03Å; Y244-Y248 WeakPolarHBondContact O-CB 3.48Å; Y244-Y248 PolarHBondContact O-N 3.28Å
245	F	93.5	Very high	90.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-38.2	-178.2	-75.3	-66.6	0	0	0	112.2	Y241 Y248 G249 A354 L355 T358 M409 W415 I416	Y241-F245 VanDerWaalsContact O-CD2 3.23Å; Y241-F245 WeakPolarHBondContact O-CD2 3.26Å; Y241-F245 PolarHBondContact O-N 3.43Å; F245-Y248 PolarHBondContact O-N 3.28Å; F245-G249 PolarHBondContact O-N 3.49Å; F245-A354 HydrophobicContact CE1-CB 4.22Å; F245-L355 HydrophobicContact CE1-CB 4.24Å; F245-L355 HydrophobicContact CE2-CD1 4.33Å; F245-L355 HydrophobicContact CZ-CB 4.27Å; F245-L355 HydrophobicContact CZ-CD1 4.1Å; F245-T358 HydrophobicContact CE2-CG2 4.17Å; F245-T358 HydrophobicContact CZ-CG2 4.21Å; F245-M409 HydrophobicContact CE2-CE 4.41Å; F245-W415 HydrophobicContact CB-CE3 4.12Å; F245-W415 HydrophobicContact CB-CZ3 4.23Å; F245-W415 WeakPolarHBondContact O-CH2 3.44Å; F245-W415 WeakPolarHBondContact O-CZ3 3.29Å; F245-I416 HydrophobicContact CB-CD1 4.35Å; F245-I416 HydrophobicContact CB-CG1 4.32Å; F245-I416 HydrophobicContact CD1-CD1 3.77Å; F245-I416 HydrophobicContact CD1-CG1 4.41Å; F245-I416 HydrophobicContact CD2-CD1 4.11Å; F245-I416 HydrophobicContact CE1-CD1 4.08Å; F245-I416 HydrophobicContact CE2-CD1 4.4Å; F245-I416 HydrophobicContact CG-CD1 3.81Å; F245-I416 HydrophobicContact CG-CG1 4.31Å; F245-I416 HydrophobicContact CZ-CD1 4.4Å
246	K	93.2	Very high	89.8	Confident	105 Å²	105	41.4 Å²	41.4	46%	0.457	22%	0.216	S	C	.	.	H	α-helix	trans	-61.6	-46.6	175.6	-176.2	178.2	-178.5	178.8	0	112.2	Y242 Y244 G250 W415	Y242-K246 HydrophobicContact CE1-CD 3.89Å; Y242-K246 WeakPolarHBondContact O-CB 3.33Å; Y242-K246 PolarHBondContact O-N 3.24Å; Y244-K246 VanDerWaalsContact C-N 3.34Å; Y244-K246 PolarHBondContact O-N 3.2Å; K246-G250 PolarHBondContact O-N 3Å; K246-G250 VanDerWaalsContact O-N 3.09Å; K246-W415 HydrophobicContact CB-CD2 4.4Å; K246-W415 HydrophobicContact CB-CZ2 4.18Å; K246-W415 HydrophobicContact CG-CZ2 4.07Å
247	A	90.5	Very high	89.1	Confident	51 Å²	51	44.8 Å²	44.8	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-68.3	-39.2	177.4	0	0	0	0	0	111.7	A243 Y244 K251	A243-A247 VanDerWaalsContact O-CB 3.26Å; A243-A247 WeakPolarHBondContact O-CB 3.28Å; A243-A247 PolarHBondContact O-N 3.32Å; Y244-A247 PolarHBondContact O-N 3.03Å; A247-K251 VanDerWaalsContact O-CG 3.29Å; A247-K251 WeakPolarHBondContact O-CG 3.23Å; A247-K251 PolarHBondContact O-N 3.27Å; A247-K251 VanDerWaalsContact O-N 3.12Å
248	Y	91.4	Very high	88	Confident	12 Å²	12	49.7 Å²	49.7	5%	0.047	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-54.2	179.1	-173.6	-118.7	0	0	0	111.4	Y244 F245 G250 K251 L252 I330 P332 S350 I351 A354	Y244-Y248 WeakPolarHBondContact O-CB 3.48Å; Y244-Y248 PolarHBondContact O-N 3.28Å; F245-Y248 PolarHBondContact O-N 3.28Å; Y248-G250 VanDerWaalsContact C-N 3.34Å; Y248-G250 PolarHBondContact O-N 2.96Å; Y248-K251 PolarHBondContact O-N 3.33Å; Y248-K251 VanDerWaalsContact O-N 3.09Å; Y248-L252 HydrophobicContact CD1-CD1 3.88Å; Y248-L252 HydrophobicContact CD1-CG 4.41Å; Y248-L252 HydrophobicContact CE1-CD1 3.48Å; Y248-L252 VanDerWaalsContact CE1-CD1 3.48Å; Y248-L252 HydrophobicContact CE1-CD2 4.49Å; Y248-L252 HydrophobicContact CE1-CG 4.14Å; Y248-L252 HydrophobicContact CE2-CD2 4.27Å; Y248-L252 HydrophobicContact CE2-CG 4.39Å; Y248-L252 WeakPolarHBondContact O-CG 3.47Å; Y248-L252 PolarHBondContact O-N 2.88Å; Y248-I330 VanDerWaalsContact CE2-O 3.3Å; Y248-I330 WeakPolarHBondContact CE2-O 3.48Å; Y248-I330 PolarHBondContact OH-O 3.39Å; Y248-P332 HydrophobicContact CD2-CG 3.8Å; Y248-P332 HydrophobicContact CE2-CG 3.57Å; Y248-S350 PolarHBondContact OH-OG 3.16Å; Y248-I351 HydrophobicContact CD1-CG1 4.42Å; Y248-I351 HydrophobicContact CE1-CB 4.43Å; Y248-A354 HydrophobicContact CE1-CB 4.26Å
249	G	88.9	Confident	86.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-38.7	178.8	0	0	0	0	0	112.7	F245 K251 L252 T253	F245-G249 PolarHBondContact O-N 3.49Å; G249-K251 VanDerWaalsContact C-N 3.28Å; G249-K251 PolarHBondContact O-N 2.98Å; G249-L252 PolarHBondContact O-N 3.5Å; G249-L252 VanDerWaalsContact O-N 3.15Å; G249-T253 PolarHBondContact O-N 2.93Å; G249-T253 PolarHBondContact O-OG1 3.42Å
250	G	89	Confident	85	Confident	37 Å²	37	49.5 Å²	49.5	38%	0.381	27%	0.268	S	S	.	.	H	α-helix	trans	-62.2	-31.9	173.9	0	0	0	0	0	114	K246 Y248	K246-G250 PolarHBondContact O-N 3Å; K246-G250 VanDerWaalsContact O-N 3.09Å; Y248-G250 VanDerWaalsContact C-N 3.34Å; Y248-G250 PolarHBondContact O-N 2.96Å
251	K	88.5	Confident	83.3	Confident	80 Å²	80	57.1 Å²	57.1	35%	0.348	30%	0.295	S	S	.	.	H	α-helix	trans	-75.8	-38.1	172.4	-70.3	172.4	-176.4	177.1	0	111.8	A247 Y248 G249 T253 K254 P332 H333	A247-K251 VanDerWaalsContact O-CG 3.29Å; A247-K251 WeakPolarHBondContact O-CG 3.23Å; A247-K251 PolarHBondContact O-N 3.27Å; A247-K251 VanDerWaalsContact O-N 3.12Å; Y248-K251 PolarHBondContact O-N 3.33Å; Y248-K251 VanDerWaalsContact O-N 3.09Å; G249-K251 VanDerWaalsContact C-N 3.28Å; G249-K251 PolarHBondContact O-N 2.98Å; K251-T253 VanDerWaalsContact C-N 3.34Å; K251-T253 PolarHBondContact O-N 2.76Å; K251-K254 PolarHBondContact O-N 2.86Å; K251-P332 HydrophobicContact CB-CB 3.61Å; K251-P332 HydrophobicContact CB-CG 4.01Å; K251-P332 HydrophobicContact CD-CB 4.08Å; K251-P332 HydrophobicContact CD-CG 4.38Å; K251-P332 HydrophobicContact CG-CB 4.41Å; K251-H333 PolarHBondContact NZ-CE1 3.49Å; K251-H333 PolarHBondContact NZ-NE2 3.4Å
252	L	87.1	Confident	81.7	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-39.3	176.9	-69.9	-177.9	0	0	0	112.4	Y248 G249 K254 L255 Q256 I330 P332 L347 I351	Y248-L252 HydrophobicContact CD1-CD1 3.88Å; Y248-L252 HydrophobicContact CD1-CG 4.41Å; Y248-L252 HydrophobicContact CE1-CD1 3.48Å; Y248-L252 VanDerWaalsContact CE1-CD1 3.48Å; Y248-L252 HydrophobicContact CE1-CD2 4.49Å; Y248-L252 HydrophobicContact CE1-CG 4.14Å; Y248-L252 HydrophobicContact CE2-CD2 4.27Å; Y248-L252 HydrophobicContact CE2-CG 4.39Å; Y248-L252 WeakPolarHBondContact O-CG 3.47Å; Y248-L252 PolarHBondContact O-N 2.88Å; G249-L252 PolarHBondContact O-N 3.5Å; G249-L252 VanDerWaalsContact O-N 3.15Å; L252-K254 PolarHBondContact O-N 3.36Å; L252-K254 VanDerWaalsContact O-N 3.14Å; L252-L255 PolarHBondContact O-N 2.89Å; L252-Q256 PolarHBondContact O-N 3.35Å; L252-I330 HydrophobicContact CD2-CB 4.22Å; L252-I330 HydrophobicContact CD2-CG2 4.24Å; L252-P332 HydrophobicContact CD2-CG 4.32Å; L252-L347 HydrophobicContact CB-CD2 4.29Å; L252-L347 HydrophobicContact CD2-CD2 4.01Å; L252-I351 HydrophobicContact CD1-CB 4.08Å
253	T	85.3	Confident	80	Confident	49 Å²	49	62.3 Å²	62.3	30%	0.301	32%	0.319	S	S	.	.	H	α-helix	trans	-53.7	-33	174.9	-67.8	0	0	0	0	113.1	G249 K251 L255 F423	G249-T253 PolarHBondContact O-N 2.93Å; G249-T253 PolarHBondContact O-OG1 3.42Å; K251-T253 VanDerWaalsContact C-N 3.34Å; K251-T253 PolarHBondContact O-N 2.76Å; T253-L255 VanDerWaalsContact C-N 3.33Å; T253-L255 PolarHBondContact O-N 3.38Å; T253-F423 HydrophobicContact CG2-CE1 3.99Å; T253-F423 HydrophobicContact CG2-CE2 3.54Å; T253-F423 HydrophobicContact CG2-CZ 3.23Å; T253-F423 WeakPolarHBondContact OG1-CE1 3.25Å; T253-F423 VanDerWaalsContact OG1-CZ 3.29Å; T253-F423 WeakPolarHBondContact OG1-CZ 3.38Å
254	K	85.3	Confident	78.4	Confident	157 Å²	157	64.4 Å²	64.4	68%	0.683	32%	0.323	S	S	*	.	H	α-helix	trans	-75.3	-21.9	179.1	-60.9	-176.9	179.3	-173.4	0	113.5	K251 L252 K341	K251-K254 PolarHBondContact O-N 2.86Å; L252-K254 PolarHBondContact O-N 3.36Å; L252-K254 VanDerWaalsContact O-N 3.14Å; K254-K341 PolarHBondContact O-NZ 3.19Å
255	L	84.5	Confident	77	Confident	6 Å²	6	63.9 Å²	63.9	3%	0.031	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	0.2	-179	-61.6	174.1	0	0	0	112.7	L252 T253 I330 P332 A335 K341 Y342	L252-L255 PolarHBondContact O-N 2.89Å; T253-L255 VanDerWaalsContact C-N 3.33Å; T253-L255 PolarHBondContact O-N 3.38Å; L255-I330 HydrophobicContact CD1-CG2 4.11Å; L255-P332 HydrophobicContact CD1-CB 4.11Å; L255-A335 HydrophobicContact CD1-CB 3.6Å; L255-A335 HydrophobicContact CD2-CB 4.02Å; L255-A335 HydrophobicContact CG-CB 4.46Å; L255-K341 CarbonylContact O-C 3.58Å; L255-K341 WeakPolarHBondContact O-CA 3.45Å; L255-Y342 HydrophobicContact CB-CD2 4.3Å; L255-Y342 PolarHBondContact O-N 3.39Å
256	Q	83.7	Confident	75.8	Confident	30 Å²	30	64.7 Å²	64.7	14%	0.14	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-69.7	136.8	179.5	-168.3	-177.3	-23.6	0	0	111.3	L252 L347 F423 S427	L252-Q256 PolarHBondContact O-N 3.35Å; Q256-L347 HydrophobicContact CB-CD1 3.74Å; Q256-L347 HydrophobicContact CG-CD1 3.97Å; Q256-F423 VanDerWaalsContact OE1-CE1 3.32Å; Q256-S427 PolarHBondContact NE2-OG 3.15Å; Q256-S427 VanDerWaalsContact NE2-OG 3.16Å
257	L	76.8	Confident	74.1	Confident	72 Å²	72	59.7 Å²	59.7	38%	0.377	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-66.2	140	167.8	-173.9	66.5	0	0	0	110.4	T259 K341 Y342	L257-T259 PolarHBondContact O-N 2.98Å; L257-T259 PolarHBondContact O-OG1 3.36Å; L257-K341 HydrophobicContact CB-CB 4.39Å; L257-K341 HydrophobicContact CD1-CB 4Å; L257-Y342 PolarHBondContact N-O 2.78Å
258	D	66.3	Low	72.4	Confident	102 Å²	102	57.2 Å²	57.2	55%	0.545	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-74.1	117.5	178.3	-167	2.8	0	0	0	111.1	T260	D258-T260 WeakPolarHBondContact OD1-CG2 3.48Å; D258-T260 PolarHBondContact OD1-N 3.44Å; D258-T260 PolarHBondContact OD1-OG1 3.41Å
259	T	63.2	Low	71	Confident	29 Å²	29	59.8 Å²	59.8	18%	0.178	30%	0.299	C	S	.	.			trans	-107.9	10	-174.3	-43.6	0	0	0	0	111.6	L257 Y261 E262	L257-T259 PolarHBondContact O-N 2.98Å; L257-T259 PolarHBondContact O-OG1 3.36Å; T259-Y261 PolarHBondContact O-N 3.31Å; T259-Y261 VanDerWaalsContact O-N 3.12Å; T259-E262 HydrophobicContact CG2-CB 4.15Å; T259-E262 HydrophobicContact CG2-CG 3.91Å; T259-E262 WeakPolarHBondContact CG2-OE2 3.43Å; T259-E262 PolarHBondContact O-N 2.83Å
260	T	58.7	Low	69.3	Low	91 Å²	91	62.6 Å²	62.6	56%	0.558	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-58.5	-29.7	-174.2	49.7	0	0	0	0	114.4	D258 E262	D258-T260 WeakPolarHBondContact OD1-CG2 3.48Å; D258-T260 PolarHBondContact OD1-N 3.44Å; D258-T260 PolarHBondContact OD1-OG1 3.41Å; T260-E262 VanDerWaalsContact C-N 3.33Å; T260-E262 PolarHBondContact O-N 3.47Å
261	Y	55.2	Low	67.6	Low	187 Å²	187	64 Å²	64	73%	0.733	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-73.6	-21.1	-176.3	-55.2	-80.4	0	0	0	113.7	T259 K263	T259-Y261 PolarHBondContact O-N 3.31Å; T259-Y261 VanDerWaalsContact O-N 3.12Å; Y261-K263 VanDerWaalsContact C-N 3.27Å; Y261-K263 PolarHBondContact O-N 2.97Å
262	E	58.7	Low	65.4	Low	32 Å²	32	66.5 Å²	66.5	15%	0.15	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-76.9	-10.8	-175.1	-63.3	-179.6	-172.3	0	0	113.5	T259 T260 D264 D265 L309 H430	T259-E262 HydrophobicContact CG2-CB 4.15Å; T259-E262 HydrophobicContact CG2-CG 3.91Å; T259-E262 WeakPolarHBondContact CG2-OE2 3.43Å; T259-E262 PolarHBondContact O-N 2.83Å; T260-E262 VanDerWaalsContact C-N 3.33Å; T260-E262 PolarHBondContact O-N 3.47Å; E262-D264 PolarHBondContact O-N 3.37Å; E262-D265 PolarHBondContact O-N 2.92Å; E262-D265 VanDerWaalsContact O-N 3.17Å; E262-L309 HydrophobicContact CB-CD1 4.47Å; E262-H430 HydrophobicContact CB-CB 4.42Å
263	K	58.2	Low	63.2	Low	138 Å²	138	73 Å²	73	60%	0.6	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-59.2	-32.5	-179.6	-179.8	174.7	179.1	-173.5	0	112.8	Y261	Y261-K263 VanDerWaalsContact C-N 3.27Å; Y261-K263 PolarHBondContact O-N 2.97Å
264	D	56.9	Low	60.8	Low	99 Å²	99	81.4 Å²	81.4	53%	0.529	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-87.9	-8	-177.4	-79.5	-53.5	0	0	0	114.3	E262 L266 K269	E262-D264 PolarHBondContact O-N 3.37Å; D264-L266 PolarHBondContact O-N 3.18Å; D264-K269 WeakPolarHBondContact O-CD 3.06Å; D264-K269 IonicContact OD1-NZ 3.99Å; D264-K269 PolarHBondContact OD1-NZ 2.98Å
265	D	62.7	Low	58.1	Low	63 Å²	63	80.3 Å²	80.3	34%	0.337	39%	0.391	S	S	.	.			trans	-87.3	94.1	-177.6	-75.3	-25	0	0	0	111.2	E262 L309 R475	E262-D265 PolarHBondContact O-N 2.92Å; E262-D265 VanDerWaalsContact O-N 3.17Å; D265-L309 HydrophobicContact CB-CD2 3.26Å; D265-R475 PolarHBondContact O-NH2 2.65Å
266	L	68.9	Low	55.2	Low	16 Å²	16	86.1 Å²	86.1	8%	0.084	43%	0.432	C	S	.	.			trans	-112.2	151.8	171.7	-61.9	171	0	0	0	110.1	D264 G268 K269 V478 S482 R539	D264-L266 PolarHBondContact O-N 3.18Å; L266-G268 PolarHBondContact O-N 3.49Å; L266-G268 VanDerWaalsContact O-N 3.1Å; L266-K269 HydrophobicContact CD1-CD 4.43Å; L266-K269 PolarHBondContact O-N 2.83Å; L266-K269 VanDerWaalsContact O-N 3.13Å; L266-V478 HydrophobicContact CD2-CG1 3.67Å; L266-S482 WeakPolarHBondContact CB-OG 3.47Å; L266-R539 PolarHBondContact O-NH1 2.88Å
267	L	56.6	Low	52.5	Low	0 Å²	0	90 Å²	90	0%	0	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-36.3	178.1	-97.2	91.4	0	0	0	113.2	F310 H479 M483 I536 R539 L543 L607	L267-F310 HydrophobicContact CD1-CD1 3.67Å; L267-F310 HydrophobicContact CD1-CE1 3.37Å; L267-F310 HydrophobicContact CD1-CZ 4.28Å; L267-F310 HydrophobicContact CG-CD1 4.4Å; L267-F310 HydrophobicContact CG-CE1 4.12Å; L267-H479 HydrophobicContact CD1-CB 3.97Å; L267-M483 HydrophobicContact CB-CG 4.04Å; L267-M483 HydrophobicContact CB-SD 4.32Å; L267-M483 HydrophobicContact CD2-SD 3.94Å; L267-I536 WeakPolarHBondContact O-CD1 3.41Å; L267-R539 HydrophobicContact CG-CB 4.34Å; L267-R539 PolarHBondContact O-NH2 3.48Å; L267-L543 HydrophobicContact CD1-CD2 3.49Å; L267-L543 VanDerWaalsContact CD1-CD2 3.49Å; L267-L543 HydrophobicContact CD2-CD2 4.36Å; L267-L607 HydrophobicContact CD2-CD1 4.44Å
268	G	54.2	Low	50.1	Low	0 Å²	0	91.4 Å²	91.4	0%	0	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-12.3	-176.4	0	0	0	0	0	115.6	L266 S482 L487	L266-G268 PolarHBondContact O-N 3.49Å; L266-G268 VanDerWaalsContact O-N 3.1Å; G268-S482 WeakPolarHBondContact CA-OG 3.41Å; G268-S482 PolarHBondContact N-OG 2.92Å; G268-S482 VanDerWaalsContact N-OG 3.1Å; G268-L487 WeakPolarHBondContact O-CD1 3.41Å
269	K	62.6	Low	48.1	Very low	65 Å²	65	91.3 Å²	91.3	28%	0.283	49%	0.485	S	S	.	.	S	Bend	trans	-84.6	139.9	179.4	-85	-179.5	168.8	-177.8	0	111	D264 L266 Y486 R539	D264-K269 WeakPolarHBondContact O-CD 3.06Å; D264-K269 IonicContact OD1-NZ 3.99Å; D264-K269 PolarHBondContact OD1-NZ 2.98Å; L266-K269 HydrophobicContact CD1-CD 4.43Å; L266-K269 PolarHBondContact O-N 2.83Å; L266-K269 VanDerWaalsContact O-N 3.13Å; K269-Y486 HydrophobicContact CG-CD1 4.42Å; K269-R539 VanDerWaalsContact O-CZ 3.26Å; K269-R539 PolarHBondContact O-NH1 2.82Å; K269-R539 PolarHBondContact O-NH2 2.8Å
270	N	54.2	Low	46.4	Very low	60 Å²	60	96.9 Å²	96.9	32%	0.321	52%	0.52	S	S	.	.			trans	-78.8	136	174.3	-74.1	-34	0	0	0	110.5	D272	N270-D272 VanDerWaalsContact C-N 3.29Å; N270-D272 PolarHBondContact O-N 2.98Å
271	P	51.4	Low	44.9	Very low	67 Å²	67	97.3 Å²	97.3	44%	0.435	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-24	-177.1	24.5	-32	0	0	0	114.3
272	D	43.9	Very low	43.7	Very low	131 Å²	131	93.7 Å²	93.7	70%	0.701	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	8	-156.6	-61.8	-33.9	0	0	0	117.1	N270	N270-D272 VanDerWaalsContact C-N 3.29Å; N270-D272 PolarHBondContact O-N 2.98Å
273	K	40.1	Very low	42.2	Very low	140 Å²	140	99.7 Å²	99.7	61%	0.609	56%	0.561	S	S	*	*	S	Bend	trans	-83.7	-5.9	-179	-80.3	-172.4	178.9	177.9	0	115.8	D488	K273-D488 IonicContact NZ-OD2 3.46Å; K273-D488 PolarHBondContact NZ-OD2 3.25Å
274	Y	36	Very low	40.6	Very low	224 Å²	224	100 Å²	100	88%	0.878	57%	0.566	S	S	*	*	S	Bend	trans	-118.1	1.5	-179.3	-94.8	-79.4	0	0	0	117.2
275	N	26.5	Very low	39.1	Very low	135 Å²	135	103.3 Å²	103.3	72%	0.722	58%	0.576	S	S	*	*			trans	-117.5	64.5	176.2	-110.9	-8	0	0	0	111.8	S277	N275-S277 PolarHBondContact O-N 2.92Å
276	S	24.2	Very low	37.2	Very low	128 Å²	128	108.9 Å²	108.9	90%	0.895	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	28.4	-177.9	-163.8	0	0	0	0	114.7
277	S	27.7	Very low	35	Very low	111 Å²	111	111.6 Å²	111.6	78%	0.776	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.1	14.4	-178.5	68.6	0	0	0	0	116.3	N275	N275-S277 PolarHBondContact O-N 2.92Å
278	S	25.2	Very low	33.5	Very low	102 Å²	102	118 Å²	118	71%	0.713	66%	0.659	S	S	*	*	S	Bend	trans	-138.5	98.1	170.2	-171.6	0	0	0	0	111.5
279	S	24.7	Very low	32	Very low	99 Å²	99	123.5 Å²	123.5	69%	0.692	69%	0.693	S	S	*	*			trans	-63.6	126.7	178.1	-55.3	0	0	0	0	112.6	S281	S279-S281 PolarHBondContact O-N 3.05Å
280	T	27.8	Very low	30	Very low	146 Å²	146	127.7 Å²	127.7	90%	0.896	72%	0.718	S	S	*	*	S	Bend	trans	68.5	22.1	136.6	60.6	0	0	0	0	121.6
281	S	27.5	Very low	28.7	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	74%	0.739	S	S	*	*			trans	-113	-5	175.3	61.3	0	0	0	0	117.5	S279	S279-S281 PolarHBondContact O-N 3.05Å
282	S	29.3	Very low	27.5	Very low	111 Å²	111	133.3 Å²	133.3	78%	0.776	75%	0.753	S	S	*	*	S	Bend	trans	-98.6	-2.1	-172.6	59.4	0	0	0	0	116.7	M284	S282-M284 VanDerWaalsContact C-N 3.33Å; S282-M284 PolarHBondContact O-N 3.17Å
283	L	27.6	Very low	26.5	Very low	159 Å²	159	134.2 Å²	134.2	83%	0.832	76%	0.758	S	S	*	*	S	Bend	trans	-88.4	9.5	-177.1	-70.9	173.7	0	0	0	114.8
284	M	25.1	Very low	25.6	Very low	143 Å²	143	134.8 Å²	134.8	70%	0.704	77%	0.768	S	S	*	*	S	Bend	trans	-129.3	117.3	-178.2	-66.1	-67.5	-107.3	0	0	110.2	S282	S282-M284 VanDerWaalsContact C-N 3.33Å; S282-M284 PolarHBondContact O-N 3.17Å
285	F	24.7	Very low	25.1	Very low	169 Å²	169	130 Å²	130	74%	0.741	77%	0.767	S	S	*	*			trans	67.6	81.2	165.3	-72.2	-98.7	0	0	0	118.2	S287	F285-S287 VanDerWaalsContact C-N 3.3Å
286	N	22.9	Very low	25	Very low	180 Å²	180	128.6 Å²	128.6	96%	0.963	76%	0.764	S	S	*	*			trans	-97.9	69.5	135.6	-108	22.2	0	0	0	107.2
287	S	22.5	Very low	25.1	Very low	74 Å²	74	129.2 Å²	129.2	52%	0.517	76%	0.762	S	S	.	*			trans	-76.9	135.4	168.2	-179.2	0	0	0	0	108.1	F285 T289	F285-S287 VanDerWaalsContact C-N 3.3Å; S287-T289 PolarHBondContact O-N 3.14Å
288	I	25.1	Very low	24.9	Very low	133 Å²	133	128.5 Å²	128.5	68%	0.682	76%	0.757	S	S	*	*			trans	-38.2	99.6	169.2	-59.8	156.4	0	0	0	109.6
289	T	23.1	Very low	25.2	Very low	117 Å²	117	129.3 Å²	129.3	72%	0.718	76%	0.757	S	S	*	*			trans	-106	98.5	162.4	54.6	0	0	0	0	107	S287 V291	S287-T289 PolarHBondContact O-N 3.14Å; T289-V291 VanDerWaalsContact C-N 3.35Å; T289-V291 PolarHBondContact O-N 3.5Å
290	N	21.1	Very low	25.1	Very low	152 Å²	152	129.6 Å²	129.6	81%	0.813	76%	0.759	S	S	*	*			trans	-53.5	97.7	161.6	-83	-5.5	0	0	0	108.5
291	V	26.1	Very low	25.1	Very low	125 Å²	125	127.8 Å²	127.8	76%	0.758	75%	0.753	S	S	*	*			trans	-92.9	106.2	167.6	179.8	0	0	0	0	107.5	T289	T289-V291 VanDerWaalsContact C-N 3.35Å; T289-V291 PolarHBondContact O-N 3.5Å
292	T	25.4	Very low	25	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	76%	0.758	S	S	*	*			trans	-41.2	130.7	166.2	45.3	0	0	0	0	113.3	N294	T292-N294 PolarHBondContact O-N 2.85Å
293	N	23	Very low	24.9	Very low	150 Å²	150	129.4 Å²	129.4	80%	0.802	75%	0.752	S	S	*	*			trans	3.8	108	155.6	-72	5	0	0	0	116.3
294	N	22.3	Very low	24.9	Very low	152 Å²	152	125.1 Å²	125.1	81%	0.813	75%	0.746	S	S	*	*			trans	-141.5	102.7	147	-98.5	-16.5	0	0	0	109.7	T292 T296	T292-N294 PolarHBondContact O-N 2.85Å; N294-T296 PolarHBondContact O-N 3.16Å
295	S	24.5	Very low	25.4	Very low	124 Å²	124	124.2 Å²	124.2	87%	0.867	75%	0.749	S	S	*	*			trans	-75.7	62.8	174.9	-50.1	0	0	0	0	110.6
296	T	24.4	Very low	26.1	Very low	106 Å²	106	126.1 Å²	126.1	65%	0.65	75%	0.751	S	S	*	*	S	Bend	trans	-145.1	129.6	170.5	46	0	0	0	0	110.6	N294 S298	N294-T296 PolarHBondContact O-N 3.16Å; T296-S298 PolarHBondContact O-N 3.28Å
297	V	27.6	Very low	27.3	Very low	140 Å²	140	119.6 Å²	119.6	85%	0.848	72%	0.718	S	S	*	*			trans	-62	95.1	-175.6	178.8	0	0	0	0	110.1
298	S	23.1	Very low	28.8	Very low	97 Å²	97	117.3 Å²	117.3	68%	0.678	71%	0.706	S	S	*	*			trans	-126.2	91.3	164.6	57.7	0	0	0	0	109.2	T296 S300	T296-S298 PolarHBondContact O-N 3.28Å; S298-S300 VanDerWaalsContact C-N 3.34Å; S298-S300 PolarHBondContact O-N 3.02Å
299	V	30.5	Very low	30.5	Very low	118 Å²	118	111.9 Å²	111.9	72%	0.715	68%	0.679	S	S	*	*			trans	-77.1	90.5	172	178.8	0	0	0	0	107	S301	V299-S301 PolarHBondContact O-N 3.4Å
300	S	24.7	Very low	32.4	Very low	105 Å²	105	107.1 Å²	107.1	73%	0.734	65%	0.648	S	S	*	*			trans	-60	117.7	169.5	-66.3	0	0	0	0	109.5	S298 N302	S298-S300 VanDerWaalsContact C-N 3.34Å; S298-S300 PolarHBondContact O-N 3.02Å; S300-N302 VanDerWaalsContact C-N 3.32Å; S300-N302 PolarHBondContact O-N 3.21Å
301	S	27.6	Very low	34.4	Very low	108 Å²	108	100.6 Å²	100.6	76%	0.755	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	7.4	-168.5	57.8	0	0	0	0	116	V299	V299-S301 PolarHBondContact O-N 3.4Å
302	N	25.3	Very low	36.1	Very low	152 Å²	152	95.2 Å²	95.2	81%	0.813	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.1	18.2	-160	-95.7	52	0	0	0	117.6	S300	S300-N302 VanDerWaalsContact C-N 3.32Å; S300-N302 PolarHBondContact O-N 3.21Å
303	S	27.2	Very low	38.1	Very low	93 Å²	93	93.9 Å²	93.9	65%	0.65	58%	0.579	S	S	*	*	S	Bend	trans	-146.2	122	162.9	-170.4	0	0	0	0	106.8	T305	S303-T305 PolarHBondContact O-N 3.25Å
304	G	27.4	Very low	40.1	Very low	69 Å²	69	91.4 Å²	91.4	71%	0.711	57%	0.566	S	S	*	*			trans	-60.9	84.1	165.7	0	0	0	0	0	107.6	R306	G304-R306 PolarHBondContact O-N 2.98Å
305	T	34.4	Very low	42.5	Very low	125 Å²	125	84.9 Å²	84.9	77%	0.767	53%	0.53	S	S	*	.			trans	-56.7	88.3	149.8	26.1	0	0	0	0	103.5	S303 V307	S303-T305 PolarHBondContact O-N 3.25Å; T305-V307 VanDerWaalsContact C-N 3.3Å; T305-V307 PolarHBondContact O-N 3.46Å
306	R	40.6	Very low	44.5	Very low	208 Å²	208	79 Å²	79	79%	0.785	49%	0.489	S	S	*	.			trans	-47.3	108.1	171.6	-56.4	-174.8	-175	179.8	0.8	103.1	G304 G308	G304-R306 PolarHBondContact O-N 2.98Å; R306-G308 PolarHBondContact O-N 3.23Å
307	V	48.2	Very low	46.7	Very low	43 Å²	43	76.8 Å²	76.8	26%	0.261	47%	0.473	S	S	.	.			trans	-47.9	123	176	175.6	0	0	0	0	103.6	T305 L309 R315	T305-V307 VanDerWaalsContact C-N 3.3Å; T305-V307 PolarHBondContact O-N 3.46Å; V307-L309 VanDerWaalsContact C-N 3.29Å; V307-L309 PolarHBondContact O-N 2.9Å; V307-R315 HydrophobicContact CG1-CG 4.4Å
308	G	52.4	Low	48.6	Very low	27 Å²	27	76.7 Å²	76.7	28%	0.278	46%	0.457	S	S	.	.			trans	-51.7	99.8	-174.1	0	0	0	0	0	108.7	R306 F310 G311 R315	R306-G308 PolarHBondContact O-N 3.23Å; G308-F310 VanDerWaalsContact C-N 3.25Å; G308-F310 PolarHBondContact O-N 2.96Å; G308-G311 CarbonylContact C-O 3.45Å; G308-G311 WeakPolarHBondContact CA-O 3.4Å; G308-R315 PolarHBondContact O-NH1 2.94Å
309	L	62.1	Low	50.8	Low	19 Å²	19	72 Å²	72	10%	0.099	43%	0.425	C	S	.	.	S	Bend	trans	-74.2	-31.4	-171.6	-176.7	66.6	0	0	0	109.5	E262 D265 V307 D431 I433	E262-L309 HydrophobicContact CB-CD1 4.47Å; D265-L309 HydrophobicContact CB-CD2 3.26Å; V307-L309 VanDerWaalsContact C-N 3.29Å; V307-L309 PolarHBondContact O-N 2.9Å; L309-D431 HydrophobicContact CD1-CB 3.93Å; L309-I433 WeakPolarHBondContact O-CD1 3.48Å
310	F	63.6	Low	52.7	Low	17 Å²	17	67.5 Å²	67.5	8%	0.075	40%	0.396	C	S	.	.	S	Bend	trans	-104.3	-18.6	174	-53.2	-64.2	0	0	0	112.4	L267 G308 I433 H479 R539 E542 L543 S546	L267-F310 HydrophobicContact CD1-CD1 3.67Å; L267-F310 HydrophobicContact CD1-CE1 3.37Å; L267-F310 HydrophobicContact CD1-CZ 4.28Å; L267-F310 HydrophobicContact CG-CD1 4.4Å; L267-F310 HydrophobicContact CG-CE1 4.12Å; G308-F310 VanDerWaalsContact C-N 3.25Å; G308-F310 PolarHBondContact O-N 2.96Å; F310-I433 WeakPolarHBondContact O-CD1 3.48Å; F310-H479 AromaticContact CE1-CE1 3.92Å; F310-R539 HydrophobicContact CD2-CB 4.09Å; F310-R539 HydrophobicContact CD2-CG 3.71Å; F310-R539 HydrophobicContact CE2-CB 4.47Å; F310-R539 VanDerWaalsContact CE2-CD 3.48Å; F310-R539 HydrophobicContact CE2-CG 3.98Å; F310-R539 HydrophobicContact CG-CB 4.29Å; F310-R539 HydrophobicContact CG-CG 4.38Å; F310-E542 HydrophobicContact CB-CB 4.11Å; F310-E542 CarbonylContact O-C 3.57Å; F310-L543 HydrophobicContact CB-CB 4.35Å; F310-L543 HydrophobicContact CD1-CB 4.42Å; F310-L543 VanDerWaalsContact O-CA 3.27Å; F310-L543 WeakPolarHBondContact O-CA 3.48Å; F310-L543 PolarHBondContact O-N 3.42Å; F310-L543 VanDerWaalsContact O-N 3.11Å; F310-S546 PolarHBondContact O-OG 3.32Å
311	G	62.5	Low	54.9	Low	15 Å²	15	64.1 Å²	64.1	16%	0.155	37%	0.373	C	S	.	.			trans	-109.2	130.8	-176.9	0	0	0	0	0	112.2	G308 S313	G308-G311 CarbonylContact C-O 3.45Å; G308-G311 WeakPolarHBondContact CA-O 3.4Å; G311-S313 PolarHBondContact O-N 2.9Å
312	L	61.3	Low	56.8	Low	12 Å²	12	65.7 Å²	65.7	6%	0.063	37%	0.366	C	S	.	.			trans	-62.5	-43.9	-179	-179.1	52.5	0	0	0	113.8	R315 A316 I433 I437 S546 I550	L312-R315 HydrophobicContact CD1-CB 4.27Å; L312-R315 VanDerWaalsContact O-CB 3.26Å; L312-R315 WeakPolarHBondContact O-CB 3.48Å; L312-R315 VanDerWaalsContact O-CG 3.23Å; L312-R315 WeakPolarHBondContact O-CG 3.1Å; L312-R315 PolarHBondContact O-N 2.95Å; L312-A316 HydrophobicContact CD1-CB 3.66Å; L312-A316 HydrophobicContact CD2-CB 3.81Å; L312-A316 HydrophobicContact CG-CB 3.95Å; L312-I433 HydrophobicContact CD1-CG2 3.85Å; L312-I437 HydrophobicContact CD1-CD1 3.87Å; L312-I437 HydrophobicContact CD1-CG1 4.35Å; L312-S546 PolarHBondContact N-OG 2.75Å; L312-I550 HydrophobicContact CD1-CD1 3.21Å; L312-I550 HydrophobicContact CD1-CG1 4.36Å; L312-I550 HydrophobicContact CD2-CD1 3.43Å; L312-I550 VanDerWaalsContact CD2-CD1 3.43Å; L312-I550 HydrophobicContact CD2-CG1 3.66Å; L312-I550 HydrophobicContact CG-CD1 3.88Å
313	S	67.3	Low	58.9	Low	91 Å²	91	62.3 Å²	62.3	64%	0.636	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	-142.4	-174.2	-174.9	0	0	0	0	111.1	G311 R315	G311-S313 PolarHBondContact O-N 2.9Å; S313-R315 PolarHBondContact O-N 2.87Å
314	D	65	Low	61.3	Low	99 Å²	99	60.6 Å²	60.6	53%	0.529	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	8.5	-179.1	-62.1	-31.3	0	0	0	113.5	L317 R318	D314-L317 PolarHBondContact O-N 2.99Å; D314-R318 WeakPolarHBondContact O-CB 3.31Å; D314-R318 PolarHBondContact O-N 3.34Å
315	R	73.7	Confident	63.7	Low	14 Å²	14	57.9 Å²	57.9	5%	0.053	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-44.8	-174.8	-60.5	175.6	64.1	-167.5	-2.3	111.7	V307 G308 L312 S313 E345 D431 I437	V307-R315 HydrophobicContact CG1-CG 4.4Å; G308-R315 PolarHBondContact O-NH1 2.94Å; L312-R315 HydrophobicContact CD1-CB 4.27Å; L312-R315 VanDerWaalsContact O-CB 3.26Å; L312-R315 WeakPolarHBondContact O-CB 3.48Å; L312-R315 VanDerWaalsContact O-CG 3.23Å; L312-R315 WeakPolarHBondContact O-CG 3.1Å; L312-R315 PolarHBondContact O-N 2.95Å; S313-R315 PolarHBondContact O-N 2.87Å; R315-E345 IonicContact CZ-OE1 2.65Å; R315-E345 IonicContact NE-OE1 3.02Å; R315-E345 PolarHBondContact NE-OE1 3.36Å; R315-E345 VanDerWaalsContact NE-OE1 3.1Å; R315-E345 IonicContact NH2-OE1 3.63Å; R315-E345 PolarHBondContact NH2-OE1 2.91Å; R315-E345 VanDerWaalsContact NH2-OE1 3.15Å; R315-E345 IonicContact NH2-OE2 3.31Å; R315-E345 PolarHBondContact NH2-OE2 2.95Å; R315-D431 IonicContact CZ-OD2 3.4Å; R315-D431 IonicContact NH1-OD1 2.75Å; R315-D431 IonicContact NH1-OD2 3.34Å; R315-D431 PolarHBondContact NH1-OD2 3.11Å; R315-D431 IonicContact NH2-OD2 2.75Å; R315-D431 PolarHBondContact NH2-OD2 2.98Å; R315-I437 HydrophobicContact CB-CD1 3.79Å
316	A	66.1	Low	65.8	Low	1 Å²	1	55.9 Å²	55.9	1%	0.008	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-48.2	173.7	0	0	0	0	0	111.3	L312 R318 V319 L320 I550	L312-A316 HydrophobicContact CD1-CB 3.66Å; L312-A316 HydrophobicContact CD2-CB 3.81Å; L312-A316 HydrophobicContact CG-CB 3.95Å; A316-R318 VanDerWaalsContact C-N 3.27Å; A316-R318 PolarHBondContact O-N 3.25Å; A316-V319 PolarHBondContact O-N 2.68Å; A316-V319 VanDerWaalsContact O-N 3.12Å; A316-L320 HydrophobicContact CB-CD1 3.87Å; A316-L320 VanDerWaalsContact O-CB 3.29Å; A316-L320 WeakPolarHBondContact O-CB 3.49Å; A316-L320 PolarHBondContact O-N 3.08Å; A316-I550 HydrophobicContact CB-CD1 4.18Å
317	L	70	Confident	67.8	Low	59 Å²	59	48.3 Å²	48.3	31%	0.309	27%	0.268	S	S	.	.	H	α-helix	trans	-55	-42.9	-178.5	-82.3	168	0	0	0	112.5	D314 V319 S321 F560	D314-L317 PolarHBondContact O-N 2.99Å; L317-V319 PolarHBondContact O-N 3.45Å; L317-V319 VanDerWaalsContact O-N 3.09Å; L317-S321 WeakPolarHBondContact O-CB 3.42Å; L317-F560 HydrophobicContact CD1-CE1 3.98Å; L317-F560 HydrophobicContact CD1-CZ 4.03Å; L317-F560 HydrophobicContact CD2-CD1 3.69Å; L317-F560 HydrophobicContact CD2-CD2 3.28Å; L317-F560 HydrophobicContact CD2-CE1 3.55Å; L317-F560 HydrophobicContact CD2-CE2 3.14Å; L317-F560 HydrophobicContact CD2-CG 3.57Å; L317-F560 HydrophobicContact CD2-CZ 3.3Å; L317-F560 HydrophobicContact CG-CD1 4.38Å; L317-F560 HydrophobicContact CG-CD2 4.24Å; L317-F560 HydrophobicContact CG-CE1 3.74Å; L317-F560 HydrophobicContact CG-CE2 3.59Å; L317-F560 HydrophobicContact CG-CZ 3.32Å
318	R	67.3	Low	69.4	Low	138 Å²	138	50.6 Å²	50.6	52%	0.521	29%	0.291	S	S	.	.	H	α-helix	trans	-58.9	-24.6	-178.4	-171	-179.5	-61.8	178.2	1.4	113.8	D314 A316 N324 V346	D314-R318 WeakPolarHBondContact O-CB 3.31Å; D314-R318 PolarHBondContact O-N 3.34Å; A316-R318 VanDerWaalsContact C-N 3.27Å; A316-R318 PolarHBondContact O-N 3.25Å; R318-N324 WeakPolarHBondContact O-CB 3.17Å; R318-V346 HydrophobicContact CG-CG2 4.48Å
319	V	70.5	Confident	71	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-127.4	-34	-167.6	-151.8	0	0	0	0	113.5	A316 L317 E345 V346 R349 L441	A316-V319 PolarHBondContact O-N 2.68Å; A316-V319 VanDerWaalsContact O-N 3.12Å; L317-V319 PolarHBondContact O-N 3.45Å; L317-V319 VanDerWaalsContact O-N 3.09Å; V319-E345 HydrophobicContact CG2-CB 4.47Å; V319-E345 HydrophobicContact CG2-CG 3.94Å; V319-V346 HydrophobicContact CG2-CG2 4.03Å; V319-R349 HydrophobicContact CG1-CB 3.39Å; V319-R349 VanDerWaalsContact CG1-CD 3.41Å; V319-R349 HydrophobicContact CG1-CG 3.54Å; V319-L441 HydrophobicContact CB-CD1 4.33Å; V319-L441 HydrophobicContact CB-CD2 4Å; V319-L441 HydrophobicContact CG1-CD1 3.57Å; V319-L441 HydrophobicContact CG1-CD2 3.41Å; V319-L441 VanDerWaalsContact CG1-CD2 3.41Å; V319-L441 HydrophobicContact CG1-CG 4.08Å; V319-L441 WeakPolarHBondContact O-CD2 3.47Å
320	L	69.4	Low	72.1	Confident	23 Å²	23	51.4 Å²	51.4	12%	0.12	29%	0.289	C	S	.	.	H	α-helix	trans	-94.2	-20	-173.1	-64.9	172.3	0	0	0	114.1	A316 I437 Q440 L441 L559	A316-L320 HydrophobicContact CB-CD1 3.87Å; A316-L320 VanDerWaalsContact O-CB 3.29Å; A316-L320 WeakPolarHBondContact O-CB 3.49Å; A316-L320 PolarHBondContact O-N 3.08Å; L320-I437 HydrophobicContact CD1-CG2 4.46Å; L320-I437 HydrophobicContact CG-CG2 4.47Å; L320-Q440 HydrophobicContact CD1-CB 4.17Å; L320-Q440 HydrophobicContact CD2-CB 3.87Å; L320-L441 HydrophobicContact CD2-CB 4.44Å; L320-L441 HydrophobicContact CD2-CD2 3.6Å; L320-L441 HydrophobicContact CD2-CG 3.72Å; L320-L441 HydrophobicContact CG-CD2 4.37Å; L320-L559 HydrophobicContact CD1-CD1 4.38Å
321	S	71.5	Confident	73	Confident	34 Å²	34	55.9 Å²	55.9	24%	0.238	31%	0.312	C	S	.	.	S	Bend	trans	-57.5	142.5	174.7	163.9	0	0	0	0	110.2	L317 S323 N324 L325	L317-S321 WeakPolarHBondContact O-CB 3.42Å; S321-S323 VanDerWaalsContact C-N 3.3Å; S321-S323 PolarHBondContact O-N 2.83Å; S321-S323 PolarHBondContact OG-OG 3.32Å; S321-N324 VanDerWaalsContact CB-OD1 3.31Å; S321-N324 WeakPolarHBondContact CB-OD1 3.27Å; S321-N324 CarbonylContact O-C 3.08Å; S321-N324 WeakPolarHBondContact O-CA 3.34Å; S321-N324 PolarHBondContact O-N 3.33Å; S321-N324 PolarHBondContact OG-OD1 3.38Å; S321-L325 WeakPolarHBondContact O-CB 3.44Å; S321-L325 PolarHBondContact O-N 2.84Å
322	K	67.3	Low	73.8	Confident	141 Å²	141	55.7 Å²	55.7	61%	0.613	31%	0.309	S	S	*	.	H	α-helix	trans	-55.8	-43.9	-175.7	-174.1	171.7	-177.3	167.3	0	112.1	N324 L325 E326	K322-N324 VanDerWaalsContact C-N 3.33Å; K322-N324 PolarHBondContact O-N 3.47Å; K322-L325 PolarHBondContact O-N 3.43Å; K322-E326 PolarHBondContact O-N 3.5Å
323	S	69.4	Low	74.5	Confident	81 Å²	81	60.9 Å²	60.9	57%	0.566	33%	0.332	S	S	*	.	H	α-helix	trans	-64.9	-37.7	175.3	57.5	0	0	0	0	112.2	S321 S327	S321-S323 VanDerWaalsContact C-N 3.3Å; S321-S323 PolarHBondContact O-N 2.83Å; S321-S323 PolarHBondContact OG-OG 3.32Å; S323-S327 PolarHBondContact O-N 3.19Å; S323-S327 VanDerWaalsContact O-N 3.15Å; S323-S327 PolarHBondContact O-OG 3Å
324	N	77.6	Confident	75.2	Confident	56 Å²	56	60.6 Å²	60.6	30%	0.299	33%	0.326	S	S	.	.	H	α-helix	trans	-77.5	-23.5	178.6	-67.6	89.3	0	0	0	113.7	R318 S321 K322 S327 R349	R318-N324 WeakPolarHBondContact O-CB 3.17Å; S321-N324 VanDerWaalsContact CB-OD1 3.31Å; S321-N324 WeakPolarHBondContact CB-OD1 3.27Å; S321-N324 CarbonylContact O-C 3.08Å; S321-N324 WeakPolarHBondContact O-CA 3.34Å; S321-N324 PolarHBondContact O-N 3.33Å; S321-N324 PolarHBondContact OG-OD1 3.38Å; K322-N324 VanDerWaalsContact C-N 3.33Å; K322-N324 PolarHBondContact O-N 3.47Å; N324-S327 WeakPolarHBondContact CA-OG 3.4Å; N324-S327 WeakPolarHBondContact O-CB 3.47Å; N324-R349 PolarHBondContact O-NH1 3.31Å
325	L	77.8	Confident	75.9	Confident	13 Å²	13	56.1 Å²	56.1	7%	0.068	30%	0.304	C	S	.	.	H	α-helix	trans	-75.7	-33.9	176	-175.8	70.4	0	0	0	111.3	S321 K322 R349 L441 A444 L445 L448	S321-L325 WeakPolarHBondContact O-CB 3.44Å; S321-L325 PolarHBondContact O-N 2.84Å; K322-L325 PolarHBondContact O-N 3.43Å; L325-R349 PolarHBondContact O-NH1 3.12Å; L325-L441 HydrophobicContact CD1-CD2 3.97Å; L325-A444 HydrophobicContact CD1-CB 4.09Å; L325-A444 HydrophobicContact CD2-CB 3.69Å; L325-L445 HydrophobicContact CD1-CD2 4.03Å; L325-L445 HydrophobicContact CD1-CG 4.29Å; L325-L445 HydrophobicContact CG-CD2 4.48Å; L325-L448 HydrophobicContact CD2-CD2 4.46Å
326	E	79.1	Confident	76.2	Confident	82 Å²	82	58 Å²	58	38%	0.383	32%	0.319	S	S	.	.	S	Bend	trans	-94.6	-2.4	177.8	-65.8	-173.3	-173.1	0	0	114	K322 Y353 L448	K322-E326 PolarHBondContact O-N 3.5Å; E326-Y353 PolarHBondContact O-OH 3.26Å; E326-L448 HydrophobicContact CG-CD2 4.02Å; E326-L448 WeakPolarHBondContact OE1-CD1 3.42Å
327	S	81.7	Confident	76.8	Confident	49 Å²	49	64.5 Å²	64.5	34%	0.343	35%	0.354	S	S	.	.	S	Bend	trans	-51.8	159.9	176.6	-74	0	0	0	0	112.5	S323 N324 R349	S323-S327 PolarHBondContact O-N 3.19Å; S323-S327 VanDerWaalsContact O-N 3.15Å; S323-S327 PolarHBondContact O-OG 3Å; N324-S327 WeakPolarHBondContact CA-OG 3.4Å; N324-S327 WeakPolarHBondContact O-CB 3.47Å; S327-R349 PolarHBondContact O-NH1 3.14Å; S327-R349 PolarHBondContact O-NH2 2.81Å
328	A	81.6	Confident	77.5	Confident	91 Å²	91	66.7 Å²	66.7	75%	0.752	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-56.7	143.6	180	0	0	0	0	0	112.2	R349	A328-R349 PolarHBondContact O-NH2 3.32Å
329	I	86.7	Confident	78	Confident	45 Å²	45	66.6 Å²	66.6	23%	0.231	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-65.6	150.4	172.2	62.9	169.5	0	0	0	109.9	L331 Y353 A354	I329-L331 PolarHBondContact O-N 3.14Å; I329-Y353 HydrophobicContact CG2-CD1 3.75Å; I329-A354 HydrophobicContact CD1-CB 4.29Å; I329-A354 HydrophobicContact CG2-CB 4.08Å
330	I	85	Confident	78.6	Confident	19 Å²	19	67.4 Å²	67.4	10%	0.097	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-62	123.5	175.6	-64.9	167.6	0	0	0	108.6	Y248 L252 L255 P332 A335 Y342 V346 L347 S350	Y248-I330 VanDerWaalsContact CE2-O 3.3Å; Y248-I330 WeakPolarHBondContact CE2-O 3.48Å; Y248-I330 PolarHBondContact OH-O 3.39Å; L252-I330 HydrophobicContact CD2-CB 4.22Å; L252-I330 HydrophobicContact CD2-CG2 4.24Å; L255-I330 HydrophobicContact CD1-CG2 4.11Å; I330-P332 VanDerWaalsContact O-CD 3.24Å; I330-P332 WeakPolarHBondContact O-CD 3.24Å; I330-A335 HydrophobicContact CG2-CB 4Å; I330-Y342 HydrophobicContact CD1-CD1 4.38Å; I330-Y342 HydrophobicContact CD1-CD2 4.01Å; I330-Y342 HydrophobicContact CD1-CE2 4.24Å; I330-Y342 HydrophobicContact CD1-CG 4.07Å; I330-Y342 HydrophobicContact CG2-CE2 4.2Å; I330-V346 HydrophobicContact CD1-CG1 3.75Å; I330-L347 HydrophobicContact CD1-CD2 3.9Å; I330-S350 PolarHBondContact N-OG 3.42Å
331	L	83.1	Confident	79.2	Confident	110 Å²	110	71.6 Å²	71.6	58%	0.576	40%	0.403	S	S	*	.			trans	-86.3	104.3	170.9	-63.6	178.8	0	0	0	108.8	I329 H333 V334 A335	I329-L331 PolarHBondContact O-N 3.14Å; L331-H333 PolarHBondContact O-N 3.5Å; L331-H333 VanDerWaalsContact O-N 3.16Å; L331-V334 HydrophobicContact CB-CB 4.19Å; L331-V334 HydrophobicContact CB-CG2 4.01Å; L331-V334 HydrophobicContact CD1-CG2 4.23Å; L331-V334 PolarHBondContact O-N 2.8Å; L331-A335 PolarHBondContact O-N 3.1Å
332	P	78.8	Confident	79.9	Confident	12 Å²	12	73.2 Å²	73.2	8%	0.078	40%	0.404	C	S	.	.	H	α-helix	trans	-66.8	-27.8	-167	-21.9	35	0	0	0	113.3	Y248 K251 L252 L255 I330 S336	Y248-P332 HydrophobicContact CD2-CG 3.8Å; Y248-P332 HydrophobicContact CE2-CG 3.57Å; K251-P332 HydrophobicContact CB-CB 3.61Å; K251-P332 HydrophobicContact CB-CG 4.01Å; K251-P332 HydrophobicContact CD-CB 4.08Å; K251-P332 HydrophobicContact CD-CG 4.38Å; K251-P332 HydrophobicContact CG-CB 4.41Å; L252-P332 HydrophobicContact CD2-CG 4.32Å; L255-P332 HydrophobicContact CD1-CB 4.11Å; I330-P332 VanDerWaalsContact O-CD 3.24Å; I330-P332 WeakPolarHBondContact O-CD 3.24Å; P332-S336 VanDerWaalsContact O-CB 3.29Å; P332-S336 WeakPolarHBondContact O-CB 3.47Å; P332-S336 PolarHBondContact O-N 2.72Å; P332-S336 PolarHBondContact O-OG 2.81Å
333	H	76.5	Confident	80.6	Confident	120 Å²	120	67.4 Å²	67.4	56%	0.556	38%	0.381	S	S	*	.	H	α-helix	trans	-65.2	-42.5	174.9	-67.9	-72.7	0	0	0	112	K251 L331 N337	K251-H333 PolarHBondContact NZ-CE1 3.49Å; K251-H333 PolarHBondContact NZ-NE2 3.4Å; L331-H333 PolarHBondContact O-N 3.5Å; L331-H333 VanDerWaalsContact O-N 3.16Å; H333-N337 PolarHBondContact O-N 3.29Å; H333-N337 PolarHBondContact O-ND2 2.84Å; H333-N337 PolarHBondContact O-OD1 3.37Å
334	V	81.1	Confident	81.3	Confident	85 Å²	85	64.1 Å²	64.1	52%	0.515	36%	0.357	S	S	.	.	H	α-helix	trans	-70.8	-45.6	178.2	-179.7	0	0	0	0	110.2	L331 S336 N337 V338	L331-V334 HydrophobicContact CB-CB 4.19Å; L331-V334 HydrophobicContact CB-CG2 4.01Å; L331-V334 HydrophobicContact CD1-CG2 4.23Å; L331-V334 PolarHBondContact O-N 2.8Å; V334-S336 VanDerWaalsContact C-N 3.34Å; V334-S336 PolarHBondContact O-N 3.41Å; V334-N337 PolarHBondContact O-N 3.24Å; V334-V338 WeakPolarHBondContact O-CG2 3.28Å; V334-V338 PolarHBondContact O-N 3.45Å
335	A	79.6	Confident	81.8	Confident	6 Å²	6	61.6 Å²	61.6	5%	0.05	34%	0.343	C	S	.	.	H	α-helix	trans	-63.1	-38.1	179.7	0	0	0	0	0	113.2	L255 I330 L331 N337 V338 D339 A340 Y342	L255-A335 HydrophobicContact CD1-CB 3.6Å; L255-A335 HydrophobicContact CD2-CB 4.02Å; L255-A335 HydrophobicContact CG-CB 4.46Å; I330-A335 HydrophobicContact CG2-CB 4Å; L331-A335 PolarHBondContact O-N 3.1Å; A335-N337 VanDerWaalsContact C-N 3.33Å; A335-V338 PolarHBondContact O-N 2.86Å; A335-D339 PolarHBondContact O-N 3.23Å; A335-A340 HydrophobicContact CB-CB 4.45Å; A335-A340 PolarHBondContact O-N 3.09Å; A335-Y342 HydrophobicContact CB-CE2 3.91Å
336	S	79.5	Confident	82.3	Confident	53 Å²	53	61.8 Å²	61.8	37%	0.371	35%	0.345	S	S	.	.	H	α-helix	trans	-68.2	-33.6	176.1	-54.5	0	0	0	0	111.8	P332 V334 V338 D339	P332-S336 VanDerWaalsContact O-CB 3.29Å; P332-S336 WeakPolarHBondContact O-CB 3.47Å; P332-S336 PolarHBondContact O-N 2.72Å; P332-S336 PolarHBondContact O-OG 2.81Å; V334-S336 VanDerWaalsContact C-N 3.34Å; V334-S336 PolarHBondContact O-N 3.41Å; S336-V338 VanDerWaalsContact C-N 3.26Å; S336-V338 PolarHBondContact O-N 2.83Å; S336-D339 PolarHBondContact O-N 3.35Å
337	N	80.6	Confident	82.8	Confident	138 Å²	138	58 Å²	58	74%	0.738	33%	0.327	S	S	*	.	H	α-helix	trans	-69.8	-25.2	177.5	-68.9	-8.9	0	0	0	112.8	H333 V334 A335	H333-N337 PolarHBondContact O-N 3.29Å; H333-N337 PolarHBondContact O-ND2 2.84Å; H333-N337 PolarHBondContact O-OD1 3.37Å; V334-N337 PolarHBondContact O-N 3.24Å; A335-N337 VanDerWaalsContact C-N 3.33Å
338	V	84.2	Confident	83.2	Confident	104 Å²	104	55.7 Å²	55.7	63%	0.63	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	3.7	178.1	-175	0	0	0	0	111.1	V334 A335 S336 A340	V334-V338 WeakPolarHBondContact O-CG2 3.28Å; V334-V338 PolarHBondContact O-N 3.45Å; A335-V338 PolarHBondContact O-N 2.86Å; S336-V338 VanDerWaalsContact C-N 3.26Å; S336-V338 PolarHBondContact O-N 2.83Å; V338-A340 PolarHBondContact O-N 3.12Å; V338-A340 VanDerWaalsContact O-N 3.09Å
339	D	77.9	Confident	83.7	Confident	137 Å²	137	52 Å²	52	73%	0.733	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	32.7	-173.3	-72.4	-45.2	0	0	0	113.6	A335 S336 K341	A335-D339 PolarHBondContact O-N 3.23Å; S336-D339 PolarHBondContact O-N 3.35Å; D339-K341 PolarHBondContact O-N 2.85Å
340	A	81.4	Confident	83.9	Confident	17 Å²	17	49.8 Å²	49.8	14%	0.14	27%	0.266	C	S	.	.			trans	-72.4	127.8	-177	0	0	0	0	0	111	A335 V338 Y342	A335-A340 HydrophobicContact CB-CB 4.45Å; A335-A340 PolarHBondContact O-N 3.09Å; V338-A340 PolarHBondContact O-N 3.12Å; V338-A340 VanDerWaalsContact O-N 3.09Å; A340-Y342 HydrophobicContact CB-CE2 3.78Å
341	K	83.5	Confident	84.4	Confident	111 Å²	111	48.9 Å²	48.9	48%	0.483	26%	0.262	S	S	.	.			trans	-107.5	129.9	173.8	-63.7	-66	-175.9	168.5	0	110.3	K254 L255 L257 D339	K254-K341 PolarHBondContact O-NZ 3.19Å; L255-K341 CarbonylContact O-C 3.58Å; L255-K341 WeakPolarHBondContact O-CA 3.45Å; L257-K341 HydrophobicContact CB-CB 4.39Å; L257-K341 HydrophobicContact CD1-CB 4Å; D339-K341 PolarHBondContact O-N 2.85Å
342	Y	84.9	Confident	84.9	Confident	67 Å²	67	43.7 Å²	43.7	26%	0.263	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-114.4	144.8	-176.1	-64.2	-78.3	0	0	0	111.7	L255 L257 I330 A335 A340 V346 L347	L255-Y342 HydrophobicContact CB-CD2 4.3Å; L255-Y342 PolarHBondContact O-N 3.39Å; L257-Y342 PolarHBondContact N-O 2.78Å; I330-Y342 HydrophobicContact CD1-CD1 4.38Å; I330-Y342 HydrophobicContact CD1-CD2 4.01Å; I330-Y342 HydrophobicContact CD1-CE2 4.24Å; I330-Y342 HydrophobicContact CD1-CG 4.07Å; I330-Y342 HydrophobicContact CG2-CE2 4.2Å; A335-Y342 HydrophobicContact CB-CE2 3.91Å; A340-Y342 HydrophobicContact CB-CE2 3.78Å; Y342-V346 HydrophobicContact CD1-CG1 4.03Å; Y342-V346 HydrophobicContact CG-CG1 4.47Å; Y342-L347 HydrophobicContact CD2-CD2 4.46Å
343	P	83.6	Confident	85.5	Confident	19 Å²	19	44.3 Å²	44.3	12%	0.123	24%	0.235	C	C	.	.			trans	-69.3	157.4	168.8	34.2	-36.4	0	0	0	109.8	E345 V346 L347	P343-E345 VanDerWaalsContact C-N 3.31Å; P343-E345 HydrophobicContact CG-CG 4.44Å; P343-E345 PolarHBondContact O-N 3.11Å; P343-V346 HydrophobicContact CG-CB 4.39Å; P343-V346 HydrophobicContact CG-CG2 3.73Å; P343-V346 PolarHBondContact O-N 2.9Å; P343-V346 VanDerWaalsContact O-N 3.11Å; P343-L347 PolarHBondContact O-N 3.04Å
344	I	84.3	Confident	86.2	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.062	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-34.6	-169.8	-169.6	59.1	0	0	0	113.2	V346 L347 F348 M424 C428	I344-V346 PolarHBondContact O-N 2.97Å; I344-L347 HydrophobicContact CD1-CD1 4.39Å; I344-L347 PolarHBondContact O-N 3.39Å; I344-F348 VanDerWaalsContact O-CB 3.28Å; I344-F348 WeakPolarHBondContact O-CB 3.34Å; I344-F348 PolarHBondContact O-N 2.85Å; I344-M424 HydrophobicContact CD1-CB 3.88Å; I344-M424 HydrophobicContact CD1-CG 3.94Å; I344-M424 HydrophobicContact CD1-SD 4.11Å; I344-M424 HydrophobicContact CG1-CB 4.34Å; I344-C428 HydrophobicContact CG1-CB 4.33Å; I344-C428 HydrophobicContact CG2-CB 3.6Å
345	E	87.1	Confident	86.9	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-33.6	177.3	59	-89.4	-154.3	0	0	112.6	R315 V319 P343 R349 I437	R315-E345 IonicContact CZ-OE1 2.65Å; R315-E345 IonicContact NE-OE1 3.02Å; R315-E345 PolarHBondContact NE-OE1 3.36Å; R315-E345 VanDerWaalsContact NE-OE1 3.1Å; R315-E345 IonicContact NH2-OE1 3.63Å; R315-E345 PolarHBondContact NH2-OE1 2.91Å; R315-E345 VanDerWaalsContact NH2-OE1 3.15Å; R315-E345 IonicContact NH2-OE2 3.31Å; R315-E345 PolarHBondContact NH2-OE2 2.95Å; V319-E345 HydrophobicContact CG2-CB 4.47Å; V319-E345 HydrophobicContact CG2-CG 3.94Å; P343-E345 VanDerWaalsContact C-N 3.31Å; P343-E345 HydrophobicContact CG-CG 4.44Å; P343-E345 PolarHBondContact O-N 3.11Å; E345-R349 WeakPolarHBondContact O-CB 3.38Å; E345-R349 PolarHBondContact O-N 3.14Å; E345-I437 HydrophobicContact CB-CG2 3.85Å; E345-I437 HydrophobicContact CG-CG2 4.31Å
346	V	88	Confident	87.5	Confident	17 Å²	17	34.4 Å²	34.4	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-74.6	-39.7	178.4	-178.4	0	0	0	0	110.2	R318 V319 I330 Y342 P343 I344 S350	R318-V346 HydrophobicContact CG-CG2 4.48Å; V319-V346 HydrophobicContact CG2-CG2 4.03Å; I330-V346 HydrophobicContact CD1-CG1 3.75Å; Y342-V346 HydrophobicContact CD1-CG1 4.03Å; Y342-V346 HydrophobicContact CG-CG1 4.47Å; P343-V346 HydrophobicContact CG-CB 4.39Å; P343-V346 HydrophobicContact CG-CG2 3.73Å; P343-V346 PolarHBondContact O-N 2.9Å; P343-V346 VanDerWaalsContact O-N 3.11Å; I344-V346 PolarHBondContact O-N 2.97Å; V346-S350 WeakPolarHBondContact O-CB 3.1Å; V346-S350 PolarHBondContact O-N 2.92Å
347	L	89.4	Confident	88	Confident	1 Å²	1	34 Å²	34	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-42.2	173.5	-59.4	-179.6	0	0	0	111.1	L252 Q256 I330 Y342 P343 I344 S350 I351	L252-L347 HydrophobicContact CB-CD2 4.29Å; L252-L347 HydrophobicContact CD2-CD2 4.01Å; Q256-L347 HydrophobicContact CB-CD1 3.74Å; Q256-L347 HydrophobicContact CG-CD1 3.97Å; I330-L347 HydrophobicContact CD1-CD2 3.9Å; Y342-L347 HydrophobicContact CD2-CD2 4.46Å; P343-L347 PolarHBondContact O-N 3.04Å; I344-L347 HydrophobicContact CD1-CD1 4.39Å; I344-L347 PolarHBondContact O-N 3.39Å; L347-S350 PolarHBondContact O-N 3.4Å; L347-I351 PolarHBondContact O-N 3.04Å
348	F	91.2	Very high	88.4	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.009	14%	0.144	C	C	.	.	H	α-helix	trans	-58.7	-50	176	-172.7	-75.2	0	0	0	111.2	I344 S350 I351 H352 T420 M424 C438 L441 L442 M464 L468	I344-F348 VanDerWaalsContact O-CB 3.28Å; I344-F348 WeakPolarHBondContact O-CB 3.34Å; I344-F348 PolarHBondContact O-N 2.85Å; F348-S350 VanDerWaalsContact C-N 3.31Å; F348-S350 PolarHBondContact O-N 2.95Å; F348-I351 WeakPolarHBondContact O-CG2 3.21Å; F348-H352 AromaticContact CD1-CD2 3.63Å; F348-H352 AromaticContact CE1-CD2 3.39Å; F348-H352 WeakPolarHBondContact CE1-CD2 3.3Å; F348-H352 AromaticContact CE1-NE2 3.98Å; F348-H352 AromaticContact CE2-CD2 3.92Å; F348-H352 AromaticContact CE2-NE2 3.79Å; F348-H352 AromaticContact CG-CD2 3.98Å; F348-H352 AromaticContact CZ-CD2 3.5Å; F348-H352 AromaticContact CZ-NE2 3.57Å; F348-H352 WeakPolarHBondContact O-CB 3.49Å; F348-H352 PolarHBondContact O-CD2 2.78Å; F348-H352 VanDerWaalsContact O-CD2 3.3Å; F348-H352 PolarHBondContact O-N 2.85Å; F348-H352 VanDerWaalsContact O-N 3.13Å; F348-T420 HydrophobicContact CD2-CG2 4.14Å; F348-T420 HydrophobicContact CE2-CG2 3.45Å; F348-T420 VanDerWaalsContact CE2-CG2 3.45Å; F348-T420 HydrophobicContact CZ-CG2 4.28Å; F348-M424 HydrophobicContact CB-CE 3.78Å; F348-M424 HydrophobicContact CB-SD 4.5Å; F348-M424 HydrophobicContact CD2-CE 3.35Å; F348-M424 HydrophobicContact CE2-CE 4.11Å; F348-M424 HydrophobicContact CG-CE 3.79Å; F348-C438 HydrophobicContact CD1-CB 4.09Å; F348-C438 HydrophobicContact CD2-CB 3.89Å; F348-C438 HydrophobicContact CE1-CB 4.09Å; F348-C438 WeakPolarHBondContact CE1-O 3.48Å; F348-C438 HydrophobicContact CE2-CB 3.94Å; F348-C438 HydrophobicContact CG-CB 4.04Å; F348-C438 HydrophobicContact CZ-CB 4.06Å; F348-L441 HydrophobicContact CD1-CB 4.38Å; F348-L441 HydrophobicContact CD1-CD1 4.15Å; F348-L441 HydrophobicContact CE1-CB 4.36Å; F348-L442 HydrophobicContact CE1-CD2 3.53Å; F348-L442 HydrophobicContact CE1-CG 3.81Å; F348-L442 HydrophobicContact CZ-CD1 4.07Å; F348-L442 HydrophobicContact CZ-CD2 3.62Å; F348-L442 HydrophobicContact CZ-CG 3.75Å; F348-M464 HydrophobicContact CZ-SD 4.39Å; F348-L468 HydrophobicContact CE2-CD1 4.41Å; F348-L468 HydrophobicContact CZ-CD1 4.11Å
349	R	91.5	Very high	88.8	Confident	12 Å²	12	22.9 Å²	22.9	5%	0.045	11%	0.114	C	C	.	.	H	α-helix	trans	-54.5	-49.7	172.4	-172.9	-152.3	94.2	94.1	11	111.1	V319 N324 L325 S327 A328 E345 I351 H352 Y353 L441	V319-R349 HydrophobicContact CG1-CB 3.39Å; V319-R349 VanDerWaalsContact CG1-CD 3.41Å; V319-R349 HydrophobicContact CG1-CG 3.54Å; N324-R349 PolarHBondContact O-NH1 3.31Å; L325-R349 PolarHBondContact O-NH1 3.12Å; S327-R349 PolarHBondContact O-NH1 3.14Å; S327-R349 PolarHBondContact O-NH2 2.81Å; A328-R349 PolarHBondContact O-NH2 3.32Å; E345-R349 WeakPolarHBondContact O-CB 3.38Å; E345-R349 PolarHBondContact O-N 3.14Å; R349-I351 PolarHBondContact O-N 2.72Å; R349-H352 PolarHBondContact O-N 3.5Å; R349-Y353 WeakPolarHBondContact O-CB 3.26Å; R349-Y353 PolarHBondContact O-N 2.94Å; R349-L441 HydrophobicContact CB-CD1 4.21Å; R349-L441 HydrophobicContact CB-CD2 4.43Å; R349-L441 HydrophobicContact CG-CD2 4.25Å
350	S	91.7	Very high	89.3	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-61.5	-44.7	-172.6	-159.2	0	0	0	0	112.6	Y248 I330 V346 L347 F348 A354	Y248-S350 PolarHBondContact OH-OG 3.16Å; I330-S350 PolarHBondContact N-OG 3.42Å; V346-S350 WeakPolarHBondContact O-CB 3.1Å; V346-S350 PolarHBondContact O-N 2.92Å; L347-S350 PolarHBondContact O-N 3.4Å; F348-S350 VanDerWaalsContact C-N 3.31Å; F348-S350 PolarHBondContact O-N 2.95Å; S350-A354 VanDerWaalsContact O-CB 3.25Å; S350-A354 WeakPolarHBondContact O-CB 3.34Å; S350-A354 PolarHBondContact O-N 3.42Å
351	I	93.7	Very high	89.7	Confident	0 Å²	0	21 Å²	21	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-71.8	-39.9	178.9	-168.1	169.1	0	0	0	112.7	Y248 L252 L347 F348 R349 L355 W415 F419 M424	Y248-I351 HydrophobicContact CD1-CG1 4.42Å; Y248-I351 HydrophobicContact CE1-CB 4.43Å; L252-I351 HydrophobicContact CD1-CB 4.08Å; L347-I351 PolarHBondContact O-N 3.04Å; F348-I351 WeakPolarHBondContact O-CG2 3.21Å; R349-I351 PolarHBondContact O-N 2.72Å; I351-L355 PolarHBondContact O-N 3.17Å; I351-W415 HydrophobicContact CD1-CZ3 4.27Å; I351-F419 HydrophobicContact CD1-CD1 3.61Å; I351-F419 HydrophobicContact CD1-CE1 3.66Å; I351-M424 HydrophobicContact CG2-CE 3.76Å; I351-M424 HydrophobicContact CG2-SD 4.27Å
352	H	93.5	Very high	90.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-76.7	-31.7	-179.1	-76.6	-68.8	0	0	0	113.1	F348 R349 L355 L356 T420 L445 W461 M464	F348-H352 AromaticContact CD1-CD2 3.63Å; F348-H352 AromaticContact CE1-CD2 3.39Å; F348-H352 WeakPolarHBondContact CE1-CD2 3.3Å; F348-H352 AromaticContact CE1-NE2 3.98Å; F348-H352 AromaticContact CE2-CD2 3.92Å; F348-H352 AromaticContact CE2-NE2 3.79Å; F348-H352 AromaticContact CG-CD2 3.98Å; F348-H352 AromaticContact CZ-CD2 3.5Å; F348-H352 AromaticContact CZ-NE2 3.57Å; F348-H352 WeakPolarHBondContact O-CB 3.49Å; F348-H352 PolarHBondContact O-CD2 2.78Å; F348-H352 VanDerWaalsContact O-CD2 3.3Å; F348-H352 PolarHBondContact O-N 2.85Å; F348-H352 VanDerWaalsContact O-N 3.13Å; R349-H352 PolarHBondContact O-N 3.5Å; H352-L355 WeakPolarHBondContact O-CB 3.39Å; H352-L355 PolarHBondContact O-N 2.93Å; H352-L356 PolarHBondContact O-N 3.38Å; H352-T420 PolarHBondContact NE2-OG1 3.35Å; H352-T420 VanDerWaalsContact NE2-OG1 3.13Å; H352-L445 HydrophobicContact CB-CD1 3.43Å; H352-L445 VanDerWaalsContact CB-CD1 3.43Å; H352-W461 AromaticContact ND1-NE1 3.31Å; H352-W461 PolarHBondContact ND1-NE1 3.1Å; H352-M464 PolarHBondContact CE1-SD 2.86Å; H352-M464 PolarHBondContact NE2-SD 3.13Å
353	Y	93	Very high	90.3	Very high	25 Å²	25	13 Å²	13	10%	0.098	6%	0.06	C	C	.	.	H	α-helix	trans	-70	-40	170.5	-173.2	-116.5	0	0	0	111.6	E326 I329 R349 L355 L356 D357 L445 L448 R452	E326-Y353 PolarHBondContact O-OH 3.26Å; I329-Y353 HydrophobicContact CG2-CD1 3.75Å; R349-Y353 WeakPolarHBondContact O-CB 3.26Å; R349-Y353 PolarHBondContact O-N 2.94Å; Y353-L355 VanDerWaalsContact C-N 3.26Å; Y353-L355 PolarHBondContact O-N 3.1Å; Y353-L356 HydrophobicContact CD2-CD2 4.43Å; Y353-L356 PolarHBondContact O-N 3.04Å; Y353-L356 VanDerWaalsContact O-N 3.16Å; Y353-D357 PolarHBondContact O-N 3.37Å; Y353-L445 HydrophobicContact CD2-CD2 3.91Å; Y353-L448 HydrophobicContact CD2-CD2 4.35Å; Y353-L448 HydrophobicContact CE2-CD2 3.79Å; Y353-R452 PolarHBondContact OH-NH2 3.05Å
354	A	91.5	Very high	90.5	Very high	3 Å²	3	16.8 Å²	16.8	3%	0.025	7%	0.073	C	C	.	.	H	α-helix	trans	-59.2	-39.4	171.2	0	0	0	0	0	111.8	F245 Y248 I329 S350 T358	F245-A354 HydrophobicContact CE1-CB 4.22Å; Y248-A354 HydrophobicContact CE1-CB 4.26Å; I329-A354 HydrophobicContact CD1-CB 4.29Å; I329-A354 HydrophobicContact CG2-CB 4.08Å; S350-A354 VanDerWaalsContact O-CB 3.25Å; S350-A354 WeakPolarHBondContact O-CB 3.34Å; S350-A354 PolarHBondContact O-N 3.42Å; A354-T358 VanDerWaalsContact O-CB 3.28Å; A354-T358 WeakPolarHBondContact O-CB 3.4Å; A354-T358 PolarHBondContact O-N 3.32Å; A354-T358 PolarHBondContact O-OG1 3.09Å
355	L	94.3	Very high	90.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.9	-46.9	172.9	175.8	61.5	0	0	0	111.8	F245 I351 H352 Y353 T358 A359 M409 L413 I416 L457 F460	F245-L355 HydrophobicContact CE1-CB 4.24Å; F245-L355 HydrophobicContact CE2-CD1 4.33Å; F245-L355 HydrophobicContact CZ-CB 4.27Å; F245-L355 HydrophobicContact CZ-CD1 4.1Å; I351-L355 PolarHBondContact O-N 3.17Å; H352-L355 WeakPolarHBondContact O-CB 3.39Å; H352-L355 PolarHBondContact O-N 2.93Å; Y353-L355 VanDerWaalsContact C-N 3.26Å; Y353-L355 PolarHBondContact O-N 3.1Å; L355-T358 PolarHBondContact O-N 2.97Å; L355-A359 WeakPolarHBondContact O-CB 3.26Å; L355-A359 PolarHBondContact O-N 3.39Å; L355-M409 HydrophobicContact CD1-CE 3.48Å; L355-M409 VanDerWaalsContact CD1-CE 3.48Å; L355-L413 HydrophobicContact CD1-CD2 3.84Å; L355-L413 HydrophobicContact CD2-CD2 3.87Å; L355-L413 HydrophobicContact CG-CD2 4.4Å; L355-I416 HydrophobicContact CB-CD1 4.16Å; L355-I416 HydrophobicContact CD1-CD1 3.73Å; L355-I416 HydrophobicContact CD2-CD1 3.88Å; L355-I416 HydrophobicContact CD2-CG2 4.46Å; L355-I416 HydrophobicContact CG-CD1 4.12Å; L355-L457 HydrophobicContact CG-CD1 4.5Å; L355-F460 HydrophobicContact CD2-CD1 4.07Å; L355-F460 HydrophobicContact CD2-CE1 3.46Å; L355-F460 VanDerWaalsContact CD2-CE1 3.46Å; L355-F460 HydrophobicContact CD2-CZ 3.99Å
356	L	91.7	Very high	90.8	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-59.9	-50.7	178.2	178.9	52.8	0	0	0	112	H352 Y353 T358 A359 C360 L445 L448 A449 L457 W461	H352-L356 PolarHBondContact O-N 3.38Å; Y353-L356 HydrophobicContact CD2-CD2 4.43Å; Y353-L356 PolarHBondContact O-N 3.04Å; Y353-L356 VanDerWaalsContact O-N 3.16Å; L356-T358 VanDerWaalsContact C-N 3.31Å; L356-T358 PolarHBondContact O-N 3.05Å; L356-A359 PolarHBondContact O-N 2.99Å; L356-C360 VanDerWaalsContact CD1-SG 3.56Å; L356-C360 PolarHBondContact O-N 2.93Å; L356-C360 PolarHBondContact O-SG 3.09Å; L356-L445 HydrophobicContact CD2-CD2 3.86Å; L356-L448 HydrophobicContact CD2-CB 3.94Å; L356-L448 HydrophobicContact CD2-CD2 3.65Å; L356-L448 HydrophobicContact CD2-CG 3.84Å; L356-A449 HydrophobicContact CD1-CB 3.7Å; L356-L457 HydrophobicContact CD1-CD1 4.18Å; L356-W461 HydrophobicContact CB-CH2 3.84Å; L356-W461 HydrophobicContact CB-CZ2 4.26Å; L356-W461 HydrophobicContact CD1-CH2 3.85Å; L356-W461 HydrophobicContact CD1-CZ3 4.36Å; L356-W461 HydrophobicContact CD2-CH2 4.17Å; L356-W461 HydrophobicContact CG-CH2 4.14Å
357	D	90.3	Very high	90.7	Very high	45 Å²	45	15.9 Å²	15.9	24%	0.241	7%	0.068	C	C	.	.	H	α-helix	trans	-61.4	-42.2	-179.8	-172.8	41.6	0	0	0	111.3	Y353 C360 R361	Y353-D357 PolarHBondContact O-N 3.37Å; D357-C360 PolarHBondContact O-N 3.16Å; D357-R361 VanDerWaalsContact CG-NE 3.29Å; D357-R361 WeakPolarHBondContact O-CD 3.43Å; D357-R361 VanDerWaalsContact O-CG 3.27Å; D357-R361 WeakPolarHBondContact O-CG 3.43Å; D357-R361 PolarHBondContact O-N 3.4Å; D357-R361 VanDerWaalsContact O-N 3.14Å; D357-R361 IonicContact OD1-CZ 2.86Å; D357-R361 IonicContact OD1-NE 3.19Å; D357-R361 PolarHBondContact OD1-NE 2.97Å; D357-R361 IonicContact OD1-NH2 3.88Å; D357-R361 PolarHBondContact OD1-NH2 3.28Å; D357-R361 IonicContact OD2-CZ 3.61Å; D357-R361 IonicContact OD2-NE 3.99Å; D357-R361 PolarHBondContact OD2-NE 2.94Å; D357-R361 IonicContact OD2-NH2 3.75Å; D357-R361 PolarHBondContact OD2-NH2 3.25Å
358	T	90.6	Very high	90.5	Very high	8 Å²	8	19.6 Å²	19.6	5%	0.049	9%	0.088	C	C	.	.	H	α-helix	trans	-62.8	-44.4	175.4	-57.2	0	0	0	0	111.5	Y241 F245 A354 L355 L356 E362 M409	Y241-T358 HydrophobicContact CD1-CG2 3.47Å; Y241-T358 VanDerWaalsContact CD1-CG2 3.47Å; Y241-T358 HydrophobicContact CE1-CG2 3.22Å; Y241-T358 HydrophobicContact CG-CG2 4.33Å; F245-T358 HydrophobicContact CE2-CG2 4.17Å; F245-T358 HydrophobicContact CZ-CG2 4.21Å; A354-T358 VanDerWaalsContact O-CB 3.28Å; A354-T358 WeakPolarHBondContact O-CB 3.4Å; A354-T358 PolarHBondContact O-N 3.32Å; A354-T358 PolarHBondContact O-OG1 3.09Å; L355-T358 PolarHBondContact O-N 2.97Å; L356-T358 VanDerWaalsContact C-N 3.31Å; L356-T358 PolarHBondContact O-N 3.05Å; T358-E362 WeakPolarHBondContact O-CB 2.98Å; T358-E362 PolarHBondContact O-N 3.32Å; T358-M409 HydrophobicContact CG2-CE 4.39Å
359	A	90.8	Very high	90.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-64.8	-44.4	179.5	0	0	0	0	0	112.1	L355 L356 E362 Y363 F405 L457	L355-A359 WeakPolarHBondContact O-CB 3.26Å; L355-A359 PolarHBondContact O-N 3.39Å; L356-A359 PolarHBondContact O-N 2.99Å; A359-E362 PolarHBondContact O-N 3.15Å; A359-Y363 VanDerWaalsContact O-CB 3.23Å; A359-Y363 WeakPolarHBondContact O-CB 3.4Å; A359-Y363 PolarHBondContact O-N 3.26Å; A359-F405 HydrophobicContact CB-CE2 3.94Å; A359-F405 HydrophobicContact CB-CZ 3.59Å; A359-F405 WeakPolarHBondContact O-CE2 3.12Å; A359-L457 HydrophobicContact CB-CD1 3.71Å; A359-L457 HydrophobicContact CB-CD2 4.34Å; A359-L457 HydrophobicContact CB-CG 4.19Å
360	C	90.3	Very high	89.9	Confident	7 Å²	7	19.7 Å²	19.7	5%	0.047	9%	0.089	C	C	.	.	H	α-helix	trans	-60.6	-48.9	178.2	-70	0	0	0	0	111.3	L356 D357 E362 Y363 Y364 V454	L356-C360 VanDerWaalsContact CD1-SG 3.56Å; L356-C360 PolarHBondContact O-N 2.93Å; L356-C360 PolarHBondContact O-SG 3.09Å; D357-C360 PolarHBondContact O-N 3.16Å; C360-E362 PolarHBondContact O-N 3.09Å; C360-Y363 PolarHBondContact O-N 3.11Å; C360-Y364 WeakPolarHBondContact O-CD2 3.14Å; C360-Y364 PolarHBondContact O-N 3.43Å; C360-Y364 VanDerWaalsContact O-N 3.08Å; C360-V454 HydrophobicContact CB-CG2 4.3Å
361	R	88.5	Confident	89.1	Confident	108 Å²	108	23.6 Å²	23.6	41%	0.408	11%	0.109	S	C	.	.	H	α-helix	trans	-61.9	-44.9	179.6	-68.2	169.7	-170.4	-111	7.3	111.9	D357 F365	D357-R361 VanDerWaalsContact CG-NE 3.29Å; D357-R361 WeakPolarHBondContact O-CD 3.43Å; D357-R361 VanDerWaalsContact O-CG 3.27Å; D357-R361 WeakPolarHBondContact O-CG 3.43Å; D357-R361 PolarHBondContact O-N 3.4Å; D357-R361 VanDerWaalsContact O-N 3.14Å; D357-R361 IonicContact OD1-CZ 2.86Å; D357-R361 IonicContact OD1-NE 3.19Å; D357-R361 PolarHBondContact OD1-NE 2.97Å; D357-R361 IonicContact OD1-NH2 3.88Å; D357-R361 PolarHBondContact OD1-NH2 3.28Å; D357-R361 IonicContact OD2-CZ 3.61Å; D357-R361 IonicContact OD2-NE 3.99Å; D357-R361 PolarHBondContact OD2-NE 2.94Å; D357-R361 IonicContact OD2-NH2 3.75Å; D357-R361 PolarHBondContact OD2-NH2 3.25Å; R361-F365 VanDerWaalsContact O-CB 3.3Å; R361-F365 WeakPolarHBondContact O-CB 3.23Å; R361-F365 PolarHBondContact O-N 3.08Å
362	E	91.3	Very high	87.8	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-66	-41.3	178.8	-175.6	60.7	-170.5	0	0	111.2	Q205 Y233 Y241 T358 A359 C360 Y364 F365 L366 F405 V408	Q205-E362 PolarHBondContact NE2-OE2 2.87Å; Y233-E362 WeakPolarHBondContact CE1-OE1 3.47Å; Y233-E362 PolarHBondContact OH-OE1 3.15Å; Y233-E362 PolarHBondContact OH-OE2 2.87Å; Y233-E362 VanDerWaalsContact OH-OE2 3.12Å; Y241-E362 HydrophobicContact CE2-CG 4.17Å; Y241-E362 PolarHBondContact OH-OE2 2.91Å; T358-E362 WeakPolarHBondContact O-CB 2.98Å; T358-E362 PolarHBondContact O-N 3.32Å; A359-E362 PolarHBondContact O-N 3.15Å; C360-E362 PolarHBondContact O-N 3.09Å; E362-Y364 PolarHBondContact O-N 3.35Å; E362-F365 PolarHBondContact O-N 3.07Å; E362-L366 HydrophobicContact CG-CD1 3.91Å; E362-L366 HydrophobicContact CG-CG 4.16Å; E362-L366 WeakPolarHBondContact O-CB 3.18Å; E362-L366 WeakPolarHBondContact O-CG 3.27Å; E362-L366 PolarHBondContact O-N 3.32Å; E362-L366 WeakPolarHBondContact OE1-CD2 3.32Å; E362-L366 WeakPolarHBondContact OE1-CG 3.39Å; E362-F405 HydrophobicContact CB-CE2 4.33Å; E362-F405 HydrophobicContact CG-CD2 4.36Å; E362-F405 HydrophobicContact CG-CE2 4.49Å; E362-V408 HydrophobicContact CG-CG1 4.23Å
363	Y	89.8	Confident	86.2	Confident	9 Å²	9	28 Å²	28	4%	0.035	14%	0.138	C	C	.	.	H	α-helix	trans	-59.3	-48	177.9	-175.3	-101.7	0	0	0	112.2	A359 C360 L366 S367 T374 L401 F405 V454 V456	A359-Y363 VanDerWaalsContact O-CB 3.23Å; A359-Y363 WeakPolarHBondContact O-CB 3.4Å; A359-Y363 PolarHBondContact O-N 3.26Å; C360-Y363 PolarHBondContact O-N 3.11Å; Y363-L366 PolarHBondContact O-N 2.79Å; Y363-S367 WeakPolarHBondContact O-CB 3.29Å; Y363-S367 PolarHBondContact O-N 3.08Å; Y363-T374 HydrophobicContact CE1-CG2 3.99Å; Y363-L401 HydrophobicContact CD2-CD2 4.19Å; Y363-L401 HydrophobicContact CD2-CG 4.15Å; Y363-L401 HydrophobicContact CE1-CD2 4.07Å; Y363-L401 HydrophobicContact CE2-CD2 3.55Å; Y363-L401 HydrophobicContact CE2-CG 3.68Å; Y363-L401 VanDerWaalsContact CZ-CD2 3.48Å; Y363-F405 HydrophobicContact CD2-CD2 4.4Å; Y363-V454 HydrophobicContact CD1-CB 4.37Å; Y363-V454 HydrophobicContact CD1-CG1 4.06Å; Y363-V454 HydrophobicContact CD1-CG2 3.8Å; Y363-V454 HydrophobicContact CD2-CG1 4.22Å; Y363-V454 HydrophobicContact CE1-CG2 4.42Å; Y363-V454 HydrophobicContact CG-CG1 3.79Å; Y363-V454 HydrophobicContact CG-CG2 4.29Å; Y363-V456 HydrophobicContact CD2-CG2 3.5Å; Y363-V456 VanDerWaalsContact CD2-CG2 3.5Å; Y363-V456 HydrophobicContact CE2-CG2 3.36Å
364	Y	88.7	Confident	84.3	Confident	99 Å²	99	29.2 Å²	29.2	39%	0.388	15%	0.148	S	C	.	.	H	α-helix	trans	-67.9	-39.6	176.4	-72.9	-61.1	0	0	0	112.8	C360 E362 L366 S367 D368 R452 V454	C360-Y364 WeakPolarHBondContact O-CD2 3.14Å; C360-Y364 PolarHBondContact O-N 3.43Å; C360-Y364 VanDerWaalsContact O-N 3.08Å; E362-Y364 PolarHBondContact O-N 3.35Å; Y364-L366 VanDerWaalsContact C-N 3.33Å; Y364-L366 PolarHBondContact O-N 2.91Å; Y364-S367 WeakPolarHBondContact O-CB 3.23Å; Y364-S367 PolarHBondContact O-N 3.43Å; Y364-D368 WeakPolarHBondContact O-CB 3.26Å; Y364-D368 PolarHBondContact O-N 3Å; Y364-R452 PolarHBondContact OH-O 3.01Å; Y364-V454 HydrophobicContact CE2-CG2 4.26Å
365	F	89.8	Confident	82	Confident	9 Å²	9	37 Å²	37	4%	0.039	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-45.1	174.5	175.5	-89.8	0	0	0	111.5	Q205 M208 L209 Y233 R361 E362 D368 F369	Q205-F365 HydrophobicContact CB-CD2 3.92Å; Q205-F365 HydrophobicContact CB-CE2 3.95Å; Q205-F365 HydrophobicContact CG-CD2 4.31Å; Q205-F365 HydrophobicContact CG-CE2 4.25Å; Q205-F365 HydrophobicContact CG-CZ 4.47Å; Q205-F365 VanDerWaalsContact O-CE2 3.29Å; Q205-F365 WeakPolarHBondContact O-CE2 3.33Å; M208-F365 HydrophobicContact CB-CE2 4.24Å; M208-F365 HydrophobicContact CB-CZ 4.39Å; L209-F365 HydrophobicContact CD1-CD2 4.43Å; L209-F365 HydrophobicContact CD2-CD2 3.75Å; L209-F365 HydrophobicContact CD2-CE2 3.95Å; L209-F365 HydrophobicContact CG-CD2 3.94Å; L209-F365 HydrophobicContact CG-CE2 4.08Å; Y233-F365 HydrophobicContact CE1-CD1 4.38Å; Y233-F365 AromaticContact CE1-CE1 3.99Å; Y233-F365 HydrophobicContact CE1-CE1 3.99Å; Y233-F365 HydrophobicContact CE2-CD1 4.44Å; Y233-F365 AromaticContact CE2-CE1 3.54Å; Y233-F365 HydrophobicContact CE2-CE1 3.54Å; Y233-F365 AromaticContact CE2-CZ 3.97Å; Y233-F365 HydrophobicContact CE2-CZ 3.97Å; Y233-F365 AromaticContact CZ-CD1 3.76Å; Y233-F365 AromaticContact CZ-CE1 3.25Å; Y233-F365 WeakPolarHBondContact OH-CD1 3.12Å; Y233-F365 WeakPolarHBondContact OH-CE1 3.38Å; R361-F365 VanDerWaalsContact O-CB 3.3Å; R361-F365 WeakPolarHBondContact O-CB 3.23Å; R361-F365 PolarHBondContact O-N 3.08Å; E362-F365 PolarHBondContact O-N 3.07Å; F365-D368 PolarHBondContact O-N 2.86Å; F365-F369 HydrophobicContact CD1-CB 4.43Å; F365-F369 HydrophobicContact CD2-CB 4.47Å; F365-F369 HydrophobicContact CE1-CB 3.91Å; F365-F369 HydrophobicContact CE1-CD1 4.22Å; F365-F369 HydrophobicContact CE1-CG 4.13Å; F365-F369 HydrophobicContact CE2-CB 4Å; F365-F369 HydrophobicContact CE2-CD2 4.4Å; F365-F369 HydrophobicContact CE2-CG 4.21Å; F365-F369 HydrophobicContact CZ-CB 3.7Å; F365-F369 HydrophobicContact CZ-CD1 4.01Å; F365-F369 HydrophobicContact CZ-CD2 4.11Å; F365-F369 AromaticContact CZ-CG 3.66Å; F365-F369 HydrophobicContact CZ-CG 3.66Å; F365-F369 WeakPolarHBondContact O-CB 3.22Å; F365-F369 PolarHBondContact O-N 3.46Å
366	L	87.8	Confident	79.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-40.9	179.6	-70.5	175.8	0	0	0	111.8	Y233 E362 Y363 Y364 F370 L401 L404 F405 V408	Y233-L366 HydrophobicContact CD1-CD2 4.39Å; Y233-L366 HydrophobicContact CE1-CD2 3.78Å; E362-L366 HydrophobicContact CG-CD1 3.91Å; E362-L366 HydrophobicContact CG-CG 4.16Å; E362-L366 WeakPolarHBondContact O-CB 3.18Å; E362-L366 WeakPolarHBondContact O-CG 3.27Å; E362-L366 PolarHBondContact O-N 3.32Å; E362-L366 WeakPolarHBondContact OE1-CD2 3.32Å; E362-L366 WeakPolarHBondContact OE1-CG 3.39Å; Y363-L366 PolarHBondContact O-N 2.79Å; Y364-L366 VanDerWaalsContact C-N 3.33Å; Y364-L366 PolarHBondContact O-N 2.91Å; L366-F370 HydrophobicContact CD2-CD2 3.73Å; L366-F370 HydrophobicContact CD2-CE2 3.68Å; L366-F370 WeakPolarHBondContact O-CB 3.21Å; L366-F370 PolarHBondContact O-N 3.34Å; L366-F370 VanDerWaalsContact O-N 3.15Å; L366-L401 HydrophobicContact CB-CD1 3.61Å; L366-L404 HydrophobicContact CB-CD2 4.41Å; L366-L404 HydrophobicContact CD1-CG 4.11Å; L366-L404 HydrophobicContact CD2-CD2 3.87Å; L366-L404 HydrophobicContact CD2-CG 3.97Å; L366-L404 HydrophobicContact CG-CG 4.5Å; L366-F405 HydrophobicContact CD1-CB 4.01Å; L366-F405 HydrophobicContact CD1-CD2 4.33Å; L366-V408 HydrophobicContact CD1-CG2 4.35Å
367	S	85	Confident	77.1	Confident	5 Å²	5	49.4 Å²	49.4	4%	0.035	25%	0.247	C	C	.	.	H	α-helix	trans	-53.7	-56.3	171.4	161.4	0	0	0	0	111.3	Y363 Y364 L371 L372 T374	Y363-S367 WeakPolarHBondContact O-CB 3.29Å; Y363-S367 PolarHBondContact O-N 3.08Å; Y364-S367 WeakPolarHBondContact O-CB 3.23Å; Y364-S367 PolarHBondContact O-N 3.43Å; S367-L371 CarbonylContact O-C 3.57Å; S367-L371 VanDerWaalsContact O-CA 3.28Å; S367-L371 WeakPolarHBondContact O-CA 3.29Å; S367-L371 PolarHBondContact O-N 2.86Å; S367-L372 WeakPolarHBondContact CA-O 3.12Å; S367-L372 PolarHBondContact O-N 3.28Å; S367-L372 PolarHBondContact OG-O 3.49Å; S367-T374 WeakPolarHBondContact OG-CG2 3.28Å
368	D	85.5	Confident	74.5	Confident	80 Å²	80	52.7 Å²	52.7	43%	0.428	27%	0.274	S	S	.	.	H	α-helix	trans	-78.4	-41.3	-167.2	-68.8	-1.5	0	0	0	112.4	L209 Y364 F365	L209-D368 HydrophobicContact CD2-CB 3.83Å; Y364-D368 WeakPolarHBondContact O-CB 3.26Å; Y364-D368 PolarHBondContact O-N 3Å; F365-D368 PolarHBondContact O-N 2.86Å
369	F	85.6	Confident	72	Confident	1 Å²	1	58.6 Å²	58.6	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-75.7	-39.8	-178.2	-172.7	-100.3	0	0	0	112.2	L187 M208 L209 N215 F365	L187-F369 HydrophobicContact CD2-CZ 4.02Å; M208-F369 HydrophobicContact CB-CD2 4.4Å; M208-F369 HydrophobicContact CB-CE2 4.12Å; M208-F369 HydrophobicContact CE-CE1 4.29Å; M208-F369 HydrophobicContact CE-CE2 4.29Å; M208-F369 HydrophobicContact CE-CZ 3.89Å; M208-F369 WeakPolarHBondContact O-CE2 3.15Å; L209-F369 HydrophobicContact CD2-CB 4.1Å; N215-F369 HydrophobicContact CB-CE1 4.37Å; N215-F369 HydrophobicContact CB-CZ 4.34Å; N215-F369 PolarHBondContact ND2-O 3.31Å; F365-F369 HydrophobicContact CD1-CB 4.43Å; F365-F369 HydrophobicContact CD2-CB 4.47Å; F365-F369 HydrophobicContact CE1-CB 3.91Å; F365-F369 HydrophobicContact CE1-CD1 4.22Å; F365-F369 HydrophobicContact CE1-CG 4.13Å; F365-F369 HydrophobicContact CE2-CB 4Å; F365-F369 HydrophobicContact CE2-CD2 4.4Å; F365-F369 HydrophobicContact CE2-CG 4.21Å; F365-F369 HydrophobicContact CZ-CB 3.7Å; F365-F369 HydrophobicContact CZ-CD1 4.01Å; F365-F369 HydrophobicContact CZ-CD2 4.11Å; F365-F369 AromaticContact CZ-CG 3.66Å; F365-F369 HydrophobicContact CZ-CG 3.66Å; F365-F369 WeakPolarHBondContact O-CB 3.22Å; F365-F369 PolarHBondContact O-N 3.46Å
370	F	84	Confident	69.5	Low	15 Å²	15	66 Å²	66	7%	0.066	35%	0.349	C	S	.	.	H	α-helix	trans	-92.1	4.6	178.7	-64.1	-76.4	0	0	0	114.2	N215 R230 Y233 L366 L372 L404	N215-F370 WeakPolarHBondContact ND2-CA 3.37Å; R230-F370 HydrophobicContact CB-CE1 3.91Å; R230-F370 HydrophobicContact CB-CZ 4.41Å; R230-F370 HydrophobicContact CG-CE1 4.17Å; R230-F370 HydrophobicContact CG-CZ 4.46Å; Y233-F370 AromaticContact CD1-CE2 3.99Å; Y233-F370 HydrophobicContact CD1-CE2 3.99Å; Y233-F370 HydrophobicContact CD1-CZ 4.16Å; Y233-F370 HydrophobicContact CE1-CE2 4.27Å; Y233-F370 HydrophobicContact CG-CE2 4.41Å; Y233-F370 HydrophobicContact CG-CZ 4.2Å; L366-F370 HydrophobicContact CD2-CD2 3.73Å; L366-F370 HydrophobicContact CD2-CE2 3.68Å; L366-F370 WeakPolarHBondContact O-CB 3.21Å; L366-F370 PolarHBondContact O-N 3.34Å; L366-F370 VanDerWaalsContact O-N 3.15Å; F370-L372 VanDerWaalsContact C-N 3.29Å; F370-L372 HydrophobicContact CB-CD1 4.16Å; F370-L372 HydrophobicContact CB-CG 4.27Å; F370-L372 PolarHBondContact O-N 3.26Å; F370-L404 HydrophobicContact CB-CD2 4.26Å; F370-L404 HydrophobicContact CD2-CD2 3.77Å; F370-L404 HydrophobicContact CE2-CD2 4.34Å; F370-L404 HydrophobicContact CG-CD2 4.07Å
371	L	74.4	Confident	66.5	Low	82 Å²	82	71 Å²	71	43%	0.429	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	43.5	178.5	-59.3	177.8	0	0	0	113	S216 S367	S216-L371 WeakPolarHBondContact OG-CD1 3.4Å; S367-L371 CarbonylContact O-C 3.57Å; S367-L371 VanDerWaalsContact O-CA 3.28Å; S367-L371 WeakPolarHBondContact O-CA 3.29Å; S367-L371 PolarHBondContact O-N 2.86Å
372	L	68.4	Low	64	Low	26 Å²	26	71.1 Å²	71.1	14%	0.136	40%	0.399	C	S	.	.			trans	-101.2	108.7	176	-62.3	168.6	0	0	0	107.7	S367 F370 T374 A400 L401 L404	S367-L372 WeakPolarHBondContact CA-O 3.12Å; S367-L372 PolarHBondContact O-N 3.28Å; S367-L372 PolarHBondContact OG-O 3.49Å; F370-L372 VanDerWaalsContact C-N 3.29Å; F370-L372 HydrophobicContact CB-CD1 4.16Å; F370-L372 HydrophobicContact CB-CG 4.27Å; F370-L372 PolarHBondContact O-N 3.26Å; L372-T374 PolarHBondContact O-N 3.31Å; L372-A400 HydrophobicContact CD2-CB 4.26Å; L372-L401 HydrophobicContact CB-CB 4Å; L372-L401 HydrophobicContact CB-CD1 4.2Å; L372-L401 HydrophobicContact CD1-CB 4.24Å; L372-L401 HydrophobicContact CD1-CD1 4.1Å; L372-L404 HydrophobicContact CD1-CD2 3.74Å
373	S	58.7	Low	61.4	Low	67 Å²	67	77.4 Å²	77.4	47%	0.469	44%	0.44	S	S	.	.			trans	-55.9	135.8	-174.3	-50.5	0	0	0	0	113.2
374	T	52.9	Low	58.8	Low	50 Å²	50	82.3 Å²	82.3	31%	0.307	48%	0.475	S	S	.	.			trans	-94.7	2.2	178.8	41.7	0	0	0	0	114.7	Y363 S367 L372 T376 L401	Y363-T374 HydrophobicContact CE1-CG2 3.99Å; S367-T374 WeakPolarHBondContact OG-CG2 3.28Å; L372-T374 PolarHBondContact O-N 3.31Å; T374-T376 VanDerWaalsContact C-N 3.26Å; T374-T376 PolarHBondContact O-N 3.38Å; T374-L401 HydrophobicContact CG2-CD2 3.8Å
375	E	42.9	Very low	56	Low	166 Å²	166	82.9 Å²	82.9	78%	0.776	49%	0.492	S	S	*	.			trans	-64.4	82.9	-172.6	-67	179.8	-174.6	0	0	112.2
376	T	43.5	Very low	53.4	Low	82 Å²	82	89.6 Å²	89.6	50%	0.503	53%	0.529	S	S	.	.			trans	-78.4	115.7	163	48.7	0	0	0	0	108.2	T374 S378	T374-T376 VanDerWaalsContact C-N 3.26Å; T374-T376 PolarHBondContact O-N 3.38Å; T376-S378 PolarHBondContact O-N 3.45Å
377	E	39.6	Very low	50.9	Low	179 Å²	179	98.3 Å²	98.3	84%	0.836	57%	0.57	S	S	*	*			trans	30.1	58.8	150.8	-56.9	-165.7	167	0	0	117.3	V379	E377-V379 WeakPolarHBondContact O-CG2 3.46Å; E377-V379 PolarHBondContact O-N 3.39Å
378	S	35.9	Very low	48.4	Very low	114 Å²	114	102.9 Å²	102.9	80%	0.797	60%	0.602	S	S	*	*			trans	-69.4	105.4	158.1	47.2	0	0	0	0	108.5	T376 D380	T376-S378 PolarHBondContact O-N 3.45Å; S378-D380 PolarHBondContact O-N 3.26Å
379	V	38	Very low	45.9	Very low	131 Å²	131	103.9 Å²	103.9	79%	0.794	62%	0.621	S	S	*	*			trans	-67.3	63.6	-177.7	-174.4	0	0	0	0	111.8	E377	E377-V379 WeakPolarHBondContact O-CG2 3.46Å; E377-V379 PolarHBondContact O-N 3.39Å
380	D	38.1	Very low	43.7	Very low	155 Å²	155	109 Å²	109	83%	0.829	65%	0.654	S	S	*	*			trans	-148.4	40.5	175	-108.4	-15.9	0	0	0	114.4	S378	S378-D380 PolarHBondContact O-N 3.26Å
381	S	28.9	Very low	41.3	Very low	112 Å²	112	114.4 Å²	114.4	78%	0.783	68%	0.684	S	S	*	*	S	Bend	trans	-139.8	120.1	157.7	-68	0	0	0	0	109.7
382	P	34.9	Very low	39.6	Very low	112 Å²	112	117.2 Å²	117.2	73%	0.727	70%	0.695	S	S	*	*			trans	-61.2	153.6	178.2	-3.2	13.4	0	0	0	109.9	S384	P382-S384 VanDerWaalsContact C-N 3.29Å; P382-S384 PolarHBondContact O-N 2.87Å
383	P	37.3	Very low	38.1	Very low	132 Å²	132	118.2 Å²	118.2	86%	0.857	71%	0.711	S	S	*	*			trans	-68.4	88.3	176.8	29	-32.2	0	0	0	109.3	C385	P383-C385 PolarHBondContact O-N 3.48Å
384	S	34.3	Very low	37	Very low	111 Å²	111	123.8 Å²	123.8	78%	0.776	72%	0.722	S	S	*	*			trans	-71.2	118.6	162.8	52.5	0	0	0	0	107.6	P382 D386	P382-S384 VanDerWaalsContact C-N 3.29Å; P382-S384 PolarHBondContact O-N 2.87Å; S384-D386 PolarHBondContact O-N 3.3Å
385	C	31.4	Very low	36.8	Very low	111 Å²	111	125.6 Å²	125.6	75%	0.75	73%	0.733	S	S	*	*			trans	-66	94.1	-178.7	-156.8	0	0	0	0	109.3	P383	P383-C385 PolarHBondContact O-N 3.48Å
386	D	35.2	Very low	37.3	Very low	150 Å²	150	123.1 Å²	123.1	80%	0.802	72%	0.722	S	S	*	*			trans	-139.1	98.1	160.2	-98.1	-30	0	0	0	109.3	S384 S388	S384-D386 PolarHBondContact O-N 3.3Å; D386-S388 PolarHBondContact O-N 3.13Å
387	Q	34.3	Very low	38.2	Very low	184 Å²	184	120.5 Å²	120.5	86%	0.86	71%	0.707	S	S	*	*			trans	-84.1	83.3	175.8	-65.3	179.3	18.1	0	0	109.5
388	S	32.9	Very low	39.6	Very low	101 Å²	101	113.4 Å²	113.4	71%	0.706	68%	0.681	S	S	*	*			trans	-166.9	89.1	159.2	55.5	0	0	0	0	112.3	D386	D386-S388 PolarHBondContact O-N 3.13Å
389	A	33	Very low	41.6	Very low	100 Å²	100	113.7 Å²	113.7	83%	0.826	67%	0.673	S	S	*	*	S	Bend	trans	64.1	144.8	162.1	0	0	0	0	0	118.7
390	P	38.6	Very low	43.6	Very low	109 Å²	109	109.2 Å²	109.2	71%	0.708	65%	0.65	S	S	*	*			cis	-127.1	97.9	-19.5	34.1	-13.3	0	0	0	111.4	Q392	P390-Q392 PolarHBondContact O-N 3.3Å
391	N	34.7	Very low	45.8	Very low	128 Å²	128	101.9 Å²	101.9	68%	0.684	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-3.1	171.9	-93.8	-17.5	0	0	0	114.2	G393	N391-G393 VanDerWaalsContact C-N 3.33Å; N391-G393 PolarHBondContact O-N 3.41Å
392	Q	37.6	Very low	48.5	Very low	142 Å²	142	98 Å²	98	66%	0.664	59%	0.586	S	S	*	*	H	α-helix	trans	-67.4	-28	-180	-96	176.2	-2.9	0	0	113.8	P390 T395 Q396	P390-Q392 PolarHBondContact O-N 3.3Å; Q392-T395 PolarHBondContact O-OG1 3.38Å; Q392-Q396 WeakPolarHBondContact O-CB 3.47Å; Q392-Q396 VanDerWaalsContact O-CD 3.22Å; Q392-Q396 WeakPolarHBondContact O-CG 3.43Å; Q392-Q396 PolarHBondContact O-N 3.13Å
393	G	37.3	Very low	51	Low	47 Å²	47	97.5 Å²	97.5	49%	0.485	57%	0.573	S	S	.	*	H	α-helix	trans	-67	-39.7	-178.2	0	0	0	0	0	113.9	N391 Q396 S397	N391-G393 VanDerWaalsContact C-N 3.33Å; N391-G393 PolarHBondContact O-N 3.41Å; G393-Q396 PolarHBondContact O-N 2.98Å; G393-S397 PolarHBondContact O-N 3.32Å
394	R	36.3	Very low	53.4	Low	183 Å²	183	91.2 Å²	91.2	69%	0.691	53%	0.532	S	S	*	.	H	α-helix	trans	-71	-42.8	-175.9	-78.6	-177.8	-178.4	154.8	-0.6	113.1	Q396 S397	R394-Q396 VanDerWaalsContact C-N 3.31Å; R394-Q396 PolarHBondContact O-N 2.81Å; R394-S397 PolarHBondContact O-OG 3.18Å
395	T	47.5	Very low	56.1	Low	89 Å²	89	86 Å²	86	55%	0.546	50%	0.496	S	S	.	.	H	α-helix	trans	-70.5	-31.6	177.3	54	0	0	0	0	111.6	Q392 L399	Q392-T395 PolarHBondContact O-OG1 3.38Å; T395-L399 WeakPolarHBondContact O-CB 3.37Å; T395-L399 WeakPolarHBondContact O-CD1 3.44Å; T395-L399 VanDerWaalsContact O-CG 3.25Å; T395-L399 WeakPolarHBondContact O-CG 3.43Å; T395-L399 PolarHBondContact O-N 3.42Å
396	Q	54.4	Low	58.9	Low	114 Å²	114	86.2 Å²	86.2	53%	0.533	49%	0.486	S	S	.	.	H	α-helix	trans	-68.3	-35.4	178.1	-75.1	173.1	19.8	0	0	112.8	Q392 G393 R394 A400	Q392-Q396 WeakPolarHBondContact O-CB 3.47Å; Q392-Q396 VanDerWaalsContact O-CD 3.22Å; Q392-Q396 WeakPolarHBondContact O-CG 3.43Å; Q392-Q396 PolarHBondContact O-N 3.13Å; G393-Q396 PolarHBondContact O-N 2.98Å; R394-Q396 VanDerWaalsContact C-N 3.31Å; R394-Q396 PolarHBondContact O-N 2.81Å; Q396-A400 VanDerWaalsContact O-CB 3.26Å; Q396-A400 WeakPolarHBondContact O-CB 3.5Å; Q396-A400 PolarHBondContact O-N 3.06Å
397	S	61.2	Low	61.6	Low	27 Å²	27	82.4 Å²	82.4	19%	0.189	46%	0.463	C	S	.	.	H	α-helix	trans	-67.9	-44.4	179.6	64	0	0	0	0	112.3	G393 R394 A400 L401	G393-S397 PolarHBondContact O-N 3.32Å; R394-S397 PolarHBondContact O-OG 3.18Å; S397-A400 PolarHBondContact O-N 3.2Å; S397-L401 PolarHBondContact O-N 3.21Å
398	G	69.6	Low	64.4	Low	29 Å²	29	73.7 Å²	73.7	30%	0.299	42%	0.422	S	S	.	.	H	α-helix	trans	-62.9	-42.7	176.2	0	0	0	0	0	112.4	L401 A402	G398-L401 PolarHBondContact O-N 2.98Å; G398-A402 PolarHBondContact O-N 3.05Å
399	L	78.4	Confident	67.3	Low	121 Å²	121	68.9 Å²	68.9	63%	0.634	39%	0.389	S	S	*	.	H	α-helix	trans	-64.5	-39.3	174.7	-71.5	170.6	0	0	0	112.4	T395 L401 A402 H403	T395-L399 WeakPolarHBondContact O-CB 3.37Å; T395-L399 WeakPolarHBondContact O-CD1 3.44Å; T395-L399 VanDerWaalsContact O-CG 3.25Å; T395-L399 WeakPolarHBondContact O-CG 3.43Å; T395-L399 PolarHBondContact O-N 3.42Å; L399-L401 VanDerWaalsContact C-N 3.34Å; L399-L401 PolarHBondContact O-N 2.87Å; L399-A402 PolarHBondContact O-N 2.67Å; L399-H403 WeakPolarHBondContact O-CB 3.34Å; L399-H403 PolarHBondContact O-N 2.82Å
400	A	80.3	Confident	70.1	Confident	37 Å²	37	66.5 Å²	66.5	31%	0.306	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-36	176.8	0	0	0	0	0	112.4	L372 Q396 S397 L404	L372-A400 HydrophobicContact CD2-CB 4.26Å; Q396-A400 VanDerWaalsContact O-CB 3.26Å; Q396-A400 WeakPolarHBondContact O-CB 3.5Å; Q396-A400 PolarHBondContact O-N 3.06Å; S397-A400 PolarHBondContact O-N 3.2Å; A400-L404 WeakPolarHBondContact O-CB 3.23Å; A400-L404 PolarHBondContact O-N 3.22Å
401	L	83.4	Confident	72.8	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-47.4	173	179.5	58.4	0	0	0	111.4	Y363 L366 L372 T374 S397 G398 L399 H403 L404 F405	Y363-L401 HydrophobicContact CD2-CD2 4.19Å; Y363-L401 HydrophobicContact CD2-CG 4.15Å; Y363-L401 HydrophobicContact CE1-CD2 4.07Å; Y363-L401 HydrophobicContact CE2-CD2 3.55Å; Y363-L401 HydrophobicContact CE2-CG 3.68Å; Y363-L401 VanDerWaalsContact CZ-CD2 3.48Å; L366-L401 HydrophobicContact CB-CD1 3.61Å; L372-L401 HydrophobicContact CB-CB 4Å; L372-L401 HydrophobicContact CB-CD1 4.2Å; L372-L401 HydrophobicContact CD1-CB 4.24Å; L372-L401 HydrophobicContact CD1-CD1 4.1Å; T374-L401 HydrophobicContact CG2-CD2 3.8Å; S397-L401 PolarHBondContact O-N 3.21Å; G398-L401 PolarHBondContact O-N 2.98Å; L399-L401 VanDerWaalsContact C-N 3.34Å; L399-L401 PolarHBondContact O-N 2.87Å; L401-H403 VanDerWaalsContact C-N 3.31Å; L401-H403 PolarHBondContact O-N 2.97Å; L401-L404 PolarHBondContact O-N 2.67Å; L401-F405 WeakPolarHBondContact O-CB 3.24Å; L401-F405 PolarHBondContact O-N 3.49Å
402	A	85.7	Confident	75.7	Confident	31 Å²	31	60.9 Å²	60.9	26%	0.256	32%	0.321	S	S	.	.	H	α-helix	trans	-59.3	-42.5	176.8	0	0	0	0	0	111.9	G398 L399 F405 E406	G398-A402 PolarHBondContact O-N 3.05Å; L399-A402 PolarHBondContact O-N 2.67Å; A402-F405 PolarHBondContact O-N 3.47Å; A402-E406 WeakPolarHBondContact O-CB 3.36Å; A402-E406 PolarHBondContact O-N 3.48Å
403	H	87.9	Confident	78.4	Confident	101 Å²	101	55.2 Å²	55.2	47%	0.468	30%	0.296	S	S	.	.	H	α-helix	trans	-66.6	-38.2	176.5	-177.3	-120.2	0	0	0	112.5	L399 L401 E406 Q407	L399-H403 WeakPolarHBondContact O-CB 3.34Å; L399-H403 PolarHBondContact O-N 2.82Å; L401-H403 VanDerWaalsContact C-N 3.31Å; L401-H403 PolarHBondContact O-N 2.97Å; H403-E406 PolarHBondContact O-N 3.14Å; H403-Q407 PolarHBondContact CE1-NE2 3.34Å; H403-Q407 PolarHBondContact ND1-NE2 3.34Å; H403-Q407 PolarHBondContact NE2-NE2 3.21Å; H403-Q407 WeakPolarHBondContact O-CG 3.25Å; H403-Q407 PolarHBondContact O-N 2.85Å
404	L	88	Confident	81.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-45.8	173.8	-178.2	51.2	0	0	0	111.4	R230 I234 L366 F370 L372 A400 L401 E406 Q407 V408	R230-L404 HydrophobicContact CG-CD1 4.31Å; I234-L404 HydrophobicContact CD1-CD1 3.43Å; I234-L404 VanDerWaalsContact CD1-CD1 3.43Å; I234-L404 HydrophobicContact CG1-CD1 3.69Å; L366-L404 HydrophobicContact CB-CD2 4.41Å; L366-L404 HydrophobicContact CD1-CG 4.11Å; L366-L404 HydrophobicContact CD2-CD2 3.87Å; L366-L404 HydrophobicContact CD2-CG 3.97Å; L366-L404 HydrophobicContact CG-CG 4.5Å; F370-L404 HydrophobicContact CB-CD2 4.26Å; F370-L404 HydrophobicContact CD2-CD2 3.77Å; F370-L404 HydrophobicContact CE2-CD2 4.34Å; F370-L404 HydrophobicContact CG-CD2 4.07Å; L372-L404 HydrophobicContact CD1-CD2 3.74Å; A400-L404 WeakPolarHBondContact O-CB 3.23Å; A400-L404 PolarHBondContact O-N 3.22Å; L401-L404 PolarHBondContact O-N 2.67Å; L404-E406 VanDerWaalsContact C-N 3.33Å; L404-E406 PolarHBondContact O-N 3.42Å; L404-Q407 PolarHBondContact O-N 3.43Å; L404-V408 WeakPolarHBondContact O-CG2 3.44Å; L404-V408 PolarHBondContact O-N 2.94Å; L404-V408 VanDerWaalsContact O-N 3.13Å
405	F	91.4	Very high	83.9	Confident	1 Å²	1	49.3 Å²	49.3	0%	0.004	27%	0.268	C	S	.	.	H	α-helix	trans	-58.6	-45.6	175.3	177.2	-84	0	0	0	111.4	A359 E362 Y363 L366 L401 A402 Q407 V408 M409 V456 L457	A359-F405 HydrophobicContact CB-CE2 3.94Å; A359-F405 HydrophobicContact CB-CZ 3.59Å; A359-F405 WeakPolarHBondContact O-CE2 3.12Å; E362-F405 HydrophobicContact CB-CE2 4.33Å; E362-F405 HydrophobicContact CG-CD2 4.36Å; E362-F405 HydrophobicContact CG-CE2 4.49Å; Y363-F405 HydrophobicContact CD2-CD2 4.4Å; L366-F405 HydrophobicContact CD1-CB 4.01Å; L366-F405 HydrophobicContact CD1-CD2 4.33Å; L401-F405 WeakPolarHBondContact O-CB 3.24Å; L401-F405 PolarHBondContact O-N 3.49Å; A402-F405 PolarHBondContact O-N 3.47Å; F405-Q407 VanDerWaalsContact C-N 3.32Å; F405-Q407 PolarHBondContact O-N 3.25Å; F405-V408 PolarHBondContact O-N 3.02Å; F405-M409 HydrophobicContact CD1-CB 4.3Å; F405-M409 HydrophobicContact CD1-CG 4.31Å; F405-M409 HydrophobicContact CD2-CG 4.31Å; F405-M409 HydrophobicContact CE1-CB 3.91Å; F405-M409 HydrophobicContact CE1-CG 3.87Å; F405-M409 HydrophobicContact CE2-CG 3.83Å; F405-M409 HydrophobicContact CZ-CB 4.15Å; F405-M409 HydrophobicContact CZ-CE 4.43Å; F405-M409 HydrophobicContact CZ-CG 3.61Å; F405-M409 WeakPolarHBondContact O-CB 3.29Å; F405-M409 PolarHBondContact O-N 3.24Å; F405-V456 HydrophobicContact CB-CG1 4.33Å; F405-V456 HydrophobicContact CD1-CB 3.92Å; F405-V456 HydrophobicContact CD1-CG1 3.17Å; F405-V456 HydrophobicContact CD1-CG2 4.48Å; F405-V456 HydrophobicContact CE1-CB 3.99Å; F405-V456 HydrophobicContact CE1-CG1 3.58Å; F405-V456 HydrophobicContact CG-CB 4.44Å; F405-V456 HydrophobicContact CG-CG1 3.91Å; F405-L457 HydrophobicContact CE1-CD2 4.41Å; F405-L457 HydrophobicContact CZ-CD2 4.44Å
406	E	90.2	Very high	86.1	Confident	116 Å²	116	45.1 Å²	45.1	54%	0.542	24%	0.242	S	C	.	.	H	α-helix	trans	-60	-42.1	178	-173.8	175.4	-172.8	0	0	111.3	A402 H403 L404 V408 M409 S410	A402-E406 WeakPolarHBondContact O-CB 3.36Å; A402-E406 PolarHBondContact O-N 3.48Å; H403-E406 PolarHBondContact O-N 3.14Å; L404-E406 VanDerWaalsContact C-N 3.33Å; L404-E406 PolarHBondContact O-N 3.42Å; E406-V408 VanDerWaalsContact C-N 3.35Å; E406-V408 PolarHBondContact O-N 3.18Å; E406-M409 PolarHBondContact O-N 3.06Å; E406-S410 VanDerWaalsContact O-CA 3.31Å; E406-S410 WeakPolarHBondContact O-CA 3.44Å; E406-S410 WeakPolarHBondContact O-CB 3.24Å; E406-S410 PolarHBondContact O-N 3.27Å
407	Q	92	Very high	87.9	Confident	71 Å²	71	43 Å²	43	33%	0.332	23%	0.232	S	C	.	.	H	α-helix	trans	-60.7	-42.7	176.1	-72	179.6	19.7	0	0	112.4	I234 H403 L404 F405 S410	I234-Q407 HydrophobicContact CG2-CB 3.96Å; H403-Q407 PolarHBondContact CE1-NE2 3.34Å; H403-Q407 PolarHBondContact ND1-NE2 3.34Å; H403-Q407 PolarHBondContact NE2-NE2 3.21Å; H403-Q407 WeakPolarHBondContact O-CG 3.25Å; H403-Q407 PolarHBondContact O-N 2.85Å; L404-Q407 PolarHBondContact O-N 3.43Å; F405-Q407 VanDerWaalsContact C-N 3.32Å; F405-Q407 PolarHBondContact O-N 3.25Å; Q407-S410 PolarHBondContact O-OG 3.26Å
408	V	91.8	Very high	89.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.6	-49.6	177.1	177.1	0	0	0	0	110.9	I234 M237 S238 Y241 E362 L366 L404 F405 E406	I234-V408 HydrophobicContact CB-CG2 4.37Å; I234-V408 HydrophobicContact CG1-CG2 3.95Å; I234-V408 HydrophobicContact CG2-CG2 4.35Å; M237-V408 HydrophobicContact CB-CG1 3.7Å; S238-V408 VanDerWaalsContact CA-O 3.28Å; S238-V408 WeakPolarHBondContact CA-O 3.3Å; S238-V408 VanDerWaalsContact CB-O 3.24Å; S238-V408 WeakPolarHBondContact CB-O 3.4Å; S238-V408 PolarHBondContact OG-O 3.34Å; S238-V408 VanDerWaalsContact OG-O 3.05Å; Y241-V408 HydrophobicContact CD2-CG1 3.91Å; Y241-V408 HydrophobicContact CE2-CG1 3.91Å; E362-V408 HydrophobicContact CG-CG1 4.23Å; L366-V408 HydrophobicContact CD1-CG2 4.35Å; L404-V408 WeakPolarHBondContact O-CG2 3.44Å; L404-V408 PolarHBondContact O-N 2.94Å; L404-V408 VanDerWaalsContact O-N 3.13Å; F405-V408 PolarHBondContact O-N 3.02Å; E406-V408 VanDerWaalsContact C-N 3.35Å; E406-V408 PolarHBondContact O-N 3.18Å
409	M	93.5	Very high	90.5	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-90.4	-12.6	-168.4	-71.1	-67.2	-77.8	0	0	114.6	Y241 F245 L355 T358 F405 E406 R411 S412 L413	Y241-M409 HydrophobicContact CD2-SD 3.84Å; Y241-M409 HydrophobicContact CE2-SD 4.32Å; Y241-M409 HydrophobicContact CG-SD 4.13Å; F245-M409 HydrophobicContact CE2-CE 4.41Å; L355-M409 HydrophobicContact CD1-CE 3.48Å; L355-M409 VanDerWaalsContact CD1-CE 3.48Å; T358-M409 HydrophobicContact CG2-CE 4.39Å; F405-M409 HydrophobicContact CD1-CB 4.3Å; F405-M409 HydrophobicContact CD1-CG 4.31Å; F405-M409 HydrophobicContact CD2-CG 4.31Å; F405-M409 HydrophobicContact CE1-CB 3.91Å; F405-M409 HydrophobicContact CE1-CG 3.87Å; F405-M409 HydrophobicContact CE2-CG 3.83Å; F405-M409 HydrophobicContact CZ-CB 4.15Å; F405-M409 HydrophobicContact CZ-CE 4.43Å; F405-M409 HydrophobicContact CZ-CG 3.61Å; F405-M409 WeakPolarHBondContact O-CB 3.29Å; F405-M409 PolarHBondContact O-N 3.24Å; E406-M409 PolarHBondContact O-N 3.06Å; M409-R411 VanDerWaalsContact C-N 3.35Å; M409-R411 PolarHBondContact O-N 3.15Å; M409-S412 WeakPolarHBondContact O-CA 3.44Å; M409-S412 WeakPolarHBondContact O-CB 3.49Å; M409-S412 PolarHBondContact O-N 3.46Å; M409-L413 HydrophobicContact CB-CD1 4.01Å; M409-L413 HydrophobicContact CB-CG 4.12Å; M409-L413 WeakPolarHBondContact O-CG 3.47Å; M409-L413 PolarHBondContact O-N 3.46Å
410	S	92.8	Very high	90.9	Very high	50 Å²	50	42.2 Å²	42.2	35%	0.35	21%	0.212	S	C	.	.	H	α-helix	trans	-46	-51.2	-174.5	56.2	0	0	0	0	114	E406 Q407 S412 L413 S414	E406-S410 VanDerWaalsContact O-CA 3.31Å; E406-S410 WeakPolarHBondContact O-CA 3.44Å; E406-S410 WeakPolarHBondContact O-CB 3.24Å; E406-S410 PolarHBondContact O-N 3.27Å; Q407-S410 PolarHBondContact O-OG 3.26Å; S410-S412 PolarHBondContact O-N 3.3Å; S410-L413 PolarHBondContact O-N 2.88Å; S410-S414 VanDerWaalsContact O-CB 3.27Å; S410-S414 WeakPolarHBondContact O-CB 3.42Å; S410-S414 PolarHBondContact O-N 3.22Å
411	R	95.2	Very high	91.1	Very high	119 Å²	119	41.5 Å²	41.5	45%	0.449	21%	0.209	S	C	.	.	H	α-helix	trans	-64.7	-41.1	-179.3	-65.2	-177.8	65.9	161.8	1.5	112	S238 Y242 M409 W415	S238-R411 WeakPolarHBondContact OG-CD 3.39Å; Y242-R411 HydrophobicContact CD2-CB 4.18Å; M409-R411 VanDerWaalsContact C-N 3.35Å; M409-R411 PolarHBondContact O-N 3.15Å; R411-W415 WeakPolarHBondContact O-CB 3.43Å; R411-W415 PolarHBondContact O-N 3.38Å
412	S	94.8	Very high	91.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-48.5	178.2	-55.9	0	0	0	0	110.8	Y241 Y242 M409 S410 S414 W415 I416	Y241-S412 VanDerWaalsContact CB-OG 3.26Å; Y241-S412 WeakPolarHBondContact CB-OG 3.38Å; Y242-S412 PolarHBondContact N-OG 3.2Å; Y242-S412 VanDerWaalsContact N-OG 3.17Å; M409-S412 WeakPolarHBondContact O-CA 3.44Å; M409-S412 WeakPolarHBondContact O-CB 3.49Å; M409-S412 PolarHBondContact O-N 3.46Å; S410-S412 PolarHBondContact O-N 3.3Å; S412-S414 PolarHBondContact O-N 3.06Å; S412-W415 PolarHBondContact O-N 3.33Å; S412-I416 VanDerWaalsContact O-CG1 3.29Å; S412-I416 WeakPolarHBondContact O-CG1 3.34Å; S412-I416 PolarHBondContact O-N 3.49Å
413	L	94.8	Very high	90.9	Very high	24 Å²	24	48 Å²	48	13%	0.126	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-45.6	177.5	-66.9	175.4	0	0	0	111.4	L355 M409 S410 W415 I416 H417 L457 F460	L355-L413 HydrophobicContact CD1-CD2 3.84Å; L355-L413 HydrophobicContact CD2-CD2 3.87Å; L355-L413 HydrophobicContact CG-CD2 4.4Å; M409-L413 HydrophobicContact CB-CD1 4.01Å; M409-L413 HydrophobicContact CB-CG 4.12Å; M409-L413 WeakPolarHBondContact O-CG 3.47Å; M409-L413 PolarHBondContact O-N 3.46Å; S410-L413 PolarHBondContact O-N 2.88Å; L413-W415 VanDerWaalsContact C-N 3.3Å; L413-W415 PolarHBondContact O-N 3.45Å; L413-I416 PolarHBondContact O-N 2.86Å; L413-H417 WeakPolarHBondContact O-CB 3.45Å; L413-H417 PolarHBondContact O-N 3.23Å; L413-L457 HydrophobicContact CD2-CD2 3.93Å; L413-F460 HydrophobicContact CB-CD2 4.07Å; L413-F460 HydrophobicContact CB-CE2 4.09Å; L413-F460 HydrophobicContact CD2-CD1 4.24Å; L413-F460 HydrophobicContact CD2-CD2 3.9Å; L413-F460 HydrophobicContact CD2-CE1 4.38Å; L413-F460 HydrophobicContact CD2-CE2 4.03Å; L413-F460 HydrophobicContact CD2-CG 4Å; L413-F460 HydrophobicContact CD2-CZ 4.28Å; L413-F460 HydrophobicContact CG-CD2 4.45Å; L413-F460 WeakPolarHBondContact O-CE2 3.25Å
414	S	94.3	Very high	90.6	Very high	61 Å²	61	43.3 Å²	43.3	43%	0.427	22%	0.219	S	C	.	.	H	α-helix	trans	-59.7	-41.6	176.2	-172.4	0	0	0	0	111.9	S410 S412 K418	S410-S414 VanDerWaalsContact O-CB 3.27Å; S410-S414 WeakPolarHBondContact O-CB 3.42Å; S410-S414 PolarHBondContact O-N 3.22Å; S412-S414 PolarHBondContact O-N 3.06Å; S414-K418 WeakPolarHBondContact O-CG 3.49Å; S414-K418 PolarHBondContact O-N 3.32Å; S414-K418 VanDerWaalsContact O-N 3.1Å
415	W	94.4	Very high	90.3	Very high	45 Å²	45	43.5 Å²	43.5	17%	0.17	22%	0.22	C	C	.	.	H	α-helix	trans	-67.4	-46.2	177.2	-172.9	83.1	0	0	0	112.1	Y242 F245 K246 I351 R411 S412 L413 H417 K418 F419	Y242-W415 HydrophobicContact CD2-CB 4.06Å; Y242-W415 HydrophobicContact CD2-CG 4.39Å; Y242-W415 HydrophobicContact CE2-CB 3.82Å; Y242-W415 AromaticContact CE2-CD1 3.74Å; Y242-W415 AromaticContact CE2-CG 3.86Å; Y242-W415 HydrophobicContact CE2-CG 3.86Å; F245-W415 HydrophobicContact CB-CE3 4.12Å; F245-W415 HydrophobicContact CB-CZ3 4.23Å; F245-W415 WeakPolarHBondContact O-CH2 3.44Å; F245-W415 WeakPolarHBondContact O-CZ3 3.29Å; K246-W415 HydrophobicContact CB-CD2 4.4Å; K246-W415 HydrophobicContact CB-CZ2 4.18Å; K246-W415 HydrophobicContact CG-CZ2 4.07Å; I351-W415 HydrophobicContact CD1-CZ3 4.27Å; R411-W415 WeakPolarHBondContact O-CB 3.43Å; R411-W415 PolarHBondContact O-N 3.38Å; S412-W415 PolarHBondContact O-N 3.33Å; L413-W415 VanDerWaalsContact C-N 3.3Å; L413-W415 PolarHBondContact O-N 3.45Å; W415-H417 VanDerWaalsContact C-N 3.32Å; W415-H417 PolarHBondContact O-N 3.01Å; W415-K418 PolarHBondContact O-N 3.32Å; W415-F419 HydrophobicContact CD2-CB 4.48Å; W415-F419 HydrophobicContact CE3-CB 4.24Å; W415-F419 HydrophobicContact CH2-CB 3.94Å; W415-F419 HydrophobicContact CH2-CD1 4.26Å; W415-F419 AromaticContact CH2-CD2 3.72Å; W415-F419 HydrophobicContact CH2-CD2 3.72Å; W415-F419 HydrophobicContact CH2-CE2 4.28Å; W415-F419 AromaticContact CH2-CG 3.7Å; W415-F419 HydrophobicContact CH2-CG 3.7Å; W415-F419 HydrophobicContact CZ2-CB 4.21Å; W415-F419 AromaticContact CZ2-CD2 3.99Å; W415-F419 HydrophobicContact CZ2-CD2 3.99Å; W415-F419 HydrophobicContact CZ2-CG 4.23Å; W415-F419 HydrophobicContact CZ3-CB 3.96Å; W415-F419 HydrophobicContact CZ3-CD1 4.31Å; W415-F419 HydrophobicContact CZ3-CD2 4.47Å; W415-F419 AromaticContact CZ3-CG 4Å; W415-F419 HydrophobicContact CZ3-CG 4Å; W415-F419 WeakPolarHBondContact O-CB 3.25Å; W415-F419 PolarHBondContact O-N 2.85Å
416	I	94.4	Very high	89.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-41.5	177.4	-64.9	168.2	0	0	0	110.2	F245 L355 S412 L413 K418 F419 T420 F460	F245-I416 HydrophobicContact CB-CD1 4.35Å; F245-I416 HydrophobicContact CB-CG1 4.32Å; F245-I416 HydrophobicContact CD1-CD1 3.77Å; F245-I416 HydrophobicContact CD1-CG1 4.41Å; F245-I416 HydrophobicContact CD2-CD1 4.11Å; F245-I416 HydrophobicContact CE1-CD1 4.08Å; F245-I416 HydrophobicContact CE2-CD1 4.4Å; F245-I416 HydrophobicContact CG-CD1 3.81Å; F245-I416 HydrophobicContact CG-CG1 4.31Å; F245-I416 HydrophobicContact CZ-CD1 4.4Å; L355-I416 HydrophobicContact CB-CD1 4.16Å; L355-I416 HydrophobicContact CD1-CD1 3.73Å; L355-I416 HydrophobicContact CD2-CD1 3.88Å; L355-I416 HydrophobicContact CD2-CG2 4.46Å; L355-I416 HydrophobicContact CG-CD1 4.12Å; S412-I416 VanDerWaalsContact O-CG1 3.29Å; S412-I416 WeakPolarHBondContact O-CG1 3.34Å; S412-I416 PolarHBondContact O-N 3.49Å; L413-I416 PolarHBondContact O-N 2.86Å; I416-K418 VanDerWaalsContact C-N 3.35Å; I416-K418 PolarHBondContact O-N 2.94Å; I416-F419 PolarHBondContact O-N 2.9Å; I416-T420 WeakPolarHBondContact O-CB 3.44Å; I416-T420 PolarHBondContact O-N 2.9Å; I416-T420 PolarHBondContact O-OG1 3.13Å; I416-T420 VanDerWaalsContact O-OG1 3.1Å; I416-F460 HydrophobicContact CB-CZ 4.22Å; I416-F460 HydrophobicContact CG2-CZ 3.88Å
417	H	92.5	Very high	89.1	Confident	71 Å²	71	42.2 Å²	42.2	33%	0.329	22%	0.224	S	C	.	.	H	α-helix	trans	-57.4	-47.8	175.5	-171.6	-84.7	0	0	0	111.8	L413 W415 G421 F460 M464	L413-H417 WeakPolarHBondContact O-CB 3.45Å; L413-H417 PolarHBondContact O-N 3.23Å; W415-H417 VanDerWaalsContact C-N 3.32Å; W415-H417 PolarHBondContact O-N 3.01Å; H417-G421 PolarHBondContact O-N 2.82Å; H417-F460 HydrophobicContact CB-CE2 4Å; H417-M464 HydrophobicContact CB-CE 4.47Å
418	K	92.4	Very high	88.4	Confident	136 Å²	136	39 Å²	39	59%	0.591	21%	0.209	S	C	*	.	H	α-helix	trans	-65.7	-42.6	176.6	-71.5	178.8	-177.7	-176.4	0	112.1	S414 W415 I416 G421 T422	S414-K418 WeakPolarHBondContact O-CG 3.49Å; S414-K418 PolarHBondContact O-N 3.32Å; S414-K418 VanDerWaalsContact O-N 3.1Å; W415-K418 PolarHBondContact O-N 3.32Å; I416-K418 VanDerWaalsContact C-N 3.35Å; I416-K418 PolarHBondContact O-N 2.94Å; K418-G421 PolarHBondContact O-N 3.15Å; K418-T422 VanDerWaalsContact O-CB 3.24Å; K418-T422 WeakPolarHBondContact O-CB 3.11Å; K418-T422 PolarHBondContact O-N 3.27Å; K418-T422 PolarHBondContact O-OG1 3.16Å
419	F	91.8	Very high	87.7	Confident	23 Å²	23	40.7 Å²	40.7	10%	0.101	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-49.4	178.9	177.9	-103.3	0	0	0	111.3	I351 W415 I416 F423 M424	I351-F419 HydrophobicContact CD1-CD1 3.61Å; I351-F419 HydrophobicContact CD1-CE1 3.66Å; W415-F419 HydrophobicContact CD2-CB 4.48Å; W415-F419 HydrophobicContact CE3-CB 4.24Å; W415-F419 HydrophobicContact CH2-CB 3.94Å; W415-F419 HydrophobicContact CH2-CD1 4.26Å; W415-F419 AromaticContact CH2-CD2 3.72Å; W415-F419 HydrophobicContact CH2-CD2 3.72Å; W415-F419 HydrophobicContact CH2-CE2 4.28Å; W415-F419 AromaticContact CH2-CG 3.7Å; W415-F419 HydrophobicContact CH2-CG 3.7Å; W415-F419 HydrophobicContact CZ2-CB 4.21Å; W415-F419 AromaticContact CZ2-CD2 3.99Å; W415-F419 HydrophobicContact CZ2-CD2 3.99Å; W415-F419 HydrophobicContact CZ2-CG 4.23Å; W415-F419 HydrophobicContact CZ3-CB 3.96Å; W415-F419 HydrophobicContact CZ3-CD1 4.31Å; W415-F419 HydrophobicContact CZ3-CD2 4.47Å; W415-F419 AromaticContact CZ3-CG 4Å; W415-F419 HydrophobicContact CZ3-CG 4Å; W415-F419 WeakPolarHBondContact O-CB 3.25Å; W415-F419 PolarHBondContact O-N 2.85Å; I416-F419 PolarHBondContact O-N 2.9Å; F419-F423 HydrophobicContact CD2-CB 4.19Å; F419-F423 HydrophobicContact CD2-CD1 4.4Å; F419-F423 HydrophobicContact CE1-CD1 4.42Å; F419-F423 HydrophobicContact CE2-CB 4.19Å; F419-F423 AromaticContact CE2-CD1 3.62Å; F419-F423 HydrophobicContact CE2-CD1 3.62Å; F419-F423 HydrophobicContact CE2-CE1 4.34Å; F419-F423 HydrophobicContact CE2-CG 4.04Å; F419-F423 AromaticContact CZ-CD1 3.64Å; F419-F423 HydrophobicContact CZ-CD1 3.64Å; F419-F423 HydrophobicContact CZ-CE1 4.16Å; F419-F423 HydrophobicContact CZ-CG 4.49Å; F419-F423 WeakPolarHBondContact O-CA 3.37Å; F419-F423 VanDerWaalsContact O-CB 3.23Å; F419-F423 WeakPolarHBondContact O-CB 3.18Å; F419-F423 PolarHBondContact O-N 3.34Å; F419-M424 HydrophobicContact CD1-CG 4.3Å; F419-M424 HydrophobicContact CD1-SD 4.45Å; F419-M424 HydrophobicContact CE1-CG 3.81Å; F419-M424 HydrophobicContact CE1-SD 3.75Å; F419-M424 HydrophobicContact CZ-CG 4.27Å; F419-M424 HydrophobicContact CZ-SD 4.48Å; F419-M424 PolarHBondContact O-N 3.27Å
420	T	86.8	Confident	87	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-62.1	-47.2	176.8	-59.4	0	0	0	0	110.8	F348 H352 I416 M424 I425 M464	F348-T420 HydrophobicContact CD2-CG2 4.14Å; F348-T420 HydrophobicContact CE2-CG2 3.45Å; F348-T420 VanDerWaalsContact CE2-CG2 3.45Å; F348-T420 HydrophobicContact CZ-CG2 4.28Å; H352-T420 PolarHBondContact NE2-OG1 3.35Å; H352-T420 VanDerWaalsContact NE2-OG1 3.13Å; I416-T420 WeakPolarHBondContact O-CB 3.44Å; I416-T420 PolarHBondContact O-N 2.9Å; I416-T420 PolarHBondContact O-OG1 3.13Å; I416-T420 VanDerWaalsContact O-OG1 3.1Å; T420-M424 HydrophobicContact CG2-CE 4.06Å; T420-M424 PolarHBondContact O-N 3.15Å; T420-I425 HydrophobicContact CG2-CD1 4.13Å; T420-I425 HydrophobicContact CG2-CG1 4.17Å; T420-I425 WeakPolarHBondContact O-CB 3.38Å; T420-I425 VanDerWaalsContact O-CG1 3.29Å; T420-I425 WeakPolarHBondContact O-CG1 3.47Å; T420-I425 PolarHBondContact O-N 2.62Å; T420-M464 HydrophobicContact CG2-CE 4.02Å; T420-M464 HydrophobicContact CG2-CG 4.36Å; T420-M464 HydrophobicContact CG2-SD 3.6Å
421	G	85.2	Confident	86.5	Confident	23 Å²	23	41 Å²	41	24%	0.237	22%	0.217	C	C	.	.	I	π-helix	trans	-65.6	-48.7	-178.6	0	0	0	0	0	114.9	H417 K418	H417-G421 PolarHBondContact O-N 2.82Å; K418-G421 PolarHBondContact O-N 3.15Å
422	T	83.8	Confident	86	Confident	112 Å²	112	35.4 Å²	35.4	69%	0.687	20%	0.196	S	C	*	.	I	π-helix	trans	-83.2	-39.8	-174.7	-56.9	0	0	0	0	112.3	K418 S426	K418-T422 VanDerWaalsContact O-CB 3.24Å; K418-T422 WeakPolarHBondContact O-CB 3.11Å; K418-T422 PolarHBondContact O-N 3.27Å; K418-T422 PolarHBondContact O-OG1 3.16Å; T422-S426 WeakPolarHBondContact O-CB 3.29Å
423	F	81.7	Confident	85.4	Confident	56 Å²	56	35.5 Å²	35.5	25%	0.246	20%	0.197	C	C	.	.	I	π-helix	trans	-97.3	-66.1	-173.5	-179.5	-100.7	0	0	0	111.1	T253 Q256 F419 I425 S426 S427	T253-F423 HydrophobicContact CG2-CE1 3.99Å; T253-F423 HydrophobicContact CG2-CE2 3.54Å; T253-F423 HydrophobicContact CG2-CZ 3.23Å; T253-F423 WeakPolarHBondContact OG1-CE1 3.25Å; T253-F423 VanDerWaalsContact OG1-CZ 3.29Å; T253-F423 WeakPolarHBondContact OG1-CZ 3.38Å; Q256-F423 VanDerWaalsContact OE1-CE1 3.32Å; F419-F423 HydrophobicContact CD2-CB 4.19Å; F419-F423 HydrophobicContact CD2-CD1 4.4Å; F419-F423 HydrophobicContact CE1-CD1 4.42Å; F419-F423 HydrophobicContact CE2-CB 4.19Å; F419-F423 AromaticContact CE2-CD1 3.62Å; F419-F423 HydrophobicContact CE2-CD1 3.62Å; F419-F423 HydrophobicContact CE2-CE1 4.34Å; F419-F423 HydrophobicContact CE2-CG 4.04Å; F419-F423 AromaticContact CZ-CD1 3.64Å; F419-F423 HydrophobicContact CZ-CD1 3.64Å; F419-F423 HydrophobicContact CZ-CE1 4.16Å; F419-F423 HydrophobicContact CZ-CG 4.49Å; F419-F423 WeakPolarHBondContact O-CA 3.37Å; F419-F423 VanDerWaalsContact O-CB 3.23Å; F419-F423 WeakPolarHBondContact O-CB 3.18Å; F419-F423 PolarHBondContact O-N 3.34Å; F423-I425 PolarHBondContact O-N 3.34Å; F423-S426 PolarHBondContact O-N 3.15Å; F423-S427 PolarHBondContact O-N 2.91Å; F423-S427 PolarHBondContact O-OG 2.69Å
424	M	82	Confident	84.9	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.01	19%	0.191	C	C	.	.	I	π-helix	trans	-67.4	-45.4	-168.7	-61.1	-153.6	-48	0	0	113.2	I344 F348 I351 F419 T420 S426 S427 C428	I344-M424 HydrophobicContact CD1-CB 3.88Å; I344-M424 HydrophobicContact CD1-CG 3.94Å; I344-M424 HydrophobicContact CD1-SD 4.11Å; I344-M424 HydrophobicContact CG1-CB 4.34Å; F348-M424 HydrophobicContact CB-CE 3.78Å; F348-M424 HydrophobicContact CB-SD 4.5Å; F348-M424 HydrophobicContact CD2-CE 3.35Å; F348-M424 HydrophobicContact CE2-CE 4.11Å; F348-M424 HydrophobicContact CG-CE 3.79Å; I351-M424 HydrophobicContact CG2-CE 3.76Å; I351-M424 HydrophobicContact CG2-SD 4.27Å; F419-M424 HydrophobicContact CD1-CG 4.3Å; F419-M424 HydrophobicContact CD1-SD 4.45Å; F419-M424 HydrophobicContact CE1-CG 3.81Å; F419-M424 HydrophobicContact CE1-SD 3.75Å; F419-M424 HydrophobicContact CZ-CG 4.27Å; F419-M424 HydrophobicContact CZ-SD 4.48Å; F419-M424 PolarHBondContact O-N 3.27Å; T420-M424 HydrophobicContact CG2-CE 4.06Å; T420-M424 PolarHBondContact O-N 3.15Å; M424-S426 VanDerWaalsContact C-N 3.31Å; M424-S426 PolarHBondContact O-N 3.08Å; M424-S427 PolarHBondContact O-N 3.2Å; M424-C428 PolarHBondContact O-N 3.16Å; M424-C428 VanDerWaalsContact O-N 3.15Å; M424-C428 PolarHBondContact O-SG 2.79Å
425	I	80.1	Confident	84.7	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-35.1	177.7	-67.7	178.4	0	0	0	111.3	T420 F423 S427 S429 L435 T467 L468 R471	T420-I425 HydrophobicContact CG2-CD1 4.13Å; T420-I425 HydrophobicContact CG2-CG1 4.17Å; T420-I425 WeakPolarHBondContact O-CB 3.38Å; T420-I425 VanDerWaalsContact O-CG1 3.29Å; T420-I425 WeakPolarHBondContact O-CG1 3.47Å; T420-I425 PolarHBondContact O-N 2.62Å; F423-I425 PolarHBondContact O-N 3.34Å; I425-S427 VanDerWaalsContact C-N 3.31Å; I425-S429 PolarHBondContact O-N 2.68Å; I425-S429 VanDerWaalsContact O-N 3.15Å; I425-L435 HydrophobicContact CG2-CD2 4.25Å; I425-T467 HydrophobicContact CD1-CG2 4.31Å; I425-L468 HydrophobicContact CD1-CD2 3.48Å; I425-L468 VanDerWaalsContact CD1-CD2 3.48Å; I425-L468 HydrophobicContact CD1-CG 3.94Å; I425-L468 HydrophobicContact CG1-CD2 3.61Å; I425-R471 HydrophobicContact CG2-CB 4.4Å; I425-R471 HydrophobicContact CG2-CG 3.77Å
426	S	80.3	Confident	84.3	Confident	65 Å²	65	29.4 Å²	29.4	46%	0.455	16%	0.163	S	C	.	.	H	α-helix	trans	-70.5	-29.4	176	-169	0	0	0	0	112.5	T422 F423 M424 S429	T422-S426 WeakPolarHBondContact O-CB 3.29Å; F423-S426 PolarHBondContact O-N 3.15Å; M424-S426 VanDerWaalsContact C-N 3.31Å; M424-S426 PolarHBondContact O-N 3.08Å; S426-S429 PolarHBondContact O-OG 3.18Å; S426-S429 VanDerWaalsContact O-OG 3.08Å
427	S	77.6	Confident	83.9	Confident	26 Å²	26	29.4 Å²	29.4	18%	0.182	16%	0.163	C	C	.	.	H	α-helix	trans	-73.6	-36.8	175.7	-67.7	0	0	0	0	113	Q256 F423 M424 I425 S429	Q256-S427 PolarHBondContact NE2-OG 3.15Å; Q256-S427 VanDerWaalsContact NE2-OG 3.16Å; F423-S427 PolarHBondContact O-N 2.91Å; F423-S427 PolarHBondContact O-OG 2.69Å; M424-S427 PolarHBondContact O-N 3.2Å; I425-S427 VanDerWaalsContact C-N 3.31Å; S427-S429 VanDerWaalsContact C-N 3.34Å
428	C	77.2	Confident	83.8	Confident	3 Å²	3	26 Å²	26	2%	0.02	15%	0.148	C	C	.	.	S	Bend	trans	-90.9	10.2	177.5	64.5	0	0	0	0	114	I344 M424 H430 D431 L435	I344-C428 HydrophobicContact CG1-CB 4.33Å; I344-C428 HydrophobicContact CG2-CB 3.6Å; M424-C428 PolarHBondContact O-N 3.16Å; M424-C428 VanDerWaalsContact O-N 3.15Å; M424-C428 PolarHBondContact O-SG 2.79Å; C428-H430 PolarHBondContact O-N 3.29Å; C428-D431 PolarHBondContact O-N 3.29Å; C428-L435 HydrophobicContact CB-CD2 4.49Å; C428-L435 HydrophobicContact CB-CG 4.48Å; C428-L435 WeakPolarHBondContact SG-CD2 3.48Å
429	S	76.9	Confident	83.7	Confident	36 Å²	36	19.6 Å²	19.6	25%	0.252	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-20.4	-176.5	63	0	0	0	0	114.2	I425 S426 S427 R475	I425-S429 PolarHBondContact O-N 2.68Å; I425-S429 VanDerWaalsContact O-N 3.15Å; S426-S429 PolarHBondContact O-OG 3.18Å; S426-S429 VanDerWaalsContact O-OG 3.08Å; S427-S429 VanDerWaalsContact C-N 3.34Å; S429-R475 WeakPolarHBondContact O-CD 3.42Å
430	H	77.5	Confident	83.5	Confident	48 Å²	48	19.2 Å²	19.2	22%	0.222	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-11	179.9	-49.6	98.2	0	0	0	112.8	E262 C428 R475	E262-H430 HydrophobicContact CB-CB 4.42Å; C428-H430 PolarHBondContact O-N 3.29Å; H430-R475 VanDerWaalsContact C-NE 3.31Å; H430-R475 PolarHBondContact O-NE 3.21Å; H430-R475 PolarHBondContact O-NH2 2.84Å
431	D	83.2	Confident	83.6	Confident	7 Å²	7	19.2 Å²	19.2	4%	0.037	12%	0.118	C	C	.	.			trans	-117	100.7	-176.8	179.3	4.4	0	0	0	110.7	L309 R315 C428 I433 G434 L435	L309-D431 HydrophobicContact CD1-CB 3.93Å; R315-D431 IonicContact CZ-OD2 3.4Å; R315-D431 IonicContact NH1-OD1 2.75Å; R315-D431 IonicContact NH1-OD2 3.34Å; R315-D431 PolarHBondContact NH1-OD2 3.11Å; R315-D431 IonicContact NH2-OD2 2.75Å; R315-D431 PolarHBondContact NH2-OD2 2.98Å; C428-D431 PolarHBondContact O-N 3.29Å; D431-I433 VanDerWaalsContact C-N 3.27Å; D431-I433 PolarHBondContact O-N 3.4Å; D431-I433 PolarHBondContact OD1-N 3.28Å; D431-G434 PolarHBondContact O-N 3.33Å; D431-G434 PolarHBondContact OD1-N 3.01Å; D431-G434 WeakPolarHBondContact OD2-CA 3.49Å; D431-G434 PolarHBondContact OD2-N 2.88Å; D431-L435 WeakPolarHBondContact O-CG 3.32Å; D431-L435 PolarHBondContact O-N 3.2Å
432	A	84.2	Confident	83.8	Confident	2 Å²	2	18.1 Å²	18.1	2%	0.017	11%	0.107	C	C	.	.	H	α-helix	trans	-62.4	-35.2	178.3	0	0	0	0	0	112.3	L436 R475 L476	A432-L436 WeakPolarHBondContact O-CB 3.47Å; A432-L436 WeakPolarHBondContact O-CG 3.37Å; A432-L436 PolarHBondContact O-N 2.99Å; A432-R475 HydrophobicContact CB-CB 4.46Å; A432-R475 HydrophobicContact CB-CG 3.9Å; A432-L476 HydrophobicContact CB-CD2 4.2Å
433	I	83.2	Confident	84	Confident	3 Å²	3	13.9 Å²	13.9	2%	0.015	8%	0.079	C	C	.	.	H	α-helix	trans	-74.1	-43.9	-178.4	-61.2	174.3	0	0	0	109.5	L309 F310 L312 D431 L435 L436 I437 L543 I550	L309-I433 WeakPolarHBondContact O-CD1 3.48Å; F310-I433 WeakPolarHBondContact O-CD1 3.48Å; L312-I433 HydrophobicContact CD1-CG2 3.85Å; D431-I433 VanDerWaalsContact C-N 3.27Å; D431-I433 PolarHBondContact O-N 3.4Å; D431-I433 PolarHBondContact OD1-N 3.28Å; I433-L435 VanDerWaalsContact C-N 3.31Å; I433-L435 PolarHBondContact O-N 3.43Å; I433-L436 CarbonylContact O-C 3.36Å; I433-L436 PolarHBondContact O-N 3.21Å; I433-L436 VanDerWaalsContact O-N 3.12Å; I433-I437 HydrophobicContact CG2-CD1 3.98Å; I433-I437 HydrophobicContact CG2-CG1 4.36Å; I433-I437 VanDerWaalsContact O-CG1 3.31Å; I433-I437 WeakPolarHBondContact O-CG1 3.22Å; I433-I437 PolarHBondContact O-N 3.35Å; I433-L543 HydrophobicContact CD1-CD1 4.32Å; I433-L543 HydrophobicContact CG1-CD1 4.22Å; I433-I550 HydrophobicContact CG2-CD1 4.37Å
434	G	84.5	Confident	84.2	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-57.5	-42.7	173.7	0	0	0	0	0	112.4	D431 I437 C438	D431-G434 PolarHBondContact O-N 3.33Å; D431-G434 PolarHBondContact OD1-N 3.01Å; D431-G434 WeakPolarHBondContact OD2-CA 3.49Å; D431-G434 PolarHBondContact OD2-N 2.88Å; G434-I437 PolarHBondContact O-N 2.75Å; G434-C438 PolarHBondContact O-N 3.5Å; G434-C438 PolarHBondContact O-SG 2.98Å
435	L	88.4	Confident	84.6	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.6	-43.8	173.1	-75.6	167	0	0	0	112.2	I425 C428 D431 I433 C438 L439 L468 R471 V472	I425-L435 HydrophobicContact CG2-CD2 4.25Å; C428-L435 HydrophobicContact CB-CD2 4.49Å; C428-L435 HydrophobicContact CB-CG 4.48Å; C428-L435 WeakPolarHBondContact SG-CD2 3.48Å; D431-L435 WeakPolarHBondContact O-CG 3.32Å; D431-L435 PolarHBondContact O-N 3.2Å; I433-L435 VanDerWaalsContact C-N 3.31Å; I433-L435 PolarHBondContact O-N 3.43Å; L435-C438 WeakPolarHBondContact O-CB 3.5Å; L435-C438 PolarHBondContact O-N 3.09Å; L435-L439 WeakPolarHBondContact O-CB 3.37Å; L435-L439 PolarHBondContact O-N 3.38Å; L435-L468 HydrophobicContact CD2-CD2 3.88Å; L435-R471 HydrophobicContact CD1-CB 4.19Å; L435-R471 HydrophobicContact CD2-CB 4.34Å; L435-V472 HydrophobicContact CB-CG2 3.59Å
436	L	86.9	Confident	85	Confident	2 Å²	2	11.7 Å²	11.7	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-66.4	-37.1	176.7	-81	169	0	0	0	113.1	A432 I433 L439 Q440 W469 V472 L547 I550 I600	A432-L436 WeakPolarHBondContact O-CB 3.47Å; A432-L436 WeakPolarHBondContact O-CG 3.37Å; A432-L436 PolarHBondContact O-N 2.99Å; I433-L436 CarbonylContact O-C 3.36Å; I433-L436 PolarHBondContact O-N 3.21Å; I433-L436 VanDerWaalsContact O-N 3.12Å; L436-L439 WeakPolarHBondContact O-CB 3.4Å; L436-L439 PolarHBondContact O-N 3.08Å; L436-Q440 WeakPolarHBondContact O-CG 3.43Å; L436-Q440 PolarHBondContact O-N 3.28Å; L436-W469 HydrophobicContact CD2-CH2 4.33Å; L436-W469 HydrophobicContact CD2-CZ3 4.26Å; L436-V472 HydrophobicContact CD1-CG1 4.15Å; L436-V472 HydrophobicContact CD2-CG1 3.79Å; L436-V472 HydrophobicContact CD2-CG2 4.08Å; L436-V472 HydrophobicContact CG-CG1 3.77Å; L436-V472 HydrophobicContact CG-CG2 3.95Å; L436-L547 HydrophobicContact CD1-CD2 3.22Å; L436-I550 HydrophobicContact CB-CG2 3.88Å; L436-I600 HydrophobicContact CD1-CD1 4.49Å; L436-I600 HydrophobicContact CD2-CD1 3.87Å
437	I	86.7	Confident	85.2	Confident	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-62.7	-46.3	172.3	-67.3	166.5	0	0	0	109.4	L312 R315 L320 E345 I433 G434 L439 Q440 L441 I550	L312-I437 HydrophobicContact CD1-CD1 3.87Å; L312-I437 HydrophobicContact CD1-CG1 4.35Å; R315-I437 HydrophobicContact CB-CD1 3.79Å; L320-I437 HydrophobicContact CD1-CG2 4.46Å; L320-I437 HydrophobicContact CG-CG2 4.47Å; E345-I437 HydrophobicContact CB-CG2 3.85Å; E345-I437 HydrophobicContact CG-CG2 4.31Å; I433-I437 HydrophobicContact CG2-CD1 3.98Å; I433-I437 HydrophobicContact CG2-CG1 4.36Å; I433-I437 VanDerWaalsContact O-CG1 3.31Å; I433-I437 WeakPolarHBondContact O-CG1 3.22Å; I433-I437 PolarHBondContact O-N 3.35Å; G434-I437 PolarHBondContact O-N 2.75Å; I437-L439 PolarHBondContact O-N 2.86Å; I437-Q440 PolarHBondContact O-N 3.07Å; I437-L441 HydrophobicContact CG2-CD1 4.06Å; I437-L441 HydrophobicContact CG2-CG 4.37Å; I437-L441 WeakPolarHBondContact O-CB 3.43Å; I437-L441 VanDerWaalsContact O-CG 3.24Å; I437-L441 WeakPolarHBondContact O-CG 3.39Å; I437-L441 PolarHBondContact O-N 3.32Å; I437-I550 HydrophobicContact CD1-CD1 4.47Å; I437-I550 HydrophobicContact CG1-CD1 3.79Å
438	C	89.4	Confident	85.6	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-58.1	-40	175.2	-66.2	0	0	0	0	112	F348 G434 L435 L441 L442 L468	F348-C438 HydrophobicContact CD1-CB 4.09Å; F348-C438 HydrophobicContact CD2-CB 3.89Å; F348-C438 HydrophobicContact CE1-CB 4.09Å; F348-C438 WeakPolarHBondContact CE1-O 3.48Å; F348-C438 HydrophobicContact CE2-CB 3.94Å; F348-C438 HydrophobicContact CG-CB 4.04Å; F348-C438 HydrophobicContact CZ-CB 4.06Å; G434-C438 PolarHBondContact O-N 3.5Å; G434-C438 PolarHBondContact O-SG 2.98Å; L435-C438 WeakPolarHBondContact O-CB 3.5Å; L435-C438 PolarHBondContact O-N 3.09Å; C438-L441 WeakPolarHBondContact O-CB 3.42Å; C438-L441 PolarHBondContact O-N 2.87Å; C438-L442 PolarHBondContact O-N 2.9Å; C438-L442 VanDerWaalsContact O-N 3.15Å; C438-L468 HydrophobicContact CB-CD1 4.29Å; C438-L468 HydrophobicContact CB-CD2 4.45Å
439	L	89.7	Confident	86.1	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-63.8	-48.5	176.4	-167.2	151.6	0	0	0	111.6	L435 L436 I437 L441 L442 H443 T465 L468 W469	L435-L439 WeakPolarHBondContact O-CB 3.37Å; L435-L439 PolarHBondContact O-N 3.38Å; L436-L439 WeakPolarHBondContact O-CB 3.4Å; L436-L439 PolarHBondContact O-N 3.08Å; I437-L439 PolarHBondContact O-N 2.86Å; L439-L441 VanDerWaalsContact C-N 3.27Å; L439-L441 PolarHBondContact O-N 2.93Å; L439-L442 WeakPolarHBondContact O-CB 3.24Å; L439-L442 PolarHBondContact O-N 3.44Å; L439-L442 VanDerWaalsContact O-N 3.15Å; L439-H443 WeakPolarHBondContact CD2-CE1 3.49Å; L439-H443 PolarHBondContact O-N 3.2Å; L439-T465 HydrophobicContact CD2-CG2 4.27Å; L439-T465 HydrophobicContact CG-CG2 4.14Å; L439-L468 HydrophobicContact CB-CB 4.39Å; L439-L468 HydrophobicContact CB-CD1 4.26Å; L439-L468 HydrophobicContact CD1-CB 3.99Å; L439-L468 HydrophobicContact CG-CB 4.39Å; L439-W469 HydrophobicContact CD1-CB 4.4Å; L439-W469 HydrophobicContact CD1-CD2 3.43Å; L439-W469 VanDerWaalsContact CD1-CD2 3.43Å; L439-W469 VanDerWaalsContact CD1-CE2 3.4Å; L439-W469 HydrophobicContact CD1-CE3 4.03Å; L439-W469 HydrophobicContact CD1-CG 3.6Å; L439-W469 HydrophobicContact CD1-CZ2 4.01Å; L439-W469 HydrophobicContact CD2-CZ2 3.85Å
440	Q	87.7	Confident	86.5	Confident	15 Å²	15	14.7 Å²	14.7	7%	0.07	7%	0.065	C	C	.	.	H	α-helix	trans	-66.9	-28.4	176.5	-67.1	-56.7	-7.8	0	0	112.9	L320 L436 I437 L442 H443 A444 I550 H552	L320-Q440 HydrophobicContact CD1-CB 4.17Å; L320-Q440 HydrophobicContact CD2-CB 3.87Å; L436-Q440 WeakPolarHBondContact O-CG 3.43Å; L436-Q440 PolarHBondContact O-N 3.28Å; I437-Q440 PolarHBondContact O-N 3.07Å; Q440-L442 VanDerWaalsContact C-N 3.34Å; Q440-H443 PolarHBondContact O-N 3.02Å; Q440-H443 PolarHBondContact OE1-ND1 3.36Å; Q440-H443 VanDerWaalsContact OE1-ND1 3.07Å; Q440-A444 WeakPolarHBondContact O-CB 3.43Å; Q440-A444 PolarHBondContact O-N 2.86Å; Q440-I550 HydrophobicContact CG-CG2 3.67Å; Q440-I550 PolarHBondContact NE2-O 2.82Å; Q440-H552 PolarHBondContact NE2-O 3.28Å
441	L	89.2	Confident	86.9	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-62.7	-41.7	171.4	-74.8	166.4	0	0	0	111.5	V319 L320 L325 F348 R349 I437 C438 L439 A444 L445	V319-L441 HydrophobicContact CB-CD1 4.33Å; V319-L441 HydrophobicContact CB-CD2 4Å; V319-L441 HydrophobicContact CG1-CD1 3.57Å; V319-L441 HydrophobicContact CG1-CD2 3.41Å; V319-L441 VanDerWaalsContact CG1-CD2 3.41Å; V319-L441 HydrophobicContact CG1-CG 4.08Å; V319-L441 WeakPolarHBondContact O-CD2 3.47Å; L320-L441 HydrophobicContact CD2-CB 4.44Å; L320-L441 HydrophobicContact CD2-CD2 3.6Å; L320-L441 HydrophobicContact CD2-CG 3.72Å; L320-L441 HydrophobicContact CG-CD2 4.37Å; L325-L441 HydrophobicContact CD1-CD2 3.97Å; F348-L441 HydrophobicContact CD1-CB 4.38Å; F348-L441 HydrophobicContact CD1-CD1 4.15Å; F348-L441 HydrophobicContact CE1-CB 4.36Å; R349-L441 HydrophobicContact CB-CD1 4.21Å; R349-L441 HydrophobicContact CB-CD2 4.43Å; R349-L441 HydrophobicContact CG-CD2 4.25Å; I437-L441 HydrophobicContact CG2-CD1 4.06Å; I437-L441 HydrophobicContact CG2-CG 4.37Å; I437-L441 WeakPolarHBondContact O-CB 3.43Å; I437-L441 VanDerWaalsContact O-CG 3.24Å; I437-L441 WeakPolarHBondContact O-CG 3.39Å; I437-L441 PolarHBondContact O-N 3.32Å; C438-L441 WeakPolarHBondContact O-CB 3.42Å; C438-L441 PolarHBondContact O-N 2.87Å; L439-L441 VanDerWaalsContact C-N 3.27Å; L439-L441 PolarHBondContact O-N 2.93Å; L441-A444 PolarHBondContact O-N 3.22Å; L441-L445 WeakPolarHBondContact O-CB 3.26Å; L441-L445 VanDerWaalsContact O-CG 3.25Å; L441-L445 WeakPolarHBondContact O-CG 3.28Å; L441-L445 PolarHBondContact O-N 3.02Å
442	L	90.3	Very high	87.1	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63.3	-42.4	175.3	-65.9	-171.6	0	0	0	111.9	F348 C438 L439 Q440 A444 L445 L446 W461 M464 L468	F348-L442 HydrophobicContact CE1-CD2 3.53Å; F348-L442 HydrophobicContact CE1-CG 3.81Å; F348-L442 HydrophobicContact CZ-CD1 4.07Å; F348-L442 HydrophobicContact CZ-CD2 3.62Å; F348-L442 HydrophobicContact CZ-CG 3.75Å; C438-L442 PolarHBondContact O-N 2.9Å; C438-L442 VanDerWaalsContact O-N 3.15Å; L439-L442 WeakPolarHBondContact O-CB 3.24Å; L439-L442 PolarHBondContact O-N 3.44Å; L439-L442 VanDerWaalsContact O-N 3.15Å; Q440-L442 VanDerWaalsContact C-N 3.34Å; L442-A444 VanDerWaalsContact C-N 3.31Å; L442-A444 PolarHBondContact O-N 2.96Å; L442-L445 PolarHBondContact O-N 3.29Å; L442-L446 WeakPolarHBondContact O-CB 3.41Å; L442-L446 WeakPolarHBondContact O-CG 3.2Å; L442-L446 PolarHBondContact O-N 3.29Å; L442-W461 VanDerWaalsContact CD2-CD1 3.46Å; L442-W461 HydrophobicContact CD2-CG 4.14Å; L442-M464 HydrophobicContact CD1-CB 3.74Å; L442-M464 HydrophobicContact CD1-CG 3.66Å; L442-M464 HydrophobicContact CD1-SD 4.07Å; L442-M464 HydrophobicContact CD2-SD 4.41Å; L442-L468 HydrophobicContact CD1-CD1 3.64Å; L442-L468 HydrophobicContact CG-CD1 4.32Å
443	H	87.7	Confident	86.9	Confident	23 Å²	23	22.5 Å²	22.5	11%	0.106	11%	0.106	C	C	.	.	H	α-helix	trans	-61.6	-40.2	173.3	-66	156	0	0	0	112.4	L439 Q440 L446 R447 T465 F554	L439-H443 WeakPolarHBondContact CD2-CE1 3.49Å; L439-H443 PolarHBondContact O-N 3.2Å; Q440-H443 PolarHBondContact O-N 3.02Å; Q440-H443 PolarHBondContact OE1-ND1 3.36Å; Q440-H443 VanDerWaalsContact OE1-ND1 3.07Å; H443-L446 PolarHBondContact O-N 3.24Å; H443-R447 WeakPolarHBondContact O-CG 3.21Å; H443-R447 PolarHBondContact O-N 3.01Å; H443-T465 WeakPolarHBondContact NE2-CG2 3.5Å; H443-F554 HydrophobicContact CB-CD2 4.34Å; H443-F554 HydrophobicContact CB-CE2 4.49Å; H443-F554 AromaticContact CD2-CD2 3.68Å; H443-F554 AromaticContact CD2-CE2 3.93Å; H443-F554 AromaticContact CG-CD2 3.98Å
444	A	86.6	Confident	86.8	Confident	2 Å²	2	22.3 Å²	22.3	2%	0.017	11%	0.106	C	C	.	.	H	α-helix	trans	-65.1	-42	176.7	0	0	0	0	0	112	L325 Q440 L441 L442 R447 L448	L325-A444 HydrophobicContact CD1-CB 4.09Å; L325-A444 HydrophobicContact CD2-CB 3.69Å; Q440-A444 WeakPolarHBondContact O-CB 3.43Å; Q440-A444 PolarHBondContact O-N 2.86Å; L441-A444 PolarHBondContact O-N 3.22Å; L442-A444 VanDerWaalsContact C-N 3.31Å; L442-A444 PolarHBondContact O-N 2.96Å; A444-R447 WeakPolarHBondContact O-CB 3.34Å; A444-R447 PolarHBondContact O-N 2.96Å; A444-L448 PolarHBondContact O-N 3.39Å
445	L	88.8	Confident	86.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-69.3	-35.7	176.4	-68.7	172.5	0	0	0	112.7	L325 H352 Y353 L356 L441 L442 R447 L448 A449 W461	L325-L445 HydrophobicContact CD1-CD2 4.03Å; L325-L445 HydrophobicContact CD1-CG 4.29Å; L325-L445 HydrophobicContact CG-CD2 4.48Å; H352-L445 HydrophobicContact CB-CD1 3.43Å; H352-L445 VanDerWaalsContact CB-CD1 3.43Å; Y353-L445 HydrophobicContact CD2-CD2 3.91Å; L356-L445 HydrophobicContact CD2-CD2 3.86Å; L441-L445 WeakPolarHBondContact O-CB 3.26Å; L441-L445 VanDerWaalsContact O-CG 3.25Å; L441-L445 WeakPolarHBondContact O-CG 3.28Å; L441-L445 PolarHBondContact O-N 3.02Å; L442-L445 PolarHBondContact O-N 3.29Å; L445-R447 VanDerWaalsContact C-N 3.34Å; L445-L448 PolarHBondContact O-N 3.12Å; L445-A449 WeakPolarHBondContact O-CB 3.48Å; L445-A449 PolarHBondContact O-N 3.28Å; L445-W461 HydrophobicContact CB-CH2 3.62Å; L445-W461 HydrophobicContact CB-CZ2 3.85Å; L445-W461 HydrophobicContact CB-CZ3 3.99Å; L445-W461 HydrophobicContact CD1-CZ2 4.08Å; L445-W461 WeakPolarHBondContact O-CZ3 3.29Å
446	L	88.3	Confident	86.5	Confident	13 Å²	13	26.9 Å²	26.9	7%	0.068	13%	0.134	C	C	.	.	H	α-helix	trans	-60	-43.2	171	-82	164.2	0	0	0	111.5	L442 H443 A449 K450 D458 W461	L442-L446 WeakPolarHBondContact O-CB 3.41Å; L442-L446 WeakPolarHBondContact O-CG 3.2Å; L442-L446 PolarHBondContact O-N 3.29Å; H443-L446 PolarHBondContact O-N 3.24Å; L446-A449 PolarHBondContact O-N 2.87Å; L446-K450 WeakPolarHBondContact O-CG 3.46Å; L446-K450 PolarHBondContact O-N 3.38Å; L446-K450 VanDerWaalsContact O-N 3.09Å; L446-D458 HydrophobicContact CD2-CB 4.4Å; L446-D458 WeakPolarHBondContact CD2-OD1 3.45Å; L446-W461 HydrophobicContact CD1-CB 4Å; L446-W461 HydrophobicContact CD2-CB 3.98Å; L446-W461 HydrophobicContact CD2-CD2 4.49Å; L446-W461 HydrophobicContact CD2-CE3 3.66Å; L446-W461 HydrophobicContact CG-CB 3.9Å; L446-W461 HydrophobicContact CG-CD2 4.38Å; L446-W461 HydrophobicContact CG-CE3 3.72Å
447	R	85.1	Confident	86.5	Confident	74 Å²	74	26.8 Å²	26.8	28%	0.279	13%	0.134	S	C	.	.	H	α-helix	trans	-60.8	-47.8	173.3	-73.3	-176.8	-70	177.6	-2.3	111.2	H443 A444 L445 A449 K450 E451	H443-R447 WeakPolarHBondContact O-CG 3.21Å; H443-R447 PolarHBondContact O-N 3.01Å; A444-R447 WeakPolarHBondContact O-CB 3.34Å; A444-R447 PolarHBondContact O-N 2.96Å; L445-R447 VanDerWaalsContact C-N 3.34Å; R447-A449 VanDerWaalsContact C-N 3.28Å; R447-A449 PolarHBondContact O-N 2.79Å; R447-K450 PolarHBondContact O-N 3.48Å; R447-K450 VanDerWaalsContact O-N 3.09Å; R447-E451 WeakPolarHBondContact O-CG 3.39Å; R447-E451 PolarHBondContact O-N 3.31Å
448	L	86.5	Confident	86.5	Confident	8 Å²	8	29.3 Å²	29.3	4%	0.042	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-35	-179.5	-170.8	61.2	0	0	0	112.3	L325 E326 Y353 L356 A444 L445 R452	L325-L448 HydrophobicContact CD2-CD2 4.46Å; E326-L448 HydrophobicContact CG-CD2 4.02Å; E326-L448 WeakPolarHBondContact OE1-CD1 3.42Å; Y353-L448 HydrophobicContact CD2-CD2 4.35Å; Y353-L448 HydrophobicContact CE2-CD2 3.79Å; L356-L448 HydrophobicContact CD2-CB 3.94Å; L356-L448 HydrophobicContact CD2-CD2 3.65Å; L356-L448 HydrophobicContact CD2-CG 3.84Å; A444-L448 PolarHBondContact O-N 3.39Å; L445-L448 PolarHBondContact O-N 3.12Å; L448-R452 WeakPolarHBondContact O-CB 3.35Å; L448-R452 VanDerWaalsContact O-CG 3.25Å; L448-R452 WeakPolarHBondContact O-CG 3.37Å; L448-R452 PolarHBondContact O-N 2.72Å
449	A	87.3	Confident	86.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.4	-39.4	173.4	0	0	0	0	0	112.6	L356 L445 L446 R447 R452 G453 V454 W461	L356-A449 HydrophobicContact CD1-CB 3.7Å; L445-A449 WeakPolarHBondContact O-CB 3.48Å; L445-A449 PolarHBondContact O-N 3.28Å; L446-A449 PolarHBondContact O-N 2.87Å; R447-A449 VanDerWaalsContact C-N 3.28Å; R447-A449 PolarHBondContact O-N 2.79Å; A449-R452 CarbonylContact O-C 3.41Å; A449-R452 PolarHBondContact O-N 2.95Å; A449-G453 PolarHBondContact O-N 3.4Å; A449-G453 VanDerWaalsContact O-N 3.14Å; A449-V454 PolarHBondContact O-N 2.9Å; A449-W461 HydrophobicContact CB-CZ3 3.91Å
450	K	86.4	Confident	86.5	Confident	111 Å²	111	35.4 Å²	35.4	48%	0.483	18%	0.179	S	C	.	.	H	α-helix	trans	-67.6	-42.8	175	-70.7	179.6	-178.5	-169.6	0	112.3	L446 R447 R452 G453 D458	L446-K450 WeakPolarHBondContact O-CG 3.46Å; L446-K450 PolarHBondContact O-N 3.38Å; L446-K450 VanDerWaalsContact O-N 3.09Å; R447-K450 PolarHBondContact O-N 3.48Å; R447-K450 VanDerWaalsContact O-N 3.09Å; K450-R452 PolarHBondContact O-N 2.96Å; K450-G453 PolarHBondContact O-N 3.45Å; K450-D458 WeakPolarHBondContact CE-OD2 3.41Å
451	E	84.8	Confident	86.8	Confident	130 Å²	130	34.7 Å²	34.7	61%	0.607	18%	0.176	S	C	*	.	H	α-helix	trans	-59.3	-35.2	173.5	-73	177.3	-163.9	0	0	111.8	R447 G453	R447-E451 WeakPolarHBondContact O-CG 3.39Å; R447-E451 PolarHBondContact O-N 3.31Å; E451-G453 VanDerWaalsContact C-N 3.31Å
452	R	86.6	Confident	86.7	Confident	62 Å²	62	36.1 Å²	36.1	23%	0.234	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	5.2	174.3	-65.9	176.6	-176.2	-171.8	1.3	113.7	Y353 Y364 L448 A449 K450 V454	Y353-R452 PolarHBondContact OH-NH2 3.05Å; Y364-R452 PolarHBondContact OH-O 3.01Å; L448-R452 WeakPolarHBondContact O-CB 3.35Å; L448-R452 VanDerWaalsContact O-CG 3.25Å; L448-R452 WeakPolarHBondContact O-CG 3.37Å; L448-R452 PolarHBondContact O-N 2.72Å; A449-R452 CarbonylContact O-C 3.41Å; A449-R452 PolarHBondContact O-N 2.95Å; K450-R452 PolarHBondContact O-N 2.96Å; R452-V454 WeakPolarHBondContact O-CG2 3.46Å; R452-V454 PolarHBondContact O-N 3.17Å
453	G	79.9	Confident	86.7	Confident	29 Å²	29	41.7 Å²	41.7	30%	0.299	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	30.2	177.7	0	0	0	0	0	115.5	A449 K450 E451 P455	A449-G453 PolarHBondContact O-N 3.4Å; A449-G453 VanDerWaalsContact O-N 3.14Å; K450-G453 PolarHBondContact O-N 3.45Å; E451-G453 VanDerWaalsContact C-N 3.31Å; G453-P455 WeakPolarHBondContact O-CD 3.33Å
454	V	82.9	Confident	86.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.			trans	-119.2	84.1	-178.9	-172.7	0	0	0	0	111.2	C360 Y363 Y364 A449 R452 V456	C360-V454 HydrophobicContact CB-CG2 4.3Å; Y363-V454 HydrophobicContact CD1-CB 4.37Å; Y363-V454 HydrophobicContact CD1-CG1 4.06Å; Y363-V454 HydrophobicContact CD1-CG2 3.8Å; Y363-V454 HydrophobicContact CD2-CG1 4.22Å; Y363-V454 HydrophobicContact CE1-CG2 4.42Å; Y363-V454 HydrophobicContact CG-CG1 3.79Å; Y363-V454 HydrophobicContact CG-CG2 4.29Å; Y364-V454 HydrophobicContact CE2-CG2 4.26Å; A449-V454 PolarHBondContact O-N 2.9Å; R452-V454 WeakPolarHBondContact O-CG2 3.46Å; R452-V454 PolarHBondContact O-N 3.17Å; V454-V456 HydrophobicContact CG1-CG2 4.24Å; V454-V456 PolarHBondContact O-N 3.39Å; V454-V456 VanDerWaalsContact O-N 3.11Å
455	P	80.5	Confident	86.9	Confident	64 Å²	64	41 Å²	41	42%	0.416	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	19.1	-175.4	33.8	-37	0	0	0	114.4	G453	G453-P455 WeakPolarHBondContact O-CD 3.33Å
456	V	84.8	Confident	87	Confident	31 Å²	31	46.1 Å²	46.1	19%	0.188	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-20.3	-172	-161.8	0	0	0	0	113.1	Y363 F405 V454	Y363-V456 HydrophobicContact CD2-CG2 3.5Å; Y363-V456 VanDerWaalsContact CD2-CG2 3.5Å; Y363-V456 HydrophobicContact CE2-CG2 3.36Å; F405-V456 HydrophobicContact CB-CG1 4.33Å; F405-V456 HydrophobicContact CD1-CB 3.92Å; F405-V456 HydrophobicContact CD1-CG1 3.17Å; F405-V456 HydrophobicContact CD1-CG2 4.48Å; F405-V456 HydrophobicContact CE1-CB 3.99Å; F405-V456 HydrophobicContact CE1-CG1 3.58Å; F405-V456 HydrophobicContact CG-CB 4.44Å; F405-V456 HydrophobicContact CG-CG1 3.91Å; V454-V456 HydrophobicContact CG1-CG2 4.24Å; V454-V456 PolarHBondContact O-N 3.39Å; V454-V456 VanDerWaalsContact O-N 3.11Å
457	L	87.4	Confident	87	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-91.2	-3	-180	-64.2	-178.9	0	0	0	113.7	L355 L356 A359 F405 L413 N459 F460 W461	L355-L457 HydrophobicContact CG-CD1 4.5Å; L356-L457 HydrophobicContact CD1-CD1 4.18Å; A359-L457 HydrophobicContact CB-CD1 3.71Å; A359-L457 HydrophobicContact CB-CD2 4.34Å; A359-L457 HydrophobicContact CB-CG 4.19Å; F405-L457 HydrophobicContact CE1-CD2 4.41Å; F405-L457 HydrophobicContact CZ-CD2 4.44Å; L413-L457 HydrophobicContact CD2-CD2 3.93Å; L457-N459 PolarHBondContact O-N 3.09Å; L457-F460 PolarHBondContact O-N 2.79Å; L457-F460 VanDerWaalsContact O-N 3.12Å; L457-W461 HydrophobicContact CB-CD2 4.14Å; L457-W461 HydrophobicContact CB-CE3 3.61Å; L457-W461 HydrophobicContact CB-CH2 4.29Å; L457-W461 HydrophobicContact CB-CZ3 3.72Å; L457-W461 HydrophobicContact CD1-CE3 4.34Å; L457-W461 HydrophobicContact CD1-CH2 3.49Å; L457-W461 VanDerWaalsContact CD1-CH2 3.49Å; L457-W461 HydrophobicContact CD1-CZ2 3.84Å; L457-W461 HydrophobicContact CD1-CZ3 3.77Å; L457-W461 HydrophobicContact CG-CZ3 4.42Å; L457-W461 PolarHBondContact O-N 3.35Å
458	D	87.1	Confident	87.3	Confident	54 Å²	54	44.3 Å²	44.3	29%	0.289	23%	0.234	S	C	.	.	H	α-helix	trans	-58.2	-47.6	-175.4	-76.7	10	0	0	0	112.3	L446 K450 G462	L446-D458 HydrophobicContact CD2-CB 4.4Å; L446-D458 WeakPolarHBondContact CD2-OD1 3.45Å; K450-D458 WeakPolarHBondContact CE-OD2 3.41Å; D458-G462 WeakPolarHBondContact O-CA 3.47Å; D458-G462 PolarHBondContact O-N 2.8Å
459	N	87.9	Confident	87.4	Confident	107 Å²	107	44.3 Å²	44.3	57%	0.572	23%	0.233	S	C	*	.	H	α-helix	trans	-67.4	-37.6	177.6	-170.6	10.8	0	0	0	112.1	L457 K463	L457-N459 PolarHBondContact O-N 3.09Å; N459-K463 WeakPolarHBondContact O-CG 3.4Å; N459-K463 PolarHBondContact O-N 3.12Å; N459-K463 VanDerWaalsContact O-N 3.14Å; N459-K463 WeakPolarHBondContact OD1-CE 3.34Å; N459-K463 PolarHBondContact OD1-NZ 3.46Å
460	F	91.6	Very high	87.6	Confident	20 Å²	20	48 Å²	48	9%	0.088	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-52	-178.9	171.9	-99.5	0	0	0	111.5	L355 L413 I416 H417 L457 M464	L355-F460 HydrophobicContact CD2-CD1 4.07Å; L355-F460 HydrophobicContact CD2-CE1 3.46Å; L355-F460 VanDerWaalsContact CD2-CE1 3.46Å; L355-F460 HydrophobicContact CD2-CZ 3.99Å; L413-F460 HydrophobicContact CB-CD2 4.07Å; L413-F460 HydrophobicContact CB-CE2 4.09Å; L413-F460 HydrophobicContact CD2-CD1 4.24Å; L413-F460 HydrophobicContact CD2-CD2 3.9Å; L413-F460 HydrophobicContact CD2-CE1 4.38Å; L413-F460 HydrophobicContact CD2-CE2 4.03Å; L413-F460 HydrophobicContact CD2-CG 4Å; L413-F460 HydrophobicContact CD2-CZ 4.28Å; L413-F460 HydrophobicContact CG-CD2 4.45Å; L413-F460 WeakPolarHBondContact O-CE2 3.25Å; I416-F460 HydrophobicContact CB-CZ 4.22Å; I416-F460 HydrophobicContact CG2-CZ 3.88Å; H417-F460 HydrophobicContact CB-CE2 4Å; L457-F460 PolarHBondContact O-N 2.79Å; L457-F460 VanDerWaalsContact O-N 3.12Å; F460-M464 HydrophobicContact CE1-CE 4.09Å; F460-M464 HydrophobicContact CE2-CE 4.19Å; F460-M464 HydrophobicContact CZ-CE 3.6Å; F460-M464 PolarHBondContact O-N 3.16Å
461	W	91.9	Very high	87.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-75	-32.3	178.7	-72.8	-40.8	0	0	0	112.6	H352 L356 L442 L445 L446 A449 L457 K463 M464 T465	H352-W461 AromaticContact ND1-NE1 3.31Å; H352-W461 PolarHBondContact ND1-NE1 3.1Å; L356-W461 HydrophobicContact CB-CH2 3.84Å; L356-W461 HydrophobicContact CB-CZ2 4.26Å; L356-W461 HydrophobicContact CD1-CH2 3.85Å; L356-W461 HydrophobicContact CD1-CZ3 4.36Å; L356-W461 HydrophobicContact CD2-CH2 4.17Å; L356-W461 HydrophobicContact CG-CH2 4.14Å; L442-W461 VanDerWaalsContact CD2-CD1 3.46Å; L442-W461 HydrophobicContact CD2-CG 4.14Å; L445-W461 HydrophobicContact CB-CH2 3.62Å; L445-W461 HydrophobicContact CB-CZ2 3.85Å; L445-W461 HydrophobicContact CB-CZ3 3.99Å; L445-W461 HydrophobicContact CD1-CZ2 4.08Å; L445-W461 WeakPolarHBondContact O-CZ3 3.29Å; L446-W461 HydrophobicContact CD1-CB 4Å; L446-W461 HydrophobicContact CD2-CB 3.98Å; L446-W461 HydrophobicContact CD2-CD2 4.49Å; L446-W461 HydrophobicContact CD2-CE3 3.66Å; L446-W461 HydrophobicContact CG-CB 3.9Å; L446-W461 HydrophobicContact CG-CD2 4.38Å; L446-W461 HydrophobicContact CG-CE3 3.72Å; A449-W461 HydrophobicContact CB-CZ3 3.91Å; L457-W461 HydrophobicContact CB-CD2 4.14Å; L457-W461 HydrophobicContact CB-CE3 3.61Å; L457-W461 HydrophobicContact CB-CH2 4.29Å; L457-W461 HydrophobicContact CB-CZ3 3.72Å; L457-W461 HydrophobicContact CD1-CE3 4.34Å; L457-W461 HydrophobicContact CD1-CH2 3.49Å; L457-W461 VanDerWaalsContact CD1-CH2 3.49Å; L457-W461 HydrophobicContact CD1-CZ2 3.84Å; L457-W461 HydrophobicContact CD1-CZ3 3.77Å; L457-W461 HydrophobicContact CG-CZ3 4.42Å; L457-W461 PolarHBondContact O-N 3.35Å; W461-K463 PolarHBondContact O-N 3.12Å; W461-M464 CarbonylContact O-C 2.95Å; W461-M464 PolarHBondContact O-N 3.25Å; W461-M464 VanDerWaalsContact O-N 3.08Å; W461-T465 WeakPolarHBondContact O-CB 3.4Å; W461-T465 PolarHBondContact O-N 3.26Å; W461-T465 PolarHBondContact O-OG1 3.15Å
462	G	88.4	Confident	88	Confident	30 Å²	30	41.3 Å²	41.3	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-55.7	-48.7	172.5	0	0	0	0	0	112.4	D458 M464 T465 E466	D458-G462 WeakPolarHBondContact O-CA 3.47Å; D458-G462 PolarHBondContact O-N 2.8Å; G462-M464 VanDerWaalsContact C-N 3.27Å; G462-M464 PolarHBondContact O-N 3.22Å; G462-T465 PolarHBondContact O-N 3.44Å; G462-E466 PolarHBondContact O-N 3.01Å; G462-E466 VanDerWaalsContact O-N 3.08Å
463	K	90.1	Very high	88.2	Confident	117 Å²	117	39.5 Å²	39.5	51%	0.509	22%	0.217	S	C	.	.	H	α-helix	trans	-60.4	-36.9	174.5	-74	171.8	176.1	167.7	0	113	N459 W461 T467	N459-K463 WeakPolarHBondContact O-CG 3.4Å; N459-K463 PolarHBondContact O-N 3.12Å; N459-K463 VanDerWaalsContact O-N 3.14Å; N459-K463 WeakPolarHBondContact OD1-CE 3.34Å; N459-K463 PolarHBondContact OD1-NZ 3.46Å; W461-K463 PolarHBondContact O-N 3.12Å; K463-T467 PolarHBondContact O-N 2.96Å; K463-T467 VanDerWaalsContact O-N 3.11Å; K463-T467 PolarHBondContact O-OG1 2.97Å
464	M	89.8	Confident	88.7	Confident	4 Å²	4	42 Å²	42	2%	0.02	22%	0.224	C	C	.	.	H	α-helix	trans	-73.8	-37.4	-179.5	-166.1	170.2	-76.2	0	0	112.2	F348 H352 H417 T420 L442 F460 W461 G462 T467 L468	F348-M464 HydrophobicContact CZ-SD 4.39Å; H352-M464 PolarHBondContact CE1-SD 2.86Å; H352-M464 PolarHBondContact NE2-SD 3.13Å; H417-M464 HydrophobicContact CB-CE 4.47Å; T420-M464 HydrophobicContact CG2-CE 4.02Å; T420-M464 HydrophobicContact CG2-CG 4.36Å; T420-M464 HydrophobicContact CG2-SD 3.6Å; L442-M464 HydrophobicContact CD1-CB 3.74Å; L442-M464 HydrophobicContact CD1-CG 3.66Å; L442-M464 HydrophobicContact CD1-SD 4.07Å; L442-M464 HydrophobicContact CD2-SD 4.41Å; F460-M464 HydrophobicContact CE1-CE 4.09Å; F460-M464 HydrophobicContact CE2-CE 4.19Å; F460-M464 HydrophobicContact CZ-CE 3.6Å; F460-M464 PolarHBondContact O-N 3.16Å; W461-M464 CarbonylContact O-C 2.95Å; W461-M464 PolarHBondContact O-N 3.25Å; W461-M464 VanDerWaalsContact O-N 3.08Å; G462-M464 VanDerWaalsContact C-N 3.27Å; G462-M464 PolarHBondContact O-N 3.22Å; M464-T467 WeakPolarHBondContact O-CB 3.4Å; M464-T467 PolarHBondContact O-N 2.91Å; M464-L468 WeakPolarHBondContact O-CG 3.35Å; M464-L468 PolarHBondContact O-N 3.11Å
465	T	89.4	Confident	89	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.043	23%	0.227	C	C	.	.	H	α-helix	trans	-60.3	-45.2	171.9	-61.6	0	0	0	0	110.8	L439 H443 W461 G462 T467 L468 W469	L439-T465 HydrophobicContact CD2-CG2 4.27Å; L439-T465 HydrophobicContact CG-CG2 4.14Å; H443-T465 WeakPolarHBondContact NE2-CG2 3.5Å; W461-T465 WeakPolarHBondContact O-CB 3.4Å; W461-T465 PolarHBondContact O-N 3.26Å; W461-T465 PolarHBondContact O-OG1 3.15Å; G462-T465 PolarHBondContact O-N 3.44Å; T465-T467 VanDerWaalsContact C-N 3.32Å; T465-T467 PolarHBondContact O-N 2.86Å; T465-L468 PolarHBondContact O-N 3.12Å; T465-W469 VanDerWaalsContact O-CD1 3.26Å; T465-W469 PolarHBondContact O-N 2.94Å
466	E	89.5	Confident	89.4	Confident	107 Å²	107	40 Å²	40	50%	0.5	21%	0.208	S	C	.	.	H	α-helix	trans	-61.6	-40.8	175.1	-70.7	-52.5	132.2	0	0	112.2	G462 L468 W469 V470 R599	G462-E466 PolarHBondContact O-N 3.01Å; G462-E466 VanDerWaalsContact O-N 3.08Å; E466-L468 VanDerWaalsContact C-N 3.34Å; E466-L468 PolarHBondContact O-N 2.95Å; E466-W469 PolarHBondContact O-N 3.11Å; E466-V470 WeakPolarHBondContact O-CG2 3.41Å; E466-V470 PolarHBondContact O-N 2.86Å; E466-R599 IonicContact OE2-NH1 3.94Å
467	T	89.5	Confident	89.7	Confident	50 Å²	50	41 Å²	41	31%	0.307	21%	0.212	S	C	.	.	H	α-helix	trans	-63.3	-40.6	175.8	-55.5	0	0	0	0	111.8	I425 K463 M464 T465 R471	I425-T467 HydrophobicContact CD1-CG2 4.31Å; K463-T467 PolarHBondContact O-N 2.96Å; K463-T467 VanDerWaalsContact O-N 3.11Å; K463-T467 PolarHBondContact O-OG1 2.97Å; M464-T467 WeakPolarHBondContact O-CB 3.4Å; M464-T467 PolarHBondContact O-N 2.91Å; T465-T467 VanDerWaalsContact C-N 3.32Å; T465-T467 PolarHBondContact O-N 2.86Å; T467-R471 WeakPolarHBondContact O-CG 3.02Å; T467-R471 PolarHBondContact O-N 3.05Å
468	L	90.1	Very high	89.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-39.8	176.3	-76.6	170.2	0	0	0	111.7	F348 I425 L435 C438 L439 L442 M464 T465 E466 V470 R471 V472	F348-L468 HydrophobicContact CE2-CD1 4.41Å; F348-L468 HydrophobicContact CZ-CD1 4.11Å; I425-L468 HydrophobicContact CD1-CD2 3.48Å; I425-L468 VanDerWaalsContact CD1-CD2 3.48Å; I425-L468 HydrophobicContact CD1-CG 3.94Å; I425-L468 HydrophobicContact CG1-CD2 3.61Å; L435-L468 HydrophobicContact CD2-CD2 3.88Å; C438-L468 HydrophobicContact CB-CD1 4.29Å; C438-L468 HydrophobicContact CB-CD2 4.45Å; L439-L468 HydrophobicContact CB-CB 4.39Å; L439-L468 HydrophobicContact CB-CD1 4.26Å; L439-L468 HydrophobicContact CD1-CB 3.99Å; L439-L468 HydrophobicContact CG-CB 4.39Å; L442-L468 HydrophobicContact CD1-CD1 3.64Å; L442-L468 HydrophobicContact CG-CD1 4.32Å; M464-L468 WeakPolarHBondContact O-CG 3.35Å; M464-L468 PolarHBondContact O-N 3.11Å; T465-L468 PolarHBondContact O-N 3.12Å; E466-L468 VanDerWaalsContact C-N 3.34Å; E466-L468 PolarHBondContact O-N 2.95Å; L468-V470 PolarHBondContact O-N 3.35Å; L468-R471 PolarHBondContact O-N 3.43Å; L468-R471 VanDerWaalsContact O-N 3.13Å; L468-V472 WeakPolarHBondContact O-CG2 3.42Å; L468-V472 PolarHBondContact O-N 2.67Å
469	W	90.4	Very high	89.8	Confident	7 Å²	7	41.8 Å²	41.8	3%	0.027	22%	0.219	C	C	.	.	H	α-helix	trans	-58.2	-47.5	178	-89.8	121.6	0	0	0	112.6	L436 L439 T465 E466 R471 V472 T473 D597 R599 I600	L436-W469 HydrophobicContact CD2-CH2 4.33Å; L436-W469 HydrophobicContact CD2-CZ3 4.26Å; L439-W469 HydrophobicContact CD1-CB 4.4Å; L439-W469 HydrophobicContact CD1-CD2 3.43Å; L439-W469 VanDerWaalsContact CD1-CD2 3.43Å; L439-W469 VanDerWaalsContact CD1-CE2 3.4Å; L439-W469 HydrophobicContact CD1-CE3 4.03Å; L439-W469 HydrophobicContact CD1-CG 3.6Å; L439-W469 HydrophobicContact CD1-CZ2 4.01Å; L439-W469 HydrophobicContact CD2-CZ2 3.85Å; T465-W469 VanDerWaalsContact O-CD1 3.26Å; T465-W469 PolarHBondContact O-N 2.94Å; E466-W469 PolarHBondContact O-N 3.11Å; W469-R471 PolarHBondContact O-N 2.77Å; W469-V472 HydrophobicContact CE3-CB 4.48Å; W469-V472 HydrophobicContact CZ3-CG1 4.45Å; W469-V472 PolarHBondContact O-N 3.32Å; W469-T473 PolarHBondContact O-N 2.91Å; W469-T473 PolarHBondContact O-OG1 2.97Å; W469-T473 VanDerWaalsContact O-OG1 3.08Å; W469-D597 HydrophobicContact CH2-CB 3.69Å; W469-D597 HydrophobicContact CZ2-CB 4.07Å; W469-D597 WeakPolarHBondContact CZ2-OD2 3.32Å; W469-R599 VanDerWaalsContact CE2-CZ 3.43Å; W469-R599 VanDerWaalsContact CG-CZ 3.47Å; W469-R599 HydrophobicContact CZ3-CB 4.44Å; W469-I600 HydrophobicContact CH2-CD1 3.61Å; W469-I600 HydrophobicContact CH2-CG1 3.89Å; W469-I600 HydrophobicContact CZ3-CD1 3.86Å; W469-I600 HydrophobicContact CZ3-CG1 3.74Å
470	V	90.3	Very high	89.8	Confident	77 Å²	77	37.4 Å²	37.4	47%	0.467	20%	0.195	S	C	.	.	H	α-helix	trans	-54.6	-43.2	176.4	174.8	0	0	0	0	110.5	E466 L468 T473 D474	E466-V470 WeakPolarHBondContact O-CG2 3.41Å; E466-V470 PolarHBondContact O-N 2.86Å; L468-V470 PolarHBondContact O-N 3.35Å; V470-T473 WeakPolarHBondContact CA-OG1 3.37Å; V470-T473 PolarHBondContact O-N 3.29Å; V470-T473 PolarHBondContact O-OG1 3.27Å; V470-D474 WeakPolarHBondContact O-CB 3.3Å; V470-D474 PolarHBondContact O-N 3.09Å
471	R	89.5	Confident	89.6	Confident	102 Å²	102	38.1 Å²	38.1	39%	0.385	21%	0.205	S	C	.	.	H	α-helix	trans	-71.3	-38.2	-179.7	-61.5	-57.4	-175.4	106.3	-0.5	113.6	I425 L435 T467 L468 W469 R475	I425-R471 HydrophobicContact CG2-CB 4.4Å; I425-R471 HydrophobicContact CG2-CG 3.77Å; L435-R471 HydrophobicContact CD1-CB 4.19Å; L435-R471 HydrophobicContact CD2-CB 4.34Å; T467-R471 WeakPolarHBondContact O-CG 3.02Å; T467-R471 PolarHBondContact O-N 3.05Å; L468-R471 PolarHBondContact O-N 3.43Å; L468-R471 VanDerWaalsContact O-N 3.13Å; W469-R471 PolarHBondContact O-N 2.77Å; R471-R475 WeakPolarHBondContact O-CB 3.31Å; R471-R475 PolarHBondContact O-N 3.28Å
472	V	90.5	Very high	89.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-48.6	173.5	170.6	0	0	0	0	109.6	L435 L436 L468 W469 R475 L476	L435-V472 HydrophobicContact CB-CG2 3.59Å; L436-V472 HydrophobicContact CD1-CG1 4.15Å; L436-V472 HydrophobicContact CD2-CG1 3.79Å; L436-V472 HydrophobicContact CD2-CG2 4.08Å; L436-V472 HydrophobicContact CG-CG1 3.77Å; L436-V472 HydrophobicContact CG-CG2 3.95Å; L468-V472 WeakPolarHBondContact O-CG2 3.42Å; L468-V472 PolarHBondContact O-N 2.67Å; W469-V472 HydrophobicContact CE3-CB 4.48Å; W469-V472 HydrophobicContact CZ3-CG1 4.45Å; W469-V472 PolarHBondContact O-N 3.32Å; V472-R475 PolarHBondContact O-N 3.37Å; V472-L476 HydrophobicContact CG1-CD1 4Å; V472-L476 HydrophobicContact CG1-CG 4.42Å; V472-L476 WeakPolarHBondContact O-CG 3.26Å; V472-L476 PolarHBondContact O-N 3.27Å
473	T	90.5	Very high	88.6	Confident	23 Å²	23	36.9 Å²	36.9	14%	0.141	19%	0.191	C	C	.	.	H	α-helix	trans	-64.5	-44.7	-179.2	50.2	0	0	0	0	111.9	W469 V470 R475 L476 D477 R599	W469-T473 PolarHBondContact O-N 2.91Å; W469-T473 PolarHBondContact O-OG1 2.97Å; W469-T473 VanDerWaalsContact O-OG1 3.08Å; V470-T473 WeakPolarHBondContact CA-OG1 3.37Å; V470-T473 PolarHBondContact O-N 3.29Å; V470-T473 PolarHBondContact O-OG1 3.27Å; T473-R475 VanDerWaalsContact C-N 3.26Å; T473-R475 PolarHBondContact O-N 2.73Å; T473-L476 PolarHBondContact O-N 2.87Å; T473-D477 WeakPolarHBondContact O-CB 3.12Å; T473-D477 VanDerWaalsContact O-CG 3.32Å; T473-D477 PolarHBondContact O-N 2.85Å; T473-R599 HydrophobicContact CG2-CB 4.3Å
474	D	90.3	Very high	87.7	Confident	82 Å²	82	36.5 Å²	36.5	44%	0.439	19%	0.194	S	C	.	.	H	α-helix	trans	-58	-41.8	176.6	-70.3	-15.4	0	0	0	111	V470 D477 V478	V470-D474 WeakPolarHBondContact O-CB 3.3Å; V470-D474 PolarHBondContact O-N 3.09Å; D474-D477 PolarHBondContact O-N 3Å; D474-V478 WeakPolarHBondContact O-CG2 3.34Å; D474-V478 PolarHBondContact O-N 3.32Å
475	R	89.1	Confident	86.5	Confident	18 Å²	18	43.3 Å²	43.3	7%	0.068	23%	0.226	C	C	.	.	H	α-helix	trans	-69.5	-40.5	179.7	-175.1	55.9	174.3	152	-0.9	112.3	D265 S429 H430 A432 R471 V472 T473 D477 V478 H479	D265-R475 PolarHBondContact O-NH2 2.65Å; S429-R475 WeakPolarHBondContact O-CD 3.42Å; H430-R475 VanDerWaalsContact C-NE 3.31Å; H430-R475 PolarHBondContact O-NE 3.21Å; H430-R475 PolarHBondContact O-NH2 2.84Å; A432-R475 HydrophobicContact CB-CB 4.46Å; A432-R475 HydrophobicContact CB-CG 3.9Å; R471-R475 WeakPolarHBondContact O-CB 3.31Å; R471-R475 PolarHBondContact O-N 3.28Å; V472-R475 PolarHBondContact O-N 3.37Å; T473-R475 VanDerWaalsContact C-N 3.26Å; T473-R475 PolarHBondContact O-N 2.73Å; R475-D477 VanDerWaalsContact C-N 3.31Å; R475-V478 PolarHBondContact O-N 3.06Å; R475-H479 PolarHBondContact O-CD2 3.17Å; R475-H479 VanDerWaalsContact O-CD2 3.29Å; R475-H479 PolarHBondContact O-N 3.23Å
476	L	90	Very high	84.9	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-39.4	173.2	-69.1	176.4	0	0	0	111.3	A432 V472 T473 V478 H479 I480 L543 L547 R603	A432-L476 HydrophobicContact CB-CD2 4.2Å; V472-L476 HydrophobicContact CG1-CD1 4Å; V472-L476 HydrophobicContact CG1-CG 4.42Å; V472-L476 WeakPolarHBondContact O-CG 3.26Å; V472-L476 PolarHBondContact O-N 3.27Å; T473-L476 PolarHBondContact O-N 2.87Å; L476-V478 VanDerWaalsContact C-N 3.31Å; L476-V478 PolarHBondContact O-N 2.95Å; L476-H479 WeakPolarHBondContact O-CB 3.4Å; L476-H479 PolarHBondContact O-N 2.83Å; L476-H479 VanDerWaalsContact O-N 3.09Å; L476-I480 VanDerWaalsContact O-CG1 3.31Å; L476-I480 WeakPolarHBondContact O-CG1 3.3Å; L476-I480 PolarHBondContact O-N 3.37Å; L476-L543 HydrophobicContact CD2-CD2 4.47Å; L476-L547 HydrophobicContact CD1-CD2 4.47Å; L476-L547 HydrophobicContact CD2-CD1 3.98Å; L476-L547 HydrophobicContact CD2-CD2 4.34Å; L476-R603 HydrophobicContact CB-CB 4.34Å; L476-R603 HydrophobicContact CB-CG 4.32Å; L476-R603 HydrophobicContact CD1-CB 4.11Å; L476-R603 HydrophobicContact CD1-CG 4.33Å
477	D	91.2	Very high	83.5	Confident	51 Å²	51	44.8 Å²	44.8	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-62.8	-38	175.3	-74	-28.1	0	0	0	111.7	T473 D474 R475 I480 A481 R603	T473-D477 WeakPolarHBondContact O-CB 3.12Å; T473-D477 VanDerWaalsContact O-CG 3.32Å; T473-D477 PolarHBondContact O-N 2.85Å; D474-D477 PolarHBondContact O-N 3Å; R475-D477 VanDerWaalsContact C-N 3.31Å; D477-I480 PolarHBondContact O-N 2.94Å; D477-A481 WeakPolarHBondContact O-CB 3.31Å; D477-A481 PolarHBondContact O-N 3.32Å; D477-R603 VanDerWaalsContact OD1-CD 3.26Å; D477-R603 WeakPolarHBondContact OD1-CD 3.34Å; D477-R603 IonicContact OD1-CZ 3.5Å; D477-R603 IonicContact OD1-NE 2.91Å; D477-R603 PolarHBondContact OD1-NE 3.24Å; D477-R603 IonicContact OD1-NH2 3.78Å; D477-R603 IonicContact OD2-CZ 3.28Å; D477-R603 IonicContact OD2-NE 3.14Å; D477-R603 PolarHBondContact OD2-NE 2.97Å; D477-R603 IonicContact OD2-NH2 2.75Å; D477-R603 PolarHBondContact OD2-NH2 3.02Å
478	V	88.1	Confident	81.9	Confident	67 Å²	67	45.1 Å²	45.1	41%	0.406	23%	0.229	S	C	.	.	H	α-helix	trans	-64.9	-37.5	171.9	172.9	0	0	0	0	112	L266 D474 R475 L476 S482	L266-V478 HydrophobicContact CD2-CG1 3.67Å; D474-V478 WeakPolarHBondContact O-CG2 3.34Å; D474-V478 PolarHBondContact O-N 3.32Å; R475-V478 PolarHBondContact O-N 3.06Å; L476-V478 VanDerWaalsContact C-N 3.31Å; L476-V478 PolarHBondContact O-N 2.95Å; V478-S482 VanDerWaalsContact O-CB 3.3Å; V478-S482 WeakPolarHBondContact O-CB 3.31Å; V478-S482 PolarHBondContact O-N 3.28Å
479	H	87.4	Confident	80.7	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.019	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-42.6	173.9	-73.6	-51	0	0	0	112.2	L267 F310 R475 L476 S482 M483	L267-H479 HydrophobicContact CD1-CB 3.97Å; F310-H479 AromaticContact CE1-CE1 3.92Å; R475-H479 PolarHBondContact O-CD2 3.17Å; R475-H479 VanDerWaalsContact O-CD2 3.29Å; R475-H479 PolarHBondContact O-N 3.23Å; L476-H479 WeakPolarHBondContact O-CB 3.4Å; L476-H479 PolarHBondContact O-N 2.83Å; L476-H479 VanDerWaalsContact O-N 3.09Å; H479-S482 WeakPolarHBondContact O-CB 3.45Å; H479-S482 PolarHBondContact O-N 3.16Å; H479-M483 PolarHBondContact O-N 2.72Å
480	I	87.4	Confident	79.4	Confident	15 Å²	15	50.6 Å²	50.6	8%	0.077	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-48.1	175.8	-66.2	164.1	0	0	0	110.3	L476 D477 S482 M483 L484 R603 Q606 L607 Q610	L476-I480 VanDerWaalsContact O-CG1 3.31Å; L476-I480 WeakPolarHBondContact O-CG1 3.3Å; L476-I480 PolarHBondContact O-N 3.37Å; D477-I480 PolarHBondContact O-N 2.94Å; I480-S482 VanDerWaalsContact C-N 3.3Å; I480-S482 PolarHBondContact O-N 2.83Å; I480-M483 PolarHBondContact O-N 2.9Å; I480-L484 PolarHBondContact O-N 3.3Å; I480-R603 HydrophobicContact CD1-CB 4.19Å; I480-Q606 HydrophobicContact CD1-CB 3.88Å; I480-L607 HydrophobicContact CG1-CB 4.18Å; I480-L607 HydrophobicContact CG1-CD1 3.73Å; I480-Q610 HydrophobicContact CG2-CG 3.85Å
481	A	87.3	Confident	78.3	Confident	35 Å²	35	47.8 Å²	47.8	29%	0.289	25%	0.249	S	C	.	.	H	α-helix	trans	-64	-34.4	177	0	0	0	0	0	112.5	D477 M483 L484 Q485	D477-A481 WeakPolarHBondContact O-CB 3.31Å; D477-A481 PolarHBondContact O-N 3.32Å; A481-M483 VanDerWaalsContact C-N 3.29Å; A481-M483 PolarHBondContact O-N 3.2Å; A481-L484 WeakPolarHBondContact O-CB 3.23Å; A481-L484 PolarHBondContact O-N 3.42Å; A481-L484 VanDerWaalsContact O-N 3.15Å; A481-Q485 PolarHBondContact O-N 3.36Å
482	S	83.4	Confident	77.3	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.007	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-38.3	176.9	174.5	0	0	0	0	112.6	L266 G268 V478 H479 I480 L484 Y486	L266-S482 WeakPolarHBondContact CB-OG 3.47Å; G268-S482 WeakPolarHBondContact CA-OG 3.41Å; G268-S482 PolarHBondContact N-OG 2.92Å; G268-S482 VanDerWaalsContact N-OG 3.1Å; V478-S482 VanDerWaalsContact O-CB 3.3Å; V478-S482 WeakPolarHBondContact O-CB 3.31Å; V478-S482 PolarHBondContact O-N 3.28Å; H479-S482 WeakPolarHBondContact O-CB 3.45Å; H479-S482 PolarHBondContact O-N 3.16Å; I480-S482 VanDerWaalsContact C-N 3.3Å; I480-S482 PolarHBondContact O-N 2.83Å; S482-L484 VanDerWaalsContact C-N 3.26Å; S482-L484 PolarHBondContact O-N 3.03Å; S482-Y486 WeakPolarHBondContact O-CB 3.01Å; S482-Y486 PolarHBondContact O-N 3.41Å; S482-Y486 VanDerWaalsContact O-N 3.09Å
483	M	77.2	Confident	76.1	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-29.8	177.7	-68.3	177.9	71.3	0	0	112.2	L267 H479 I480 A481 I536 L607 Q610 F611 V614	L267-M483 HydrophobicContact CB-CG 4.04Å; L267-M483 HydrophobicContact CB-SD 4.32Å; L267-M483 HydrophobicContact CD2-SD 3.94Å; H479-M483 PolarHBondContact O-N 2.72Å; I480-M483 PolarHBondContact O-N 2.9Å; A481-M483 VanDerWaalsContact C-N 3.29Å; A481-M483 PolarHBondContact O-N 3.2Å; M483-I536 HydrophobicContact CE-CD1 4.37Å; M483-I536 HydrophobicContact CE-CG1 4.45Å; M483-I536 HydrophobicContact CG-CD1 4.43Å; M483-L607 HydrophobicContact SD-CD1 3.38Å; M483-L607 WeakPolarHBondContact SD-CD1 3.38Å; M483-L607 HydrophobicContact SD-CG 4.15Å; M483-Q610 HydrophobicContact CB-CB 4.33Å; M483-F611 HydrophobicContact CE-CB 3.65Å; M483-F611 HydrophobicContact CE-CD2 4.13Å; M483-F611 HydrophobicContact CE-CG 4.41Å; M483-V614 HydrophobicContact CB-CG2 4.49Å; M483-V614 WeakPolarHBondContact O-CG2 3.04Å
484	L	70.1	Confident	75	Confident	109 Å²	109	46 Å²	46	57%	0.571	25%	0.249	S	C	*	.	H	α-helix	trans	-75.6	-46	175.6	-79.5	167	0	0	0	113.3	I480 A481 S482 Q610	I480-L484 PolarHBondContact O-N 3.3Å; A481-L484 WeakPolarHBondContact O-CB 3.23Å; A481-L484 PolarHBondContact O-N 3.42Å; A481-L484 VanDerWaalsContact O-N 3.15Å; S482-L484 VanDerWaalsContact C-N 3.26Å; S482-L484 PolarHBondContact O-N 3.03Å; L484-Q610 HydrophobicContact CG-CG 4.31Å
485	Q	64.9	Low	73.8	Confident	146 Å²	146	46.3 Å²	46.3	68%	0.682	25%	0.251	S	S	*	.	H	α-helix	trans	-96.6	-32.2	-165.6	-67.8	177.3	6.8	0	0	114.7	A481	A481-Q485 PolarHBondContact O-N 3.36Å
486	Y	55.3	Low	72.6	Confident	122 Å²	122	45.5 Å²	45.5	48%	0.478	25%	0.248	S	C	.	.	S	Bend	trans	-106.4	-5.7	-165.8	-71.6	-88.9	0	0	0	114.7	K269 S482 D488	K269-Y486 HydrophobicContact CG-CD1 4.42Å; S482-Y486 WeakPolarHBondContact O-CB 3.01Å; S482-Y486 PolarHBondContact O-N 3.41Å; S482-Y486 VanDerWaalsContact O-N 3.09Å; Y486-D488 PolarHBondContact O-N 2.76Å
487	L	60.9	Low	71.5	Confident	24 Å²	24	51.8 Å²	51.8	13%	0.126	27%	0.271	C	S	.	.			trans	-77.8	100.9	-179.8	-153.4	82.1	0	0	0	109.8	G268 V489 I536 V614 L618	G268-L487 WeakPolarHBondContact O-CD1 3.41Å; L487-V489 PolarHBondContact O-N 3.42Å; L487-I536 HydrophobicContact CD1-CD1 3.52Å; L487-I536 HydrophobicContact CD2-CD1 4.42Å; L487-V614 HydrophobicContact CD2-CB 4.1Å; L487-V614 HydrophobicContact CD2-CG1 3.22Å; L487-V614 HydrophobicContact CD2-CG2 3.9Å; L487-L618 HydrophobicContact CD2-CD1 4.23Å; L487-L618 HydrophobicContact CD2-CD2 4.35Å; L487-L618 HydrophobicContact CD2-CG 4.35Å
488	D	57	Low	70.1	Confident	57 Å²	57	53.1 Å²	53.1	31%	0.305	28%	0.278	S	S	.	.			trans	-70.7	76.3	176.8	-167.6	4	0	0	0	109.9	K273 Y486 S490 S491 F492	K273-D488 IonicContact NZ-OD2 3.46Å; K273-D488 PolarHBondContact NZ-OD2 3.25Å; Y486-D488 PolarHBondContact O-N 2.76Å; D488-S490 PolarHBondContact O-N 2.83Å; D488-S490 VanDerWaalsContact OD1-CB 3.23Å; D488-S490 WeakPolarHBondContact OD1-CB 3.44Å; D488-S490 PolarHBondContact OD1-N 3.4Å; D488-S490 PolarHBondContact OD1-OG 2.88Å; D488-S491 PolarHBondContact O-N 2.97Å; D488-S491 PolarHBondContact O-OG 2.82Å; D488-S491 VanDerWaalsContact O-OG 3.08Å; D488-S491 PolarHBondContact OD1-N 3.39Å; D488-S491 WeakPolarHBondContact OD2-CB 3.28Å; D488-F492 PolarHBondContact O-N 3.17Å
489	V	64	Low	68.7	Low	51 Å²	51	51 Å²	51	31%	0.309	26%	0.264	S	S	.	.	H	α-helix	trans	-53.1	-27.2	170.8	-179.2	0	0	0	0	109.5	L487 S493	L487-V489 PolarHBondContact O-N 3.42Å; V489-S493 WeakPolarHBondContact O-CB 3.43Å; V489-S493 PolarHBondContact O-N 3.43Å
490	S	63	Low	67.3	Low	71 Å²	71	53.1 Å²	53.1	50%	0.497	28%	0.275	S	S	.	.	H	α-helix	trans	-67.6	-37.3	177.9	92.8	0	0	0	0	112.7	D488 S493 T494	D488-S490 PolarHBondContact O-N 2.83Å; D488-S490 VanDerWaalsContact OD1-CB 3.23Å; D488-S490 WeakPolarHBondContact OD1-CB 3.44Å; D488-S490 PolarHBondContact OD1-N 3.4Å; D488-S490 PolarHBondContact OD1-OG 2.88Å; S490-S493 CarbonylContact O-C 3.6Å; S490-S493 PolarHBondContact O-N 3.33Å; S490-T494 WeakPolarHBondContact O-CB 3.47Å; S490-T494 PolarHBondContact O-N 3.09Å; S490-T494 PolarHBondContact O-OG1 3.42Å
491	S	67.9	Low	65.9	Low	17 Å²	17	58.8 Å²	58.8	12%	0.119	30%	0.299	C	S	.	.	H	α-helix	trans	-68.7	-46.8	176.3	72.4	0	0	0	0	111.5	D488 S493 T494 D495	D488-S491 PolarHBondContact O-N 2.97Å; D488-S491 PolarHBondContact O-OG 2.82Å; D488-S491 VanDerWaalsContact O-OG 3.08Å; D488-S491 PolarHBondContact OD1-N 3.39Å; D488-S491 WeakPolarHBondContact OD2-CB 3.28Å; S491-S493 PolarHBondContact O-N 3.47Å; S491-T494 PolarHBondContact O-N 3.15Å; S491-D495 PolarHBondContact O-N 3.27Å
492	F	68.3	Low	64.2	Low	17 Å²	17	58.7 Å²	58.7	8%	0.075	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-38.6	174.9	-175.5	-96.1	0	0	0	111.3	D488 D495 A496 L530 L618 T621 F622 F631	D488-F492 PolarHBondContact O-N 3.17Å; F492-D495 PolarHBondContact O-N 2.88Å; F492-A496 WeakPolarHBondContact O-CB 3.48Å; F492-A496 PolarHBondContact O-N 3.12Å; F492-L530 HydrophobicContact CD2-CD2 4.25Å; F492-L530 HydrophobicContact CE2-CD2 3.6Å; F492-L530 HydrophobicContact CZ-CD2 4.01Å; F492-L618 HydrophobicContact CB-CD2 3.87Å; F492-L618 HydrophobicContact CD1-CB 4.38Å; F492-L618 HydrophobicContact CD1-CD2 3.65Å; F492-L618 HydrophobicContact CD2-CD2 4.4Å; F492-L618 HydrophobicContact CE1-CB 4.22Å; F492-L618 HydrophobicContact CE1-CD2 4.29Å; F492-L618 HydrophobicContact CG-CD2 3.72Å; F492-T621 HydrophobicContact CD1-CG2 4.04Å; F492-T621 HydrophobicContact CE1-CG2 4.28Å; F492-F622 HydrophobicContact CE1-CE2 4.14Å; F492-F622 HydrophobicContact CE1-CZ 4.12Å; F492-F622 HydrophobicContact CZ-CE2 4.19Å; F492-F622 AromaticContact CZ-CZ 3.84Å; F492-F622 HydrophobicContact CZ-CZ 3.84Å; F492-F631 HydrophobicContact CZ-CE2 4.4Å
493	S	65.5	Low	62.6	Low	13 Å²	13	61.3 Å²	61.3	9%	0.091	31%	0.31	C	S	.	.	H	α-helix	trans	-67.9	-33.4	174.8	-169.3	0	0	0	0	113.6	V489 S490 S491 R497 T621	V489-S493 WeakPolarHBondContact O-CB 3.43Å; V489-S493 PolarHBondContact O-N 3.43Å; S490-S493 CarbonylContact O-C 3.6Å; S490-S493 PolarHBondContact O-N 3.33Å; S491-S493 PolarHBondContact O-N 3.47Å; S493-R497 VanDerWaalsContact O-CB 3.27Å; S493-R497 WeakPolarHBondContact O-CB 3.43Å; S493-R497 WeakPolarHBondContact O-CG 3.38Å; S493-R497 PolarHBondContact O-N 3.46Å; S493-R497 PolarHBondContact OG-NH1 3.28Å; S493-R497 PolarHBondContact OG-NH2 3.08Å; S493-T621 VanDerWaalsContact CA-CG2 3.41Å
494	T	66.5	Low	60.9	Low	59 Å²	59	67.9 Å²	67.9	36%	0.362	34%	0.344	S	S	.	.	H	α-helix	trans	-70.5	-47.2	174.9	-53.6	0	0	0	0	110	S490 S491 A496 R497 D498	S490-T494 WeakPolarHBondContact O-CB 3.47Å; S490-T494 PolarHBondContact O-N 3.09Å; S490-T494 PolarHBondContact O-OG1 3.42Å; S491-T494 PolarHBondContact O-N 3.15Å; T494-A496 PolarHBondContact O-N 3.4Å; T494-R497 PolarHBondContact O-N 3.29Å; T494-D498 WeakPolarHBondContact O-CB 3.46Å; T494-D498 VanDerWaalsContact O-CG 3.31Å; T494-D498 PolarHBondContact O-N 2.89Å
495	D	66	Low	59.5	Low	88 Å²	88	66.4 Å²	66.4	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-60	-45.9	176.1	-64.7	-26.1	0	0	0	111.6	S491 F492 R497 D498 I499	S491-D495 PolarHBondContact O-N 3.27Å; F492-D495 PolarHBondContact O-N 2.88Å; D495-R497 PolarHBondContact O-N 2.87Å; D495-D498 PolarHBondContact O-N 3.09Å; D495-I499 WeakPolarHBondContact O-CB 3.37Å; D495-I499 WeakPolarHBondContact O-CD1 3.27Å; D495-I499 WeakPolarHBondContact O-CG1 3.23Å; D495-I499 PolarHBondContact O-N 2.99Å
496	A	63.8	Low	58.1	Low	1 Å²	1	63.4 Å²	63.4	1%	0.008	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-42.5	176.3	0	0	0	0	0	112	F492 T494 M500 L530 T621	F492-A496 WeakPolarHBondContact O-CB 3.48Å; F492-A496 PolarHBondContact O-N 3.12Å; T494-A496 PolarHBondContact O-N 3.4Å; A496-M500 WeakPolarHBondContact O-CB 3.32Å; A496-M500 VanDerWaalsContact O-CG 3.27Å; A496-M500 WeakPolarHBondContact O-CG 3.5Å; A496-M500 PolarHBondContact O-N 3.26Å; A496-L530 HydrophobicContact CB-CD1 4.02Å; A496-T621 HydrophobicContact CB-CG2 3.62Å
497	R	65.5	Low	57.1	Low	136 Å²	136	64.4 Å²	64.4	51%	0.513	35%	0.348	S	S	.	.	H	α-helix	trans	-67.2	-43.1	176.3	-78	-176.4	-155.8	113.2	-2.8	112.2	S493 T494 D495 M500 K501	S493-R497 VanDerWaalsContact O-CB 3.27Å; S493-R497 WeakPolarHBondContact O-CB 3.43Å; S493-R497 WeakPolarHBondContact O-CG 3.38Å; S493-R497 PolarHBondContact O-N 3.46Å; S493-R497 PolarHBondContact OG-NH1 3.28Å; S493-R497 PolarHBondContact OG-NH2 3.08Å; T494-R497 PolarHBondContact O-N 3.29Å; D495-R497 PolarHBondContact O-N 2.87Å; R497-M500 PolarHBondContact O-N 3.42Å; R497-K501 WeakPolarHBondContact O-CB 3.35Å; R497-K501 VanDerWaalsContact O-CG 3.32Å; R497-K501 WeakPolarHBondContact O-CG 3.18Å; R497-K501 PolarHBondContact O-N 3.49Å
498	D	62.3	Low	55.6	Low	80 Å²	80	70.4 Å²	70.4	43%	0.428	38%	0.38	S	S	.	.	H	α-helix	trans	-68.5	-38.1	-177.8	-73	-15.1	0	0	0	110.9	T494 D495 K501 S502	T494-D498 WeakPolarHBondContact O-CB 3.46Å; T494-D498 VanDerWaalsContact O-CG 3.31Å; T494-D498 PolarHBondContact O-N 2.89Å; D495-D498 PolarHBondContact O-N 3.09Å; D498-K501 PolarHBondContact O-N 3.02Å; D498-S502 WeakPolarHBondContact O-CB 3.41Å; D498-S502 PolarHBondContact O-N 3.13Å
499	I	58.8	Low	54.4	Low	22 Å²	22	73 Å²	73	11%	0.113	40%	0.398	C	S	.	.	H	α-helix	trans	-64.6	-43.7	171.9	-67	162.8	0	0	0	110.6	D495 K501 S502 N503 K526 M527 L530	D495-I499 WeakPolarHBondContact O-CB 3.37Å; D495-I499 WeakPolarHBondContact O-CD1 3.27Å; D495-I499 WeakPolarHBondContact O-CG1 3.23Å; D495-I499 PolarHBondContact O-N 2.99Å; I499-K501 PolarHBondContact O-N 2.94Å; I499-S502 PolarHBondContact O-N 3.39Å; I499-S502 PolarHBondContact O-OG 3.1Å; I499-N503 PolarHBondContact O-N 3.1Å; I499-K526 HydrophobicContact CD1-CB 3.78Å; I499-K526 HydrophobicContact CG1-CB 3.97Å; I499-K526 HydrophobicContact CG1-CD 4.23Å; I499-K526 HydrophobicContact CG2-CB 4.04Å; I499-M527 HydrophobicContact CG2-CB 4.36Å; I499-M527 HydrophobicContact CG2-CG 4.11Å; I499-L530 HydrophobicContact CD1-CD1 3.79Å; I499-L530 HydrophobicContact CD1-CG 4.18Å
500	M	58.6	Low	52.6	Low	48 Å²	48	76.1 Å²	76.1	24%	0.236	42%	0.422	C	S	.	.	H	α-helix	trans	-64.6	-37.7	176.2	-75.5	-176.2	-162.5	0	0	113.1	A496 R497 N503 F622 S623	A496-M500 WeakPolarHBondContact O-CB 3.32Å; A496-M500 VanDerWaalsContact O-CG 3.27Å; A496-M500 WeakPolarHBondContact O-CG 3.5Å; A496-M500 PolarHBondContact O-N 3.26Å; R497-M500 PolarHBondContact O-N 3.42Å; M500-N503 PolarHBondContact O-N 3.11Å; M500-F622 HydrophobicContact CE-CD1 4.37Å; M500-S623 WeakPolarHBondContact CE-OG 3.07Å; M500-S623 PolarHBondContact SD-OG 2.85Å
501	K	56.9	Low	50.9	Low	135 Å²	135	76.9 Å²	76.9	59%	0.587	43%	0.432	S	S	*	.	H	α-helix	trans	-67	-38.7	174.6	-74.3	173.7	-176.2	173.3	0	111.7	R497 D498 I499 N503 L504 S505	R497-K501 WeakPolarHBondContact O-CB 3.35Å; R497-K501 VanDerWaalsContact O-CG 3.32Å; R497-K501 WeakPolarHBondContact O-CG 3.18Å; R497-K501 PolarHBondContact O-N 3.49Å; D498-K501 PolarHBondContact O-N 3.02Å; I499-K501 PolarHBondContact O-N 2.94Å; K501-N503 VanDerWaalsContact C-N 3.25Å; K501-N503 PolarHBondContact O-N 3.49Å; K501-L504 WeakPolarHBondContact O-CB 3.19Å; K501-L504 PolarHBondContact O-N 3.19Å; K501-S505 PolarHBondContact O-N 3.31Å
502	S	53	Low	49	Very low	33 Å²	33	81.7 Å²	81.7	23%	0.231	46%	0.464	C	S	.	.	H	α-helix	trans	-63.2	-31.2	178.8	72.2	0	0	0	0	113	D498 I499 L504 S505 T506	D498-S502 WeakPolarHBondContact O-CB 3.41Å; D498-S502 PolarHBondContact O-N 3.13Å; I499-S502 PolarHBondContact O-N 3.39Å; I499-S502 PolarHBondContact O-OG 3.1Å; S502-L504 PolarHBondContact O-N 3.37Å; S502-S505 PolarHBondContact O-N 3.2Å; S502-S505 PolarHBondContact O-OG 2.67Å; S502-T506 PolarHBondContact O-N 3.01Å; S502-T506 VanDerWaalsContact O-N 3.09Å; S502-T506 PolarHBondContact O-OG1 2.79Å; S502-T506 VanDerWaalsContact O-OG1 3.13Å
503	N	48.5	Very low	46.9	Very low	55 Å²	55	87.4 Å²	87.4	29%	0.294	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-27.3	171.7	-81.6	-12.7	0	0	0	113.3	I499 M500 K501 H524	I499-N503 PolarHBondContact O-N 3.1Å; M500-N503 PolarHBondContact O-N 3.11Å; K501-N503 VanDerWaalsContact C-N 3.25Å; K501-N503 PolarHBondContact O-N 3.49Å; N503-H524 WeakPolarHBondContact OD1-CB 3.23Å
504	L	41.6	Very low	45	Very low	141 Å²	141	93.9 Å²	93.9	74%	0.738	53%	0.533	S	S	*	.	H	α-helix	trans	-79.1	-33.2	174.7	-117.6	90.3	0	0	0	112	K501 S502	K501-L504 WeakPolarHBondContact O-CB 3.19Å; K501-L504 PolarHBondContact O-N 3.19Å; S502-L504 PolarHBondContact O-N 3.37Å
505	S	41	Very low	43.1	Very low	79 Å²	79	97.6 Å²	97.6	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-82.9	-28.4	-176.2	56.8	0	0	0	0	113.9	K501 S502 L507 N508	K501-S505 PolarHBondContact O-N 3.31Å; S502-S505 PolarHBondContact O-N 3.2Å; S502-S505 PolarHBondContact O-OG 2.67Å; S505-L507 PolarHBondContact O-N 2.74Å; S505-N508 PolarHBondContact O-N 3.5Å
506	T	36.8	Very low	41.4	Very low	83 Å²	83	99.6 Å²	99.6	51%	0.509	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-73.7	-12.8	176.8	51.9	0	0	0	0	113.9	S502 N508	S502-T506 PolarHBondContact O-N 3.01Å; S502-T506 VanDerWaalsContact O-N 3.09Å; S502-T506 PolarHBondContact O-OG1 2.79Å; S502-T506 VanDerWaalsContact O-OG1 3.13Å; T506-N508 PolarHBondContact O-N 3.46Å
507	L	33.7	Very low	39.5	Very low	142 Å²	142	103.1 Å²	103.1	74%	0.743	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-70	-11.1	172.3	-85.3	156.8	0	0	0	113.8	S505	S505-L507 PolarHBondContact O-N 2.74Å
508	N	30	Very low	37.6	Very low	150 Å²	150	103.3 Å²	103.3	80%	0.802	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-95.2	5.2	179.6	-91.1	5.2	0	0	0	115	S505 T506	S505-N508 PolarHBondContact O-N 3.5Å; T506-N508 PolarHBondContact O-N 3.46Å
509	V	30.4	Very low	36	Very low	113 Å²	113	106 Å²	106	69%	0.685	64%	0.639	S	S	*	*	S	Bend	trans	-97.1	105.4	172.1	-174.6	0	0	0	0	108.7	A511	V509-A511 PolarHBondContact O-N 2.69Å
510	S	27.2	Very low	34.7	Very low	115 Å²	115	110.9 Å²	110.9	80%	0.804	67%	0.67	S	S	*	*			trans	-27.3	94	168.4	21.2	0	0	0	0	113.8
511	A	26.8	Very low	33.8	Very low	87 Å²	87	115.3 Å²	115.3	72%	0.719	70%	0.7	S	S	*	*			trans	-76.2	132.5	167.7	0	0	0	0	0	109.3	V509	V509-A511 PolarHBondContact O-N 2.69Å
512	P	27	Very low	33.3	Very low	119 Å²	119	110.9 Å²	110.9	77%	0.773	69%	0.692	S	S	*	*			trans	-68.3	142	179.9	4.2	6.1	0	0	0	111	N514	P512-N514 PolarHBondContact O-N 2.89Å
513	T	25.5	Very low	33.4	Very low	137 Å²	137	111.6 Å²	111.6	84%	0.84	69%	0.693	S	S	*	*			trans	-59.8	87.8	176.9	50.4	0	0	0	0	111.5
514	N	25.1	Very low	33.6	Very low	148 Å²	148	111.7 Å²	111.7	79%	0.791	69%	0.692	S	S	*	*			trans	-108.2	111.5	160	-89.1	-4.8	0	0	0	109.5	P512 T516	P512-N514 PolarHBondContact O-N 2.89Å; N514-T516 PolarHBondContact O-N 3.46Å
515	T	27	Very low	34.3	Very low	137 Å²	137	109.7 Å²	109.7	84%	0.84	69%	0.687	S	S	*	*	S	Bend	trans	-51.4	90.7	170.2	42.2	0	0	0	0	111.5
516	T	29.4	Very low	35.2	Very low	130 Å²	130	112 Å²	112	80%	0.798	69%	0.687	S	S	*	*			trans	-173.5	95.8	152	13.4	0	0	0	0	106.5	N514 N518	N514-T516 PolarHBondContact O-N 3.46Å; T516-N518 PolarHBondContact O-N 3.12Å
517	G	25.3	Very low	36.3	Very low	76 Å²	76	108.2 Å²	108.2	78%	0.784	66%	0.664	S	S	*	*			trans	-66	95.9	-179.4	0	0	0	0	0	110.6
518	N	25.4	Very low	37.8	Very low	140 Å²	140	103.3 Å²	103.3	75%	0.749	64%	0.636	S	S	*	*			trans	-155	67.5	160	-91.4	-17.3	0	0	0	107.1	T516 T520	T516-N518 PolarHBondContact O-N 3.12Å; N518-T520 PolarHBondContact O-N 3Å
519	T	27.9	Very low	39.5	Very low	135 Å²	135	99.3 Å²	99.3	83%	0.828	62%	0.623	S	S	*	*			trans	-68.1	86.5	164	-6.4	0	0	0	0	106.5	V521	T519-V521 PolarHBondContact O-N 3.39Å
520	T	31.8	Very low	41.3	Very low	125 Å²	125	94.9 Å²	94.9	77%	0.767	60%	0.596	S	S	*	*			trans	-58.2	112.4	161.8	49	0	0	0	0	105.1	N518 G522	N518-T520 PolarHBondContact O-N 3Å; T520-G522 PolarHBondContact O-N 3Å
521	V	40	Very low	43.5	Very low	141 Å²	141	89.5 Å²	89.5	86%	0.855	56%	0.558	S	S	*	*			trans	-72.2	67.1	174.7	-176.2	0	0	0	0	106.5	T519 L523	T519-V521 PolarHBondContact O-N 3.39Å; V521-L523 PolarHBondContact O-N 3.32Å
522	G	46.2	Very low	46	Very low	42 Å²	42	92.5 Å²	92.5	43%	0.433	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-64.9	131.6	174.6	0	0	0	0	0	108	T520	T520-G522 PolarHBondContact O-N 3Å
523	L	55.2	Low	48.5	Very low	48 Å²	48	89.5 Å²	89.5	25%	0.251	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-58.6	144.7	170.7	-75.1	94.7	0	0	0	109.5	V521 M527 Y528 I531 L627	V521-L523 PolarHBondContact O-N 3.32Å; L523-M527 HydrophobicContact CB-CB 4.21Å; L523-M527 HydrophobicContact CD2-CB 4.01Å; L523-M527 HydrophobicContact CD2-CE 3.26Å; L523-M527 HydrophobicContact CD2-CG 4.08Å; L523-Y528 HydrophobicContact CB-CD2 4.49Å; L523-Y528 HydrophobicContact CB-CE1 4.19Å; L523-Y528 HydrophobicContact CB-CE2 3.89Å; L523-Y528 HydrophobicContact CD1-CE1 4.47Å; L523-Y528 PolarHBondContact N-OH 3.23Å; L523-Y528 WeakPolarHBondContact O-CE2 3.47Å; L523-I531 HydrophobicContact CD2-CD1 4.48Å; L523-L627 HydrophobicContact CD2-CD2 3.94Å
524	H	53.1	Low	51.2	Low	58 Å²	58	84.3 Å²	84.3	27%	0.269	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-57.7	140.8	175.7	-178.9	-97.5	0	0	0	110.8	N503 K526 M527	N503-H524 WeakPolarHBondContact OD1-CB 3.23Å; H524-K526 WeakPolarHBondContact ND1-CB 3.26Å; H524-K526 PolarHBondContact ND1-N 3.48Å; H524-K526 PolarHBondContact O-N 3.13Å; H524-M527 WeakPolarHBondContact O-CA 3.43Å; H524-M527 WeakPolarHBondContact O-CB 3.18Å; H524-M527 PolarHBondContact O-N 3.22Å
525	P	56.4	Low	54	Low	98 Å²	98	79.7 Å²	79.7	64%	0.636	48%	0.476	S	S	*	.	H	α-helix	trans	-48.6	-36	-176.9	-31.5	35.8	0	0	0	114.9	M527 Y528 A529	P525-M527 VanDerWaalsContact C-N 3.31Å; P525-M527 PolarHBondContact O-N 3.44Å; P525-Y528 PolarHBondContact O-N 2.83Å; P525-A529 PolarHBondContact O-N 3.44Å
526	K	58.7	Low	56.7	Low	127 Å²	127	73.1 Å²	73.1	55%	0.552	44%	0.436	S	S	*	.	H	α-helix	trans	-67.8	-27.2	176.9	-62.9	-175.6	-178.3	179.8	0	113.7	I499 H524 A529 L530	I499-K526 HydrophobicContact CD1-CB 3.78Å; I499-K526 HydrophobicContact CG1-CB 3.97Å; I499-K526 HydrophobicContact CG1-CD 4.23Å; I499-K526 HydrophobicContact CG2-CB 4.04Å; H524-K526 WeakPolarHBondContact ND1-CB 3.26Å; H524-K526 PolarHBondContact ND1-N 3.48Å; H524-K526 PolarHBondContact O-N 3.13Å; K526-A529 WeakPolarHBondContact O-CB 3.41Å; K526-A529 PolarHBondContact O-N 2.87Å; K526-L530 PolarHBondContact O-N 3.44Å
527	M	59.4	Low	59.5	Low	5 Å²	5	67 Å²	67	3%	0.025	40%	0.398	C	S	.	.	H	α-helix	trans	-71.7	-37.9	175.2	-125.1	-54.4	-72.6	0	0	111.3	I499 L523 H524 P525 A529 L530 I531 F622 L627	I499-M527 HydrophobicContact CG2-CB 4.36Å; I499-M527 HydrophobicContact CG2-CG 4.11Å; L523-M527 HydrophobicContact CB-CB 4.21Å; L523-M527 HydrophobicContact CD2-CB 4.01Å; L523-M527 HydrophobicContact CD2-CE 3.26Å; L523-M527 HydrophobicContact CD2-CG 4.08Å; H524-M527 WeakPolarHBondContact O-CA 3.43Å; H524-M527 WeakPolarHBondContact O-CB 3.18Å; H524-M527 PolarHBondContact O-N 3.22Å; P525-M527 VanDerWaalsContact C-N 3.31Å; P525-M527 PolarHBondContact O-N 3.44Å; M527-A529 PolarHBondContact O-N 2.84Å; M527-L530 WeakPolarHBondContact O-CB 3.42Å; M527-L530 PolarHBondContact O-N 3.13Å; M527-L530 HydrophobicContact SD-CB 4.29Å; M527-L530 HydrophobicContact SD-CD1 4.04Å; M527-I531 HydrophobicContact CE-CD1 3.54Å; M527-I531 HydrophobicContact CE-CG1 3.73Å; M527-I531 WeakPolarHBondContact O-CG1 3.31Å; M527-I531 PolarHBondContact O-N 3.42Å; M527-F622 HydrophobicContact SD-CD1 4.44Å; M527-F622 HydrophobicContact SD-CE1 4.14Å; M527-L627 HydrophobicContact CE-CB 4.41Å; M527-L627 HydrophobicContact CE-CD1 3.31Å; M527-L627 HydrophobicContact CE-CD2 3.45Å; M527-L627 VanDerWaalsContact CE-CD2 3.45Å; M527-L627 HydrophobicContact CE-CG 3.87Å; M527-L627 HydrophobicContact SD-CD1 4.35Å
528	Y	65.2	Low	62.5	Low	39 Å²	39	68 Å²	68	15%	0.153	38%	0.379	C	S	.	.	H	α-helix	trans	-60.6	-34.9	171.9	-68.5	-64.7	0	0	0	112.1	L523 P525 L530 I531 R532 M740	L523-Y528 HydrophobicContact CB-CD2 4.49Å; L523-Y528 HydrophobicContact CB-CE1 4.19Å; L523-Y528 HydrophobicContact CB-CE2 3.89Å; L523-Y528 HydrophobicContact CD1-CE1 4.47Å; L523-Y528 PolarHBondContact N-OH 3.23Å; L523-Y528 WeakPolarHBondContact O-CE2 3.47Å; P525-Y528 PolarHBondContact O-N 2.83Å; Y528-L530 VanDerWaalsContact C-N 3.27Å; Y528-L530 PolarHBondContact O-N 3.43Å; Y528-I531 HydrophobicContact CD1-CD1 4.36Å; Y528-I531 PolarHBondContact O-N 2.63Å; Y528-R532 WeakPolarHBondContact O-CG 3.43Å; Y528-R532 PolarHBondContact O-N 2.86Å; Y528-R532 VanDerWaalsContact O-N 3.14Å; Y528-M740 HydrophobicContact CE1-CE 4.35Å; Y528-M740 HydrophobicContact CE1-CG 3.73Å; Y528-M740 HydrophobicContact CE1-SD 4.26Å; Y528-M740 HydrophobicContact CE2-CG 4.45Å; Y528-M740 HydrophobicContact CE2-SD 4.29Å; Y528-M740 WeakPolarHBondContact OH-CE 3.29Å; Y528-M740 PolarHBondContact OH-SD 3.24Å
529	A	66.7	Low	65.4	Low	65 Å²	65	62.8 Å²	62.8	54%	0.537	35%	0.348	S	S	.	.	H	α-helix	trans	-62.5	-33.5	174.8	0	0	0	0	0	112.8	P525 K526 M527	P525-A529 PolarHBondContact O-N 3.44Å; K526-A529 WeakPolarHBondContact O-CB 3.41Å; K526-A529 PolarHBondContact O-N 2.87Å; M527-A529 PolarHBondContact O-N 2.84Å
530	L	68.4	Low	68.4	Low	20 Å²	20	56.3 Å²	56.3	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-74.6	-26.2	175.8	-66	174.7	0	0	0	113.2	F492 A496 I499 K526 M527 Y528 F622 F631	F492-L530 HydrophobicContact CD2-CD2 4.25Å; F492-L530 HydrophobicContact CE2-CD2 3.6Å; F492-L530 HydrophobicContact CZ-CD2 4.01Å; A496-L530 HydrophobicContact CB-CD1 4.02Å; I499-L530 HydrophobicContact CD1-CD1 3.79Å; I499-L530 HydrophobicContact CD1-CG 4.18Å; K526-L530 PolarHBondContact O-N 3.44Å; M527-L530 WeakPolarHBondContact O-CB 3.42Å; M527-L530 PolarHBondContact O-N 3.13Å; M527-L530 HydrophobicContact SD-CB 4.29Å; M527-L530 HydrophobicContact SD-CD1 4.04Å; Y528-L530 VanDerWaalsContact C-N 3.27Å; Y528-L530 PolarHBondContact O-N 3.43Å; L530-F622 HydrophobicContact CB-CE1 3.98Å; L530-F622 HydrophobicContact CB-CZ 4.13Å; L530-F622 HydrophobicContact CD1-CE1 4.49Å; L530-F631 WeakPolarHBondContact O-CD2 3.46Å
531	I	72.4	Confident	71.2	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-79	-24.9	177.6	-66.4	171.4	0	0	0	111.6	L523 M527 Y528 L627 I630 N634	L523-I531 HydrophobicContact CD2-CD1 4.48Å; M527-I531 HydrophobicContact CE-CD1 3.54Å; M527-I531 HydrophobicContact CE-CG1 3.73Å; M527-I531 WeakPolarHBondContact O-CG1 3.31Å; M527-I531 PolarHBondContact O-N 3.42Å; Y528-I531 HydrophobicContact CD1-CD1 4.36Å; Y528-I531 PolarHBondContact O-N 2.63Å; I531-L627 HydrophobicContact CD1-CD2 3.82Å; I531-L627 HydrophobicContact CG1-CD2 4.45Å; I531-I630 HydrophobicContact CG2-CB 4.03Å; I531-I630 HydrophobicContact CG2-CG2 3.25Å; I531-N634 WeakPolarHBondContact CG2-ND2 3.43Å; I531-N634 PolarHBondContact O-ND2 3.16Å
532	R	79.4	Confident	73.5	Confident	151 Å²	151	46 Å²	46	57%	0.57	24%	0.243	S	C	*	.	S	Bend	trans	-63.8	157.1	177.5	-77.4	-178.7	-177.9	-168.8	0.4	111.4	Y528 H534	Y528-R532 WeakPolarHBondContact O-CG 3.43Å; Y528-R532 PolarHBondContact O-N 2.86Å; Y528-R532 VanDerWaalsContact O-N 3.14Å; R532-H534 PolarHBondContact O-N 3.02Å
533	P	79.9	Confident	75.6	Confident	55 Å²	55	44 Å²	44	36%	0.357	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-53.3	128.7	176.8	-25	33.3	0	0	0	111.7	N634 L638	P533-N634 HydrophobicContact CG-CB 4.3Å; P533-L638 HydrophobicContact CB-CB 4.01Å; P533-L638 HydrophobicContact CB-CD2 3.4Å; P533-L638 VanDerWaalsContact CB-CD2 3.4Å; P533-L638 HydrophobicContact CB-CG 4.26Å; P533-L638 HydrophobicContact CG-CB 4.07Å; P533-L638 HydrophobicContact CG-CD2 4.17Å
534	H	83.1	Confident	77.3	Confident	29 Å²	29	41.8 Å²	41.8	13%	0.134	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-70.4	149	-179.7	-168	-91.8	0	0	0	110.1	R532 I536 A537 R538 F631 N635	R532-H534 PolarHBondContact O-N 3.02Å; H534-I536 HydrophobicContact CB-CG2 4.19Å; H534-I536 WeakPolarHBondContact ND1-CB 3.47Å; H534-I536 WeakPolarHBondContact ND1-CG2 3.33Å; H534-I536 PolarHBondContact ND1-N 2.89Å; H534-I536 VanDerWaalsContact ND1-N 3.16Å; H534-I536 PolarHBondContact O-N 2.95Å; H534-A537 WeakPolarHBondContact O-CB 3.41Å; H534-A537 PolarHBondContact O-N 3.26Å; H534-R538 PolarHBondContact O-N 3.36Å; H534-F631 HydrophobicContact CB-CE2 4.18Å; H534-F631 HydrophobicContact CB-CZ 4.16Å; H534-N635 WeakPolarHBondContact CB-OD1 3.46Å; H534-N635 PolarHBondContact N-OD1 2.79Å
535	S	82.5	Confident	78.9	Confident	50 Å²	50	39 Å²	39	35%	0.35	20%	0.197	S	C	.	.	H	α-helix	trans	-55.5	-30.2	178.4	61.9	0	0	0	0	112.9	R538 R539	S535-R538 PolarHBondContact O-N 3.48Å; S535-R539 WeakPolarHBondContact O-CG 3.41Å; S535-R539 PolarHBondContact O-N 3.46Å
536	I	84.7	Confident	80.3	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.5	-36.9	175.4	-157.4	151.8	0	0	0	113.1	L267 M483 L487 H534 R539 Y540 F611 V614	L267-I536 WeakPolarHBondContact O-CD1 3.41Å; M483-I536 HydrophobicContact CE-CD1 4.37Å; M483-I536 HydrophobicContact CE-CG1 4.45Å; M483-I536 HydrophobicContact CG-CD1 4.43Å; L487-I536 HydrophobicContact CD1-CD1 3.52Å; L487-I536 HydrophobicContact CD2-CD1 4.42Å; H534-I536 HydrophobicContact CB-CG2 4.19Å; H534-I536 WeakPolarHBondContact ND1-CB 3.47Å; H534-I536 WeakPolarHBondContact ND1-CG2 3.33Å; H534-I536 PolarHBondContact ND1-N 2.89Å; H534-I536 VanDerWaalsContact ND1-N 3.16Å; H534-I536 PolarHBondContact O-N 2.95Å; I536-R539 PolarHBondContact O-N 2.82Å; I536-Y540 WeakPolarHBondContact O-CB 3.49Å; I536-Y540 PolarHBondContact O-N 2.95Å; I536-F611 HydrophobicContact CG2-CE2 4.29Å; I536-V614 HydrophobicContact CD1-CG1 4.19Å; I536-V614 HydrophobicContact CG2-CG1 4.29Å
537	A	88.1	Confident	81.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.1	-41.3	176.3	0	0	0	0	0	110.5	H534 A541 F611 N635 L638 V639	H534-A537 WeakPolarHBondContact O-CB 3.41Å; H534-A537 PolarHBondContact O-N 3.26Å; A537-A541 WeakPolarHBondContact O-CB 3.23Å; A537-A541 PolarHBondContact O-N 2.96Å; A537-F611 HydrophobicContact CB-CE2 3.81Å; A537-F611 HydrophobicContact CB-CZ 3.71Å; A537-N635 HydrophobicContact CB-CB 4.08Å; A537-N635 WeakPolarHBondContact CB-OD1 3.39Å; A537-L638 HydrophobicContact CB-CD2 4.37Å; A537-V639 HydrophobicContact CB-CG2 4.37Å
538	R	87.9	Confident	83.1	Confident	99 Å²	99	29.2 Å²	29.2	37%	0.374	15%	0.145	S	C	.	.	H	α-helix	trans	-61.7	-50	174.1	-171.7	67.6	-173.3	-173.1	4.1	112	H534 S535 A541 E542 L638 V642	H534-R538 PolarHBondContact O-N 3.36Å; S535-R538 PolarHBondContact O-N 3.48Å; R538-A541 PolarHBondContact O-N 2.9Å; R538-E542 IonicContact CZ-OE1 3.71Å; R538-E542 IonicContact NE-OE1 2.75Å; R538-E542 PolarHBondContact NE-OE1 2.83Å; R538-E542 IonicContact NH2-OE1 3.42Å; R538-E542 PolarHBondContact NH2-OE1 2.76Å; R538-E542 WeakPolarHBondContact O-CB 3.14Å; R538-E542 WeakPolarHBondContact O-CG 3.39Å; R538-E542 PolarHBondContact O-N 3.01Å; R538-L638 HydrophobicContact CB-CD2 3.93Å; R538-V642 VanDerWaalsContact NH1-CG2 3.29Å
539	R	86.8	Confident	83.9	Confident	29 Å²	29	28.5 Å²	28.5	11%	0.109	15%	0.146	C	C	.	.	H	α-helix	trans	-63.4	-41.8	179.6	-71.7	-174.3	-71.1	-171.2	-0.2	112.9	L266 L267 K269 F310 S535 I536 L543	L266-R539 PolarHBondContact O-NH1 2.88Å; L267-R539 HydrophobicContact CG-CB 4.34Å; L267-R539 PolarHBondContact O-NH2 3.48Å; K269-R539 VanDerWaalsContact O-CZ 3.26Å; K269-R539 PolarHBondContact O-NH1 2.82Å; K269-R539 PolarHBondContact O-NH2 2.8Å; F310-R539 HydrophobicContact CD2-CB 4.09Å; F310-R539 HydrophobicContact CD2-CG 3.71Å; F310-R539 HydrophobicContact CE2-CB 4.47Å; F310-R539 VanDerWaalsContact CE2-CD 3.48Å; F310-R539 HydrophobicContact CE2-CG 3.98Å; F310-R539 HydrophobicContact CG-CB 4.29Å; F310-R539 HydrophobicContact CG-CG 4.38Å; S535-R539 WeakPolarHBondContact O-CG 3.41Å; S535-R539 PolarHBondContact O-N 3.46Å; I536-R539 PolarHBondContact O-N 2.82Å; R539-L543 WeakPolarHBondContact O-CB 3.37Å; R539-L543 PolarHBondContact O-N 2.74Å
540	Y	91	Very high	84.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.1	-48.8	173.1	169	-99.4	0	0	0	111	I536 E542 L543 A544 L607 Q608 F611 V639	I536-Y540 WeakPolarHBondContact O-CB 3.49Å; I536-Y540 PolarHBondContact O-N 2.95Å; Y540-E542 PolarHBondContact O-N 2.86Å; Y540-L543 PolarHBondContact O-N 2.99Å; Y540-A544 VanDerWaalsContact O-CB 3.23Å; Y540-A544 WeakPolarHBondContact O-CB 3.46Å; Y540-A544 PolarHBondContact O-N 3.48Å; Y540-L607 HydrophobicContact CD2-CD2 3.55Å; Y540-L607 HydrophobicContact CD2-CG 3.67Å; Y540-L607 HydrophobicContact CE2-CB 4.12Å; Y540-L607 HydrophobicContact CE2-CD2 3.61Å; Y540-L607 HydrophobicContact CE2-CG 3.62Å; Y540-Q608 WeakPolarHBondContact OH-CA 3.16Å; Y540-Q608 VanDerWaalsContact OH-CB 3.31Å; Y540-Q608 WeakPolarHBondContact OH-CB 3.43Å; Y540-F611 AromaticContact CD1-CD1 3.84Å; Y540-F611 HydrophobicContact CD1-CD1 3.84Å; Y540-F611 HydrophobicContact CD1-CD2 4.16Å; Y540-F611 AromaticContact CD1-CE1 3.96Å; Y540-F611 HydrophobicContact CD1-CE1 3.96Å; Y540-F611 HydrophobicContact CD1-CE2 4.28Å; Y540-F611 AromaticContact CD1-CG 3.92Å; Y540-F611 HydrophobicContact CD1-CG 3.92Å; Y540-F611 HydrophobicContact CD1-CZ 4.15Å; Y540-F611 HydrophobicContact CD2-CB 4.1Å; Y540-F611 HydrophobicContact CD2-CG 4.25Å; Y540-F611 AromaticContact CE1-CD1 3.86Å; Y540-F611 HydrophobicContact CE1-CD1 3.86Å; Y540-F611 HydrophobicContact CE1-CE1 4.16Å; Y540-F611 HydrophobicContact CE1-CG 4.23Å; Y540-F611 HydrophobicContact CE2-CB 4.18Å; Y540-F611 HydrophobicContact CG-CB 4.3Å; Y540-F611 HydrophobicContact CG-CD1 4.34Å; Y540-F611 AromaticContact CG-CD2 3.98Å; Y540-F611 HydrophobicContact CG-CD2 3.98Å; Y540-F611 HydrophobicContact CG-CE2 4.39Å; Y540-F611 AromaticContact CG-CG 3.94Å; Y540-F611 HydrophobicContact CG-CG 3.94Å; Y540-V639 HydrophobicContact CD1-CG1 4.18Å; Y540-V639 HydrophobicContact CD1-CG2 3.96Å; Y540-V639 HydrophobicContact CE1-CG1 3.82Å; Y540-V639 HydrophobicContact CE1-CG2 4.36Å
541	A	89.8	Confident	84.8	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.7	-43.6	-179	0	0	0	0	0	112.3	A537 R538 A545 V639 V642	A537-A541 WeakPolarHBondContact O-CB 3.23Å; A537-A541 PolarHBondContact O-N 2.96Å; R538-A541 PolarHBondContact O-N 2.9Å; A541-A545 WeakPolarHBondContact O-CB 3.18Å; A541-A545 PolarHBondContact O-N 3.23Å; A541-V639 HydrophobicContact CB-CB 4.38Å; A541-V639 HydrophobicContact CB-CG2 4.1Å; A541-V642 HydrophobicContact CB-CB 3.82Å; A541-V642 HydrophobicContact CB-CG1 3.81Å; A541-V642 HydrophobicContact CB-CG2 4.25Å
542	E	89.3	Confident	84.8	Confident	49 Å²	49	26.6 Å²	26.6	23%	0.229	13%	0.126	C	C	.	.	H	α-helix	trans	-63.9	-45.2	176.8	-73.3	176	178.4	0	0	111.7	F310 R538 Y540 A545 S546	F310-E542 HydrophobicContact CB-CB 4.11Å; F310-E542 CarbonylContact O-C 3.57Å; R538-E542 IonicContact CZ-OE1 3.71Å; R538-E542 IonicContact NE-OE1 2.75Å; R538-E542 PolarHBondContact NE-OE1 2.83Å; R538-E542 IonicContact NH2-OE1 3.42Å; R538-E542 PolarHBondContact NH2-OE1 2.76Å; R538-E542 WeakPolarHBondContact O-CB 3.14Å; R538-E542 WeakPolarHBondContact O-CG 3.39Å; R538-E542 PolarHBondContact O-N 3.01Å; Y540-E542 PolarHBondContact O-N 2.86Å; E542-A545 PolarHBondContact O-N 2.65Å; E542-S546 VanDerWaalsContact O-CB 3.32Å; E542-S546 WeakPolarHBondContact O-CB 3.49Å; E542-S546 PolarHBondContact O-N 3.02Å; E542-S546 PolarHBondContact O-OG 2.85Å
543	L	89.7	Confident	83.9	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-63.9	-48.1	177.6	178.2	62.7	0	0	0	110.6	L267 F310 I433 L476 R539 Y540 A545 S546 L547 L607	L267-L543 HydrophobicContact CD1-CD2 3.49Å; L267-L543 VanDerWaalsContact CD1-CD2 3.49Å; L267-L543 HydrophobicContact CD2-CD2 4.36Å; F310-L543 HydrophobicContact CB-CB 4.35Å; F310-L543 HydrophobicContact CD1-CB 4.42Å; F310-L543 VanDerWaalsContact O-CA 3.27Å; F310-L543 WeakPolarHBondContact O-CA 3.48Å; F310-L543 PolarHBondContact O-N 3.42Å; F310-L543 VanDerWaalsContact O-N 3.11Å; I433-L543 HydrophobicContact CD1-CD1 4.32Å; I433-L543 HydrophobicContact CG1-CD1 4.22Å; L476-L543 HydrophobicContact CD2-CD2 4.47Å; R539-L543 WeakPolarHBondContact O-CB 3.37Å; R539-L543 PolarHBondContact O-N 2.74Å; Y540-L543 PolarHBondContact O-N 2.99Å; L543-A545 PolarHBondContact O-N 3.19Å; L543-S546 PolarHBondContact O-N 3.28Å; L543-L547 HydrophobicContact CD1-CD1 4.27Å; L543-L547 HydrophobicContact CD1-CG 4.18Å; L543-L547 HydrophobicContact CG-CD1 4.05Å; L543-L547 HydrophobicContact CG-CG 4.38Å; L543-L547 WeakPolarHBondContact O-CB 3.35Å; L543-L547 VanDerWaalsContact O-CG 3.23Å; L543-L547 WeakPolarHBondContact O-CG 3.48Å; L543-L547 PolarHBondContact O-N 3.41Å; L543-L607 HydrophobicContact CD2-CD2 4Å
544	A	90	Very high	82.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.2	-45.5	178.9	0	0	0	0	0	111.2	Y540 S546 L547 H548 L604 L643	Y540-A544 VanDerWaalsContact O-CB 3.23Å; Y540-A544 WeakPolarHBondContact O-CB 3.46Å; Y540-A544 PolarHBondContact O-N 3.48Å; A544-S546 PolarHBondContact O-N 3.33Å; A544-L547 PolarHBondContact O-N 3.04Å; A544-H548 PolarHBondContact O-CD2 3.46Å; A544-H548 VanDerWaalsContact O-CD2 3.23Å; A544-H548 PolarHBondContact O-N 3.4Å; A544-L604 HydrophobicContact CB-CD2 3.96Å; A544-L643 HydrophobicContact CB-CD2 3.92Å
545	A	87.6	Confident	80.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.2	-46.9	175	0	0	0	0	0	111.7	A541 E542 L543 L547 H548 S549 V642 L643 H646	A541-A545 WeakPolarHBondContact O-CB 3.18Å; A541-A545 PolarHBondContact O-N 3.23Å; E542-A545 PolarHBondContact O-N 2.65Å; L543-A545 PolarHBondContact O-N 3.19Å; A545-L547 VanDerWaalsContact C-N 3.33Å; A545-L547 PolarHBondContact O-N 3.05Å; A545-H548 PolarHBondContact O-N 2.89Å; A545-H548 VanDerWaalsContact O-N 3.17Å; A545-S549 PolarHBondContact O-N 3.4Å; A545-S549 PolarHBondContact O-OG 3.44Å; A545-S549 VanDerWaalsContact O-OG 3.08Å; A545-V642 HydrophobicContact CB-CG1 4.18Å; A545-L643 HydrophobicContact CB-CD2 4.05Å; A545-H646 HydrophobicContact CB-CB 3.84Å
546	S	86.7	Confident	78.5	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-63.2	-38.6	178.4	-56.7	0	0	0	0	112.4	F310 L312 E542 L543 A544 S549 I550	F310-S546 PolarHBondContact O-OG 3.32Å; L312-S546 PolarHBondContact N-OG 2.75Å; E542-S546 VanDerWaalsContact O-CB 3.32Å; E542-S546 WeakPolarHBondContact O-CB 3.49Å; E542-S546 PolarHBondContact O-N 3.02Å; E542-S546 PolarHBondContact O-OG 2.85Å; L543-S546 PolarHBondContact O-N 3.28Å; A544-S546 PolarHBondContact O-N 3.33Å; S546-S549 PolarHBondContact O-N 3.17Å; S546-I550 PolarHBondContact O-N 3.19Å; S546-I550 VanDerWaalsContact O-N 3.09Å
547	L	88.8	Confident	76.3	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-66.6	-37.8	174.1	-71.4	176.5	0	0	0	112	L436 L476 L543 A544 A545 G551 I600 L604	L436-L547 HydrophobicContact CD1-CD2 3.22Å; L476-L547 HydrophobicContact CD1-CD2 4.47Å; L476-L547 HydrophobicContact CD2-CD1 3.98Å; L476-L547 HydrophobicContact CD2-CD2 4.34Å; L543-L547 HydrophobicContact CD1-CD1 4.27Å; L543-L547 HydrophobicContact CD1-CG 4.18Å; L543-L547 HydrophobicContact CG-CD1 4.05Å; L543-L547 HydrophobicContact CG-CG 4.38Å; L543-L547 WeakPolarHBondContact O-CB 3.35Å; L543-L547 VanDerWaalsContact O-CG 3.23Å; L543-L547 WeakPolarHBondContact O-CG 3.48Å; L543-L547 PolarHBondContact O-N 3.41Å; A544-L547 PolarHBondContact O-N 3.04Å; A545-L547 VanDerWaalsContact C-N 3.33Å; A545-L547 PolarHBondContact O-N 3.05Å; L547-G551 WeakPolarHBondContact O-CA 3.3Å; L547-G551 PolarHBondContact O-N 2.73Å; L547-I600 HydrophobicContact CB-CG2 4.06Å; L547-I600 HydrophobicContact CD2-CG2 4.32Å; L547-L604 HydrophobicContact CB-CD1 4.33Å; L547-L604 HydrophobicContact CB-CD2 4.13Å; L547-L604 HydrophobicContact CD1-CD2 3.59Å; L547-L604 HydrophobicContact CD1-CG 4.11Å; L547-L604 HydrophobicContact CG-CD2 4.5Å
548	H	86.5	Confident	73.9	Confident	19 Å²	19	34.3 Å²	34.3	9%	0.088	19%	0.189	C	C	.	.	H	α-helix	trans	-65.6	-45	172.5	-86.4	-83.3	0	0	0	111.2	A544 A545 I550 H552 L596 A648 S651 E653	A544-H548 PolarHBondContact O-CD2 3.46Å; A544-H548 VanDerWaalsContact O-CD2 3.23Å; A544-H548 PolarHBondContact O-N 3.4Å; A545-H548 PolarHBondContact O-N 2.89Å; A545-H548 VanDerWaalsContact O-N 3.17Å; H548-I550 PolarHBondContact O-N 3.17Å; H548-H552 PolarHBondContact O-CD2 3.26Å; H548-H552 PolarHBondContact O-NE2 3.47Å; H548-L596 VanDerWaalsContact CE1-CD1 3.41Å; H548-L596 WeakPolarHBondContact CE1-CD1 3.42Å; H548-L596 WeakPolarHBondContact ND1-CD1 3.3Å; H548-A648 HydrophobicContact CB-CB 3.78Å; H548-S651 VanDerWaalsContact CE1-CB 3.47Å; H548-S651 WeakPolarHBondContact CE1-CB 3.32Å; H548-E653 IonicContact CD2-OE1 3.33Å; H548-E653 IonicContact CE1-OE1 3.45Å; H548-E653 IonicContact CE1-OE2 2.79Å; H548-E653 IonicContact NE2-OE1 2.58Å; H548-E653 PolarHBondContact NE2-OE1 2.91Å; H548-E653 IonicContact NE2-OE2 2.84Å
549	S	82.8	Confident	71.6	Confident	25 Å²	25	32.1 Å²	32.1	18%	0.175	18%	0.184	C	C	.	.	H	α-helix	trans	-66.7	-32.6	-178.4	-54.2	0	0	0	0	113.9	A545 S546	A545-S549 PolarHBondContact O-N 3.4Å; A545-S549 PolarHBondContact O-OG 3.44Å; A545-S549 VanDerWaalsContact O-OG 3.08Å; S546-S549 PolarHBondContact O-N 3.17Å
550	I	79.5	Confident	69.2	Low	2 Å²	2	35.3 Å²	35.3	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-109.6	-26.5	-173.7	-70.2	178.2	0	0	0	113.5	L312 A316 I433 L436 I437 Q440 S546 H548 H552	L312-I550 HydrophobicContact CD1-CD1 3.21Å; L312-I550 HydrophobicContact CD1-CG1 4.36Å; L312-I550 HydrophobicContact CD2-CD1 3.43Å; L312-I550 VanDerWaalsContact CD2-CD1 3.43Å; L312-I550 HydrophobicContact CD2-CG1 3.66Å; L312-I550 HydrophobicContact CG-CD1 3.88Å; A316-I550 HydrophobicContact CB-CD1 4.18Å; I433-I550 HydrophobicContact CG2-CD1 4.37Å; L436-I550 HydrophobicContact CB-CG2 3.88Å; I437-I550 HydrophobicContact CD1-CD1 4.47Å; I437-I550 HydrophobicContact CG1-CD1 3.79Å; Q440-I550 HydrophobicContact CG-CG2 3.67Å; Q440-I550 PolarHBondContact NE2-O 2.82Å; S546-I550 PolarHBondContact O-N 3.19Å; S546-I550 VanDerWaalsContact O-N 3.09Å; H548-I550 PolarHBondContact O-N 3.17Å; I550-H552 PolarHBondContact O-N 3.21Å
551	G	74.7	Confident	66.3	Low	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.231	C	C	.	.			trans	-74.2	13	-167.3	0	0	0	0	0	115.9	L547 D597	L547-G551 WeakPolarHBondContact O-CA 3.3Å; L547-G551 PolarHBondContact O-N 2.73Å; G551-D597 PolarHBondContact O-N 3.48Å
552	H	72.2	Confident	63.4	Low	45 Å²	45	48.8 Å²	48.8	21%	0.208	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-68.5	144.2	179.3	-65.9	-67.7	0	0	0	112.3	Q440 H548 I550 T557 P594	Q440-H552 PolarHBondContact NE2-O 3.28Å; H548-H552 PolarHBondContact O-CD2 3.26Å; H548-H552 PolarHBondContact O-NE2 3.47Å; I550-H552 PolarHBondContact O-N 3.21Å; H552-T557 HydrophobicContact CB-CG2 4.49Å; H552-P594 HydrophobicContact CB-CB 4.14Å; H552-P594 HydrophobicContact CB-CG 4.34Å; H552-P594 PolarHBondContact CE1-O 3.15Å; H552-P594 PolarHBondContact ND1-O 3.05Å
553	Q	59.4	Low	60.5	Low	80 Å²	80	50 Å²	50	37%	0.374	29%	0.285	S	S	.	.			trans	-65.2	154.5	169	-68	-173.3	-25.8	0	0	111.6	A595 D597	Q553-A595 WeakPolarHBondContact CB-O 3.36Å; Q553-A595 PolarHBondContact N-O 3.02Å; Q553-D597 HydrophobicContact CG-CB 3.98Å
554	F	49.7	Very low	57.5	Low	94 Å²	94	56.7 Å²	56.7	41%	0.412	33%	0.326	S	S	.	.	S	Bend	trans	-34.3	152	153.9	-147.9	-97.5	0	0	0	112.9	H443	H443-F554 HydrophobicContact CB-CD2 4.34Å; H443-F554 HydrophobicContact CB-CE2 4.49Å; H443-F554 AromaticContact CD2-CD2 3.68Å; H443-F554 AromaticContact CD2-CE2 3.93Å; H443-F554 AromaticContact CG-CD2 3.98Å
555	P	44.6	Very low	54.5	Low	87 Å²	87	61.1 Å²	61.1	57%	0.565	36%	0.357	S	S	*	.	S	Bend	cis	-118.4	155.5	-33.1	35.2	-20.6	0	0	0	111.4
556	G	38.7	Very low	51.4	Low	51 Å²	51	70.7 Å²	70.7	53%	0.526	40%	0.399	S	S	.	.			trans	110.3	24.7	166.5	0	0	0	0	0	117.3	P558	G556-P558 WeakPolarHBondContact O-CD 3.46Å
557	T	38.9	Very low	48.4	Very low	32 Å²	32	76.3 Å²	76.3	20%	0.196	44%	0.438	C	S	.	.			trans	-69.8	116.1	166.4	23.7	0	0	0	0	111.4	H552 L559 P594	H552-T557 HydrophobicContact CB-CG2 4.49Å; T557-L559 VanDerWaalsContact C-N 3.32Å; T557-L559 PolarHBondContact O-N 3.3Å; T557-P594 HydrophobicContact CG2-CB 4.37Å; T557-P594 HydrophobicContact CG2-CG 3.52Å
558	P	37.5	Very low	45.4	Very low	102 Å²	102	85 Å²	85	66%	0.662	48%	0.476	S	S	*	.			trans	-73.4	95.9	141.5	30.9	-26.9	0	0	0	105.8	G556 F560	G556-P558 WeakPolarHBondContact O-CD 3.46Å; P558-F560 PolarHBondContact O-N 2.82Å; P558-F560 VanDerWaalsContact O-N 3.12Å
559	L	39.9	Very low	42.3	Very low	53 Å²	53	89.7 Å²	89.7	28%	0.277	51%	0.511	S	S	.	.	S	Bend	trans	-66.6	-11	-178.1	-127.9	151.3	0	0	0	112	L320 T557	L320-L559 HydrophobicContact CD1-CD1 4.38Å; T557-L559 VanDerWaalsContact C-N 3.32Å; T557-L559 PolarHBondContact O-N 3.3Å
560	F	36.5	Very low	39.7	Very low	96 Å²	96	93.8 Å²	93.8	42%	0.421	54%	0.539	S	S	.	.	S	Bend	trans	-138.7	122.3	173.5	-60.6	-78.6	0	0	0	107.6	L317 P558 D562	L317-F560 HydrophobicContact CD1-CE1 3.98Å; L317-F560 HydrophobicContact CD1-CZ 4.03Å; L317-F560 HydrophobicContact CD2-CD1 3.69Å; L317-F560 HydrophobicContact CD2-CD2 3.28Å; L317-F560 HydrophobicContact CD2-CE1 3.55Å; L317-F560 HydrophobicContact CD2-CE2 3.14Å; L317-F560 HydrophobicContact CD2-CG 3.57Å; L317-F560 HydrophobicContact CD2-CZ 3.3Å; L317-F560 HydrophobicContact CG-CD1 4.38Å; L317-F560 HydrophobicContact CG-CD2 4.24Å; L317-F560 HydrophobicContact CG-CE1 3.74Å; L317-F560 HydrophobicContact CG-CE2 3.59Å; L317-F560 HydrophobicContact CG-CZ 3.32Å; P558-F560 PolarHBondContact O-N 2.82Å; P558-F560 VanDerWaalsContact O-N 3.12Å; F560-D562 PolarHBondContact O-N 2.95Å
561	D	28.8	Very low	37	Very low	125 Å²	125	102.3 Å²	102.3	67%	0.668	58%	0.579	S	S	*	*			trans	-66.9	123.5	178.4	-156.6	9.8	0	0	0	108.8	S563	D561-S563 PolarHBondContact O-N 3.46Å; D561-S563 WeakPolarHBondContact OD2-CB 3.37Å; D561-S563 PolarHBondContact OD2-OG 3.47Å
562	D	28.6	Very low	34.6	Very low	158 Å²	158	107.8 Å²	107.8	85%	0.845	62%	0.617	S	S	*	*			trans	-74.2	20.4	173.2	-101.8	-20.2	0	0	0	111.8	F560 T564	F560-D562 PolarHBondContact O-N 2.95Å; D562-T564 VanDerWaalsContact C-N 3.34Å; D562-T564 PolarHBondContact O-N 3.43Å
563	S	29.7	Very low	32.5	Very low	74 Å²	74	110.8 Å²	110.8	52%	0.517	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.8	19.1	-170.6	71	0	0	0	0	114.8	D561 S565	D561-S563 PolarHBondContact O-N 3.46Å; D561-S563 WeakPolarHBondContact OD2-CB 3.37Å; D561-S563 PolarHBondContact OD2-OG 3.47Å; S563-S565 PolarHBondContact O-N 2.94Å; S563-S565 VanDerWaalsContact O-N 3.16Å
564	T	27	Very low	30.7	Very low	142 Å²	142	114.7 Å²	114.7	87%	0.871	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	5.5	167.4	50.8	0	0	0	0	113.9	D562	D562-T564 VanDerWaalsContact C-N 3.34Å; D562-T564 PolarHBondContact O-N 3.43Å
565	S	25.6	Very low	29.7	Very low	93 Å²	93	118 Å²	118	65%	0.65	69%	0.687	S	S	*	*	S	Bend	trans	-147	79.3	172	61.8	0	0	0	0	113.8	S563	S563-S565 PolarHBondContact O-N 2.94Å; S563-S565 VanDerWaalsContact O-N 3.16Å
566	K	24.3	Very low	28.5	Very low	202 Å²	202	122.2 Å²	122.2	88%	0.878	70%	0.7	S	S	*	*			trans	-166.6	62.8	152.9	-106.8	160.6	-165.1	-177	0	112.6	K568	K566-K568 VanDerWaalsContact C-N 3.29Å; K566-K568 PolarHBondContact O-N 3.17Å; K566-K568 VanDerWaalsContact O-N 3.15Å
567	S	23.5	Very low	28	Very low	120 Å²	120	130 Å²	130	84%	0.839	72%	0.715	S	S	*	*			trans	-76.3	84.8	153	58.2	0	0	0	0	108.8
568	K	24.8	Very low	27.1	Very low	186 Å²	186	133.1 Å²	133.1	81%	0.809	74%	0.738	S	S	*	*			trans	-131.7	86.3	157.5	-82.7	-167.5	176.7	-178	0	108.4	K566 S570	K566-K568 VanDerWaalsContact C-N 3.29Å; K566-K568 PolarHBondContact O-N 3.17Å; K566-K568 VanDerWaalsContact O-N 3.15Å; K568-S570 PolarHBondContact O-N 2.88Å
569	S	21.8	Very low	26.5	Very low	117 Å²	117	135.7 Å²	135.7	82%	0.818	75%	0.745	S	S	*	*			trans	-49.8	113.4	151.6	47.9	0	0	0	0	108.8
570	S	28.7	Very low	25.7	Very low	110 Å²	110	141.6 Å²	141.6	77%	0.769	77%	0.771	S	S	*	*			trans	-132.9	95.4	160.4	-65.9	0	0	0	0	106.1	K568	K568-S570 PolarHBondContact O-N 2.88Å
571	E	21.5	Very low	25.4	Very low	182 Å²	182	143.7 Å²	143.7	85%	0.85	79%	0.792	S	S	*	*			trans	-46	141.7	159.1	-61.2	166.4	144	0	0	109.7
572	S	25.7	Very low	25.1	Very low	114 Å²	114	145.4 Å²	145.4	80%	0.797	80%	0.796	S	S	*	*			trans	177.1	125.4	134.2	-76.2	0	0	0	0	111.9
573	S	28	Very low	25	Very low	108 Å²	108	143.9 Å²	143.9	76%	0.755	79%	0.794	S	S	*	*			trans	66.6	102.3	141.2	50.5	0	0	0	0	121.3
574	N	20.3	Very low	24.9	Very low	162 Å²	162	145.9 Å²	145.9	87%	0.866	80%	0.804	S	S	*	*				13.2	119.6	123.5	-76.5	-21.2	0	0	0	117.4
575	L	28.7	Very low	24.8	Very low	163 Å²	163	148.5 Å²	148.5	85%	0.853	80%	0.803	S	S	*	*			trans	-146.6	106.9	143.3	-99.9	159.9	0	0	0	108.8	Y577	L575-Y577 HydrophobicContact CD2-CD2 4.47Å
576	Q	20.8	Very low	24.8	Very low	177 Å²	177	151.6 Å²	151.6	83%	0.827	81%	0.808	S	S	*	*			trans	-92.6	114.3	174.7	179.3	167.3	2	0	0	107.9
577	Y	27.1	Very low	25	Very low	215 Å²	215	148.9 Å²	148.9	84%	0.843	80%	0.798	S	S	*	*			trans	-139.9	110.8	160.9	-97.1	-75.3	0	0	0	109.5	L575	L575-Y577 HydrophobicContact CD2-CD2 4.47Å
578	S	20.2	Very low	25.1	Very low	96 Å²	96	150 Å²	150	67%	0.671	80%	0.795	S	S	*	*			trans	-78.1	134.1	160.8	-63.6	0	0	0	0	109
579	L	25.6	Very low	25.3	Very low	157 Å²	157	148.8 Å²	148.8	82%	0.822	79%	0.791	S	S	*	*			trans	178.6	129.8	131.2	-119.1	79	0	0	0	110.2
580	H	23.5	Very low	25.8	Very low	176 Å²	176	146.6 Å²	146.6	82%	0.815	78%	0.781	S	S	*	*			trans	16.3	117.5	152.2	-74.4	-89.4	0	0	0	118.9
581	T	29.2	Very low	26.2	Very low	141 Å²	141	149 Å²	149	87%	0.865	79%	0.785	S	S	*	*				-168.9	148	124.9	-58.5	0	0	0	0	108.1
582	E	22.8	Very low	27.2	Very low	160 Å²	160	147.7 Å²	147.7	75%	0.748	78%	0.783	S	S	*	*			trans	-37.5	153.3	-169.3	-67.8	176.2	142.4	0	0	119.6	T584	E582-T584 VanDerWaalsContact C-N 3.31Å; E582-T584 PolarHBondContact O-N 3.35Å
583	P	27.3	Very low	28.4	Very low	126 Å²	126	149.6 Å²	149.6	82%	0.818	78%	0.777	S	S	*	*			trans	-73.3	85.4	178.6	33	-33	0	0	0	109.6	F585	P583-F585 PolarHBondContact O-N 3.35Å; P583-F585 VanDerWaalsContact O-N 3.16Å
584	T	26.3	Very low	29.7	Very low	116 Å²	116	146.7 Å²	146.7	71%	0.712	76%	0.755	S	S	*	*			trans	-71.1	110.4	162.8	-34.3	0	0	0	0	106	E582 Q586	E582-T584 VanDerWaalsContact C-N 3.31Å; E582-T584 PolarHBondContact O-N 3.35Å; T584-Q586 PolarHBondContact O-N 3.4Å
585	F	25.7	Very low	32.1	Very low	197 Å²	197	142 Å²	142	86%	0.864	74%	0.739	S	S	*	*			trans	-65.5	69.5	179.9	-140.2	-96.2	0	0	0	109.6	P583 Q587	P583-F585 PolarHBondContact O-N 3.35Å; P583-F585 VanDerWaalsContact O-N 3.16Å; F585-Q587 PolarHBondContact O-N 2.89Å; F585-Q587 VanDerWaalsContact O-N 3.11Å
586	Q	25.4	Very low	34.5	Very low	158 Å²	158	135.8 Å²	135.8	74%	0.738	71%	0.707	S	S	*	*			trans	-75.3	101.5	172.5	-77.5	179.6	-16.4	0	0	107.2	T584 N588	T584-Q586 PolarHBondContact O-N 3.4Å; Q586-N588 VanDerWaalsContact C-N 3.28Å; Q586-N588 PolarHBondContact O-N 2.76Å
587	Q	27.8	Very low	37.6	Very low	146 Å²	146	127.8 Å²	127.8	68%	0.682	67%	0.67	S	S	*	*			trans	-53	95.4	164.5	-82.7	173.2	-31.5	0	0	108.6	F585 H589	F585-Q587 PolarHBondContact O-N 2.89Å; F585-Q587 VanDerWaalsContact O-N 3.11Å; Q587-H589 VanDerWaalsContact C-N 3.26Å; Q587-H589 PolarHBondContact O-N 2.92Å
588	N	25.4	Very low	40.4	Very low	143 Å²	143	121.2 Å²	121.2	77%	0.765	65%	0.653	S	S	*	*			trans	-62.1	93.5	163.2	-83.1	-29.3	0	0	0	107.5	Q586 A590	Q586-N588 VanDerWaalsContact C-N 3.28Å; Q586-N588 PolarHBondContact O-N 2.76Å; N588-A590 PolarHBondContact O-N 3.38Å
589	H	30.1	Very low	43.7	Very low	160 Å²	160	120.4 Å²	120.4	74%	0.741	64%	0.635	S	S	*	*			trans	-69.3	30.2	171.3	-91.2	-74.9	0	0	0	112.9	Q587	Q587-H589 VanDerWaalsContact C-N 3.26Å; Q587-H589 PolarHBondContact O-N 2.92Å
590	A	32.7	Very low	46.7	Very low	72 Å²	72	113 Å²	113	60%	0.595	60%	0.597	S	S	*	*	S	Bend	trans	-110.8	117.4	177.9	0	0	0	0	0	109.2	N588	N588-A590 PolarHBondContact O-N 3.38Å
591	N	36.1	Very low	49.9	Very low	159 Å²	159	108.4 Å²	108.4	85%	0.85	58%	0.577	S	S	*	*			trans	84.1	31.5	167.5	-57.5	-9.9	0	0	0	119.5	K593	N591-K593 VanDerWaalsContact C-N 3.32Å; N591-K593 PolarHBondContact O-N 3.07Å
592	L	42.8	Very low	52.8	Low	155 Å²	155	104 Å²	104	81%	0.812	55%	0.553	S	S	*	*			trans	-66	100.1	154.7	-87.9	127.9	0	0	0	107.8
593	K	50	Low	56.1	Low	155 Å²	155	99.2 Å²	99.2	67%	0.674	53%	0.528	S	S	*	.			trans	-45	128.4	162.7	-88.4	-178.2	177.4	178.6	0	106.9	N591 A595 D650	N591-K593 VanDerWaalsContact C-N 3.32Å; N591-K593 PolarHBondContact O-N 3.07Å; K593-A595 PolarHBondContact O-N 3.3Å; K593-A595 VanDerWaalsContact O-N 3.13Å; K593-D650 IonicContact NZ-OD2 3.04Å
594	P	56.6	Low	59.2	Low	46 Å²	46	93.2 Å²	93.2	30%	0.299	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-59	123.5	-174.7	19.6	-27.9	0	0	0	109	H552 T557	H552-P594 HydrophobicContact CB-CB 4.14Å; H552-P594 HydrophobicContact CB-CG 4.34Å; H552-P594 PolarHBondContact CE1-O 3.15Å; H552-P594 PolarHBondContact ND1-O 3.05Å; T557-P594 HydrophobicContact CG2-CB 4.37Å; T557-P594 HydrophobicContact CG2-CG 3.52Å
595	A	70.5	Confident	62.3	Low	63 Å²	63	89.8 Å²	89.8	52%	0.521	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-65	142.7	-179.2	0	0	0	0	0	109.8	Q553 K593	Q553-A595 WeakPolarHBondContact CB-O 3.36Å; Q553-A595 PolarHBondContact N-O 3.02Å; K593-A595 PolarHBondContact O-N 3.3Å; K593-A595 VanDerWaalsContact O-N 3.13Å
596	L	79.1	Confident	65.5	Low	34 Å²	34	84.1 Å²	84.1	18%	0.178	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-65.1	145.9	171.4	-68.5	163.2	0	0	0	110.1	H548	H548-L596 VanDerWaalsContact CE1-CD1 3.41Å; H548-L596 WeakPolarHBondContact CE1-CD1 3.42Å; H548-L596 WeakPolarHBondContact ND1-CD1 3.3Å
597	D	85	Confident	68.6	Low	9 Å²	9	76.8 Å²	76.8	5%	0.048	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-61	132.4	176.2	-168.8	-69.9	0	0	0	110.3	W469 G551 Q553 R599 I600 L601	W469-D597 HydrophobicContact CH2-CB 3.69Å; W469-D597 HydrophobicContact CZ2-CB 4.07Å; W469-D597 WeakPolarHBondContact CZ2-OD2 3.32Å; G551-D597 PolarHBondContact O-N 3.48Å; Q553-D597 HydrophobicContact CG-CB 3.98Å; D597-R599 PolarHBondContact O-N 2.92Å; D597-R599 VanDerWaalsContact O-N 3.11Å; D597-R599 WeakPolarHBondContact OD1-CB 3.44Å; D597-R599 WeakPolarHBondContact OD1-CG 3.46Å; D597-R599 IonicContact OD1-CZ 3.53Å; D597-R599 PolarHBondContact OD1-N 3Å; D597-R599 IonicContact OD1-NE 3.33Å; D597-R599 PolarHBondContact OD1-NE 3.23Å; D597-R599 IonicContact OD1-NH2 3.62Å; D597-R599 IonicContact OD2-CZ 2.72Å; D597-R599 IonicContact OD2-NE 3.46Å; D597-R599 PolarHBondContact OD2-NE 2.97Å; D597-R599 IonicContact OD2-NH2 2.66Å; D597-R599 PolarHBondContact OD2-NH2 3.16Å; D597-I600 HydrophobicContact CB-CD1 4.42Å; D597-I600 HydrophobicContact CB-CG1 4.42Å; D597-I600 PolarHBondContact O-N 3.06Å; D597-L601 PolarHBondContact O-N 3.3Å
598	P	86.3	Confident	71.7	Confident	77 Å²	77	70.1 Å²	70.1	50%	0.5	38%	0.383	S	S	.	.	H	α-helix	trans	-59.4	-26.8	-177.1	24.1	-35.5	0	0	0	112.7	S602	P598-S602 VanDerWaalsContact O-CB 3.3Å; P598-S602 WeakPolarHBondContact O-CB 3.32Å; P598-S602 PolarHBondContact O-N 3.45Å
599	R	88.7	Confident	74.9	Confident	79 Å²	79	65.3 Å²	65.3	30%	0.298	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-43.3	174.5	-65.1	169.7	-77.4	-156.9	-5.9	111	E466 W469 T473 D597 R603	E466-R599 IonicContact OE2-NH1 3.94Å; W469-R599 VanDerWaalsContact CE2-CZ 3.43Å; W469-R599 VanDerWaalsContact CG-CZ 3.47Å; W469-R599 HydrophobicContact CZ3-CB 4.44Å; T473-R599 HydrophobicContact CG2-CB 4.3Å; D597-R599 PolarHBondContact O-N 2.92Å; D597-R599 VanDerWaalsContact O-N 3.11Å; D597-R599 WeakPolarHBondContact OD1-CB 3.44Å; D597-R599 WeakPolarHBondContact OD1-CG 3.46Å; D597-R599 IonicContact OD1-CZ 3.53Å; D597-R599 PolarHBondContact OD1-N 3Å; D597-R599 IonicContact OD1-NE 3.33Å; D597-R599 PolarHBondContact OD1-NE 3.23Å; D597-R599 IonicContact OD1-NH2 3.62Å; D597-R599 IonicContact OD2-CZ 2.72Å; D597-R599 IonicContact OD2-NE 3.46Å; D597-R599 PolarHBondContact OD2-NE 2.97Å; D597-R599 IonicContact OD2-NH2 2.66Å; D597-R599 PolarHBondContact OD2-NH2 3.16Å; R599-R603 WeakPolarHBondContact O-CG 3.41Å; R599-R603 PolarHBondContact O-N 2.75Å
600	I	89.6	Confident	77.7	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-69.7	-45.2	178.2	-65.1	178.1	0	0	0	110	L436 W469 L547 D597 S602 R603 L604	L436-I600 HydrophobicContact CD1-CD1 4.49Å; L436-I600 HydrophobicContact CD2-CD1 3.87Å; W469-I600 HydrophobicContact CH2-CD1 3.61Å; W469-I600 HydrophobicContact CH2-CG1 3.89Å; W469-I600 HydrophobicContact CZ3-CD1 3.86Å; W469-I600 HydrophobicContact CZ3-CG1 3.74Å; L547-I600 HydrophobicContact CB-CG2 4.06Å; L547-I600 HydrophobicContact CD2-CG2 4.32Å; D597-I600 HydrophobicContact CB-CD1 4.42Å; D597-I600 HydrophobicContact CB-CG1 4.42Å; D597-I600 PolarHBondContact O-N 3.06Å; I600-S602 VanDerWaalsContact C-N 3.31Å; I600-S602 PolarHBondContact O-N 2.91Å; I600-R603 PolarHBondContact O-N 2.49Å; I600-R603 VanDerWaalsContact O-N 3.12Å; I600-L604 HydrophobicContact CG2-CD1 3.75Å; I600-L604 HydrophobicContact CG2-CG 4.13Å; I600-L604 WeakPolarHBondContact O-CB 3.48Å; I600-L604 WeakPolarHBondContact O-CG 3.46Å; I600-L604 PolarHBondContact O-N 3.28Å
601	L	89.8	Confident	80.5	Confident	79 Å²	79	56.1 Å²	56.1	41%	0.414	30%	0.304	S	S	.	.	H	α-helix	trans	-58.1	-43.5	178.3	-175.5	63.8	0	0	0	112	D597 R603 L604 A605	D597-L601 PolarHBondContact O-N 3.3Å; L601-R603 VanDerWaalsContact C-N 3.34Å; L601-R603 PolarHBondContact O-N 3.44Å; L601-L604 PolarHBondContact O-N 3.42Å; L601-A605 PolarHBondContact O-N 3.07Å
602	S	91.3	Very high	83.1	Confident	50 Å²	50	49.8 Å²	49.8	35%	0.35	27%	0.269	S	S	.	.	H	α-helix	trans	-59	-44	175.7	175.7	0	0	0	0	112.2	P598 I600 Q606	P598-S602 VanDerWaalsContact O-CB 3.3Å; P598-S602 WeakPolarHBondContact O-CB 3.32Å; P598-S602 PolarHBondContact O-N 3.45Å; I600-S602 VanDerWaalsContact C-N 3.31Å; I600-S602 PolarHBondContact O-N 2.91Å; S602-Q606 WeakPolarHBondContact O-CG 3.46Å; S602-Q606 PolarHBondContact O-N 2.91Å
603	R	91.4	Very high	85.3	Confident	59 Å²	59	47.7 Å²	47.7	22%	0.223	26%	0.255	C	S	.	.	H	α-helix	trans	-74.1	-35.6	179.7	-64.5	-50.5	-171.7	-98	6.6	113.1	L476 D477 I480 R599 I600 L601 Q606 L607	L476-R603 HydrophobicContact CB-CB 4.34Å; L476-R603 HydrophobicContact CB-CG 4.32Å; L476-R603 HydrophobicContact CD1-CB 4.11Å; L476-R603 HydrophobicContact CD1-CG 4.33Å; D477-R603 VanDerWaalsContact OD1-CD 3.26Å; D477-R603 WeakPolarHBondContact OD1-CD 3.34Å; D477-R603 IonicContact OD1-CZ 3.5Å; D477-R603 IonicContact OD1-NE 2.91Å; D477-R603 PolarHBondContact OD1-NE 3.24Å; D477-R603 IonicContact OD1-NH2 3.78Å; D477-R603 IonicContact OD2-CZ 3.28Å; D477-R603 IonicContact OD2-NE 3.14Å; D477-R603 PolarHBondContact OD2-NE 2.97Å; D477-R603 IonicContact OD2-NH2 2.75Å; D477-R603 PolarHBondContact OD2-NH2 3.02Å; I480-R603 HydrophobicContact CD1-CB 4.19Å; R599-R603 WeakPolarHBondContact O-CG 3.41Å; R599-R603 PolarHBondContact O-N 2.75Å; I600-R603 PolarHBondContact O-N 2.49Å; I600-R603 VanDerWaalsContact O-N 3.12Å; L601-R603 VanDerWaalsContact C-N 3.34Å; L601-R603 PolarHBondContact O-N 3.44Å; R603-Q606 PolarHBondContact O-N 2.94Å; R603-L607 VanDerWaalsContact O-CB 3.28Å; R603-L607 WeakPolarHBondContact O-CB 3.39Å; R603-L607 PolarHBondContact O-N 3.01Å
604	L	91.9	Very high	87	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.4	-45.5	171.8	-79.2	171.2	0	0	0	111.4	A544 L547 I600 L601 Q606 L607 Q608 E653	A544-L604 HydrophobicContact CB-CD2 3.96Å; L547-L604 HydrophobicContact CB-CD1 4.33Å; L547-L604 HydrophobicContact CB-CD2 4.13Å; L547-L604 HydrophobicContact CD1-CD2 3.59Å; L547-L604 HydrophobicContact CD1-CG 4.11Å; L547-L604 HydrophobicContact CG-CD2 4.5Å; I600-L604 HydrophobicContact CG2-CD1 3.75Å; I600-L604 HydrophobicContact CG2-CG 4.13Å; I600-L604 WeakPolarHBondContact O-CB 3.48Å; I600-L604 WeakPolarHBondContact O-CG 3.46Å; I600-L604 PolarHBondContact O-N 3.28Å; L601-L604 PolarHBondContact O-N 3.42Å; L604-Q606 VanDerWaalsContact C-N 3.34Å; L604-Q606 PolarHBondContact O-N 3.44Å; L604-L607 PolarHBondContact O-N 3.28Å; L604-Q608 WeakPolarHBondContact O-CB 3.42Å; L604-Q608 PolarHBondContact O-N 2.97Å; L604-E653 WeakPolarHBondContact CB-OE1 3.4Å
605	A	92.2	Very high	88.5	Confident	43 Å²	43	38.7 Å²	38.7	36%	0.355	21%	0.212	S	C	.	.	H	α-helix	trans	-62.5	-39.5	176.7	0	0	0	0	0	112.9	L601 T609	L601-A605 PolarHBondContact O-N 3.07Å; A605-T609 PolarHBondContact O-N 3.08Å; A605-T609 VanDerWaalsContact O-N 3.12Å; A605-T609 PolarHBondContact O-OG1 3.5Å
606	Q	92.8	Very high	89.4	Confident	78 Å²	78	38.5 Å²	38.5	36%	0.364	20%	0.202	S	C	.	.	H	α-helix	trans	-65.9	-46.4	174	-71.8	177.4	0.6	0	0	111.4	I480 S602 R603 L604 Q608 T609 Q610	I480-Q606 HydrophobicContact CD1-CB 3.88Å; S602-Q606 WeakPolarHBondContact O-CG 3.46Å; S602-Q606 PolarHBondContact O-N 2.91Å; R603-Q606 PolarHBondContact O-N 2.94Å; L604-Q606 VanDerWaalsContact C-N 3.34Å; L604-Q606 PolarHBondContact O-N 3.44Å; Q606-Q608 VanDerWaalsContact C-N 3.33Å; Q606-Q608 PolarHBondContact O-N 3.13Å; Q606-T609 PolarHBondContact O-N 3.43Å; Q606-Q610 WeakPolarHBondContact O-CG 3.47Å; Q606-Q610 PolarHBondContact O-N 3.18Å
607	L	91.1	Very high	89.7	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-60.7	-42.7	178.8	-167.1	73	0	0	0	111.4	L267 I480 M483 Y540 L543 R603 L604 Q610 F611	L267-L607 HydrophobicContact CD2-CD1 4.44Å; I480-L607 HydrophobicContact CG1-CB 4.18Å; I480-L607 HydrophobicContact CG1-CD1 3.73Å; M483-L607 HydrophobicContact SD-CD1 3.38Å; M483-L607 WeakPolarHBondContact SD-CD1 3.38Å; M483-L607 HydrophobicContact SD-CG 4.15Å; Y540-L607 HydrophobicContact CD2-CD2 3.55Å; Y540-L607 HydrophobicContact CD2-CG 3.67Å; Y540-L607 HydrophobicContact CE2-CB 4.12Å; Y540-L607 HydrophobicContact CE2-CD2 3.61Å; Y540-L607 HydrophobicContact CE2-CG 3.62Å; L543-L607 HydrophobicContact CD2-CD2 4Å; R603-L607 VanDerWaalsContact O-CB 3.28Å; R603-L607 WeakPolarHBondContact O-CB 3.39Å; R603-L607 PolarHBondContact O-N 3.01Å; L604-L607 PolarHBondContact O-N 3.28Å; L607-Q610 PolarHBondContact O-N 2.83Å; L607-F611 WeakPolarHBondContact O-CB 3.21Å; L607-F611 PolarHBondContact O-N 3.49Å
608	Q	92.4	Very high	89.6	Confident	6 Å²	6	38.9 Å²	38.9	3%	0.028	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-47.1	175.1	-175.1	176.9	19.8	0	0	111.7	Y540 L604 Q606 Q610 F611 E612 E653	Y540-Q608 WeakPolarHBondContact OH-CA 3.16Å; Y540-Q608 VanDerWaalsContact OH-CB 3.31Å; Y540-Q608 WeakPolarHBondContact OH-CB 3.43Å; L604-Q608 WeakPolarHBondContact O-CB 3.42Å; L604-Q608 PolarHBondContact O-N 2.97Å; Q606-Q608 VanDerWaalsContact C-N 3.33Å; Q606-Q608 PolarHBondContact O-N 3.13Å; Q608-Q610 VanDerWaalsContact C-N 3.29Å; Q608-Q610 PolarHBondContact O-N 3.35Å; Q608-F611 WeakPolarHBondContact O-CB 3.16Å; Q608-F611 PolarHBondContact O-N 2.87Å; Q608-F611 VanDerWaalsContact O-N 3.17Å; Q608-E612 PolarHBondContact NE2-OE1 3.43Å; Q608-E612 WeakPolarHBondContact O-CG 3.47Å; Q608-E612 PolarHBondContact O-N 3.32Å; Q608-E653 PolarHBondContact NE2-O 3.15Å
609	T	92	Very high	89.6	Confident	42 Å²	42	35.5 Å²	35.5	26%	0.258	19%	0.187	S	C	.	.	H	α-helix	trans	-60.7	-42.4	179.5	-58.5	0	0	0	0	110.6	A605 Q606 E612 H613 R656	A605-T609 PolarHBondContact O-N 3.08Å; A605-T609 VanDerWaalsContact O-N 3.12Å; A605-T609 PolarHBondContact O-OG1 3.5Å; Q606-T609 PolarHBondContact O-N 3.43Å; T609-E612 PolarHBondContact O-N 2.87Å; T609-H613 PolarHBondContact O-CD2 2.85Å; T609-H613 PolarHBondContact O-N 2.67Å; T609-H613 VanDerWaalsContact O-N 3.13Å; T609-R656 PolarHBondContact OG1-NH1 3.41Å
610	Q	89	Confident	89.4	Confident	38 Å²	38	40.1 Å²	40.1	18%	0.178	21%	0.209	C	C	.	.	H	α-helix	trans	-66.4	-39.6	174.8	-62.2	-47.5	-30.3	0	0	113	I480 M483 L484 Q606 L607 Q608 E612 H613 V614	I480-Q610 HydrophobicContact CG2-CG 3.85Å; M483-Q610 HydrophobicContact CB-CB 4.33Å; L484-Q610 HydrophobicContact CG-CG 4.31Å; Q606-Q610 WeakPolarHBondContact O-CG 3.47Å; Q606-Q610 PolarHBondContact O-N 3.18Å; L607-Q610 PolarHBondContact O-N 2.83Å; Q608-Q610 VanDerWaalsContact C-N 3.29Å; Q608-Q610 PolarHBondContact O-N 3.35Å; Q610-E612 VanDerWaalsContact C-N 3.35Å; Q610-E612 PolarHBondContact O-N 2.99Å; Q610-H613 PolarHBondContact O-N 3.09Å; Q610-V614 WeakPolarHBondContact O-CB 3.23Å; Q610-V614 WeakPolarHBondContact O-CG2 3.33Å; Q610-V614 PolarHBondContact O-N 2.87Å
611	F	91.3	Very high	89	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-45.7	176.1	174.6	-113.9	0	0	0	112	M483 I536 A537 Y540 L607 Q608 V614 L615 Y636 V639	M483-F611 HydrophobicContact CE-CB 3.65Å; M483-F611 HydrophobicContact CE-CD2 4.13Å; M483-F611 HydrophobicContact CE-CG 4.41Å; I536-F611 HydrophobicContact CG2-CE2 4.29Å; A537-F611 HydrophobicContact CB-CE2 3.81Å; A537-F611 HydrophobicContact CB-CZ 3.71Å; Y540-F611 AromaticContact CD1-CD1 3.84Å; Y540-F611 HydrophobicContact CD1-CD1 3.84Å; Y540-F611 HydrophobicContact CD1-CD2 4.16Å; Y540-F611 AromaticContact CD1-CE1 3.96Å; Y540-F611 HydrophobicContact CD1-CE1 3.96Å; Y540-F611 HydrophobicContact CD1-CE2 4.28Å; Y540-F611 AromaticContact CD1-CG 3.92Å; Y540-F611 HydrophobicContact CD1-CG 3.92Å; Y540-F611 HydrophobicContact CD1-CZ 4.15Å; Y540-F611 HydrophobicContact CD2-CB 4.1Å; Y540-F611 HydrophobicContact CD2-CG 4.25Å; Y540-F611 AromaticContact CE1-CD1 3.86Å; Y540-F611 HydrophobicContact CE1-CD1 3.86Å; Y540-F611 HydrophobicContact CE1-CE1 4.16Å; Y540-F611 HydrophobicContact CE1-CG 4.23Å; Y540-F611 HydrophobicContact CE2-CB 4.18Å; Y540-F611 HydrophobicContact CG-CB 4.3Å; Y540-F611 HydrophobicContact CG-CD1 4.34Å; Y540-F611 AromaticContact CG-CD2 3.98Å; Y540-F611 HydrophobicContact CG-CD2 3.98Å; Y540-F611 HydrophobicContact CG-CE2 4.39Å; Y540-F611 AromaticContact CG-CG 3.94Å; Y540-F611 HydrophobicContact CG-CG 3.94Å; L607-F611 WeakPolarHBondContact O-CB 3.21Å; L607-F611 PolarHBondContact O-N 3.49Å; Q608-F611 WeakPolarHBondContact O-CB 3.16Å; Q608-F611 PolarHBondContact O-N 2.87Å; Q608-F611 VanDerWaalsContact O-N 3.17Å; F611-V614 WeakPolarHBondContact O-CB 3.29Å; F611-V614 PolarHBondContact O-N 3.35Å; F611-L615 HydrophobicContact CD1-CD1 4.22Å; F611-L615 HydrophobicContact CD2-CG 4.24Å; F611-L615 HydrophobicContact CE1-CD1 3.48Å; F611-L615 VanDerWaalsContact CE1-CD1 3.48Å; F611-L615 HydrophobicContact CE1-CG 4.2Å; F611-L615 HydrophobicContact CE2-CD1 3.83Å; F611-L615 HydrophobicContact CE2-CD2 4.02Å; F611-L615 HydrophobicContact CE2-CG 3.75Å; F611-L615 HydrophobicContact CZ-CD1 3.28Å; F611-L615 HydrophobicContact CZ-CD2 4.21Å; F611-L615 HydrophobicContact CZ-CG 3.77Å; F611-L615 PolarHBondContact O-N 3.49Å; F611-Y636 HydrophobicContact CE1-CD1 4.22Å; F611-Y636 HydrophobicContact CE1-CE1 4.09Å; F611-V639 HydrophobicContact CE1-CG2 3.85Å; F611-V639 HydrophobicContact CZ-CG2 3.74Å
612	E	91.1	Very high	88.5	Confident	27 Å²	27	38.2 Å²	38.2	13%	0.126	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-41	177.2	-70.7	178.3	-165.2	0	0	112.3	Q608 T609 Q610 V614 L615 N616 Y636 R656	Q608-E612 PolarHBondContact NE2-OE1 3.43Å; Q608-E612 WeakPolarHBondContact O-CG 3.47Å; Q608-E612 PolarHBondContact O-N 3.32Å; T609-E612 PolarHBondContact O-N 2.87Å; Q610-E612 VanDerWaalsContact C-N 3.35Å; Q610-E612 PolarHBondContact O-N 2.99Å; E612-V614 VanDerWaalsContact C-N 3.32Å; E612-V614 PolarHBondContact O-N 3.24Å; E612-L615 PolarHBondContact O-N 3.48Å; E612-N616 VanDerWaalsContact O-CB 3.32Å; E612-N616 WeakPolarHBondContact O-CB 3.45Å; E612-N616 VanDerWaalsContact O-CG 3.32Å; E612-N616 PolarHBondContact O-N 3.34Å; E612-N616 PolarHBondContact O-ND2 3.35Å; E612-Y636 HydrophobicContact CG-CE1 4.16Å; E612-R656 VanDerWaalsContact OE1-CD 3.3Å; E612-R656 WeakPolarHBondContact OE1-CD 3.37Å; E612-R656 WeakPolarHBondContact OE1-CG 3.47Å; E612-R656 IonicContact OE1-CZ 3.63Å; E612-R656 VanDerWaalsContact OE1-CZ 3.31Å; E612-R656 IonicContact OE1-NE 3.55Å; E612-R656 PolarHBondContact OE1-NE 2.67Å; E612-R656 IonicContact OE1-NH2 2.97Å; E612-R656 IonicContact OE2-CZ 3.05Å; E612-R656 IonicContact OE2-NE 3.83Å; E612-R656 PolarHBondContact OE2-NE 3.05Å; E612-R656 IonicContact OE2-NH2 3.37Å; E612-R656 PolarHBondContact OE2-NH2 3.07Å
613	H	88.6	Confident	87.9	Confident	111 Å²	111	40 Å²	40	51%	0.514	21%	0.212	S	C	.	.	H	α-helix	trans	-61.3	-42	174.9	-76.3	-57.3	0	0	0	112.1	T609 Q610 S617	T609-H613 PolarHBondContact O-CD2 2.85Å; T609-H613 PolarHBondContact O-N 2.67Å; T609-H613 VanDerWaalsContact O-N 3.13Å; Q610-H613 PolarHBondContact O-N 3.09Å; H613-S617 WeakPolarHBondContact O-CB 3.19Å; H613-S617 PolarHBondContact O-N 3.31Å; H613-S617 PolarHBondContact O-OG 2.77Å
614	V	86.7	Confident	87.4	Confident	12 Å²	12	45.1 Å²	45.1	7%	0.073	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-52.9	175.2	155.9	0	0	0	0	111.1	M483 L487 I536 Q610 F611 E612 N616 S617 L618	M483-V614 HydrophobicContact CB-CG2 4.49Å; M483-V614 WeakPolarHBondContact O-CG2 3.04Å; L487-V614 HydrophobicContact CD2-CB 4.1Å; L487-V614 HydrophobicContact CD2-CG1 3.22Å; L487-V614 HydrophobicContact CD2-CG2 3.9Å; I536-V614 HydrophobicContact CD1-CG1 4.19Å; I536-V614 HydrophobicContact CG2-CG1 4.29Å; Q610-V614 WeakPolarHBondContact O-CB 3.23Å; Q610-V614 WeakPolarHBondContact O-CG2 3.33Å; Q610-V614 PolarHBondContact O-N 2.87Å; F611-V614 WeakPolarHBondContact O-CB 3.29Å; F611-V614 PolarHBondContact O-N 3.35Å; E612-V614 VanDerWaalsContact C-N 3.32Å; E612-V614 PolarHBondContact O-N 3.24Å; V614-N616 VanDerWaalsContact C-N 3.32Å; V614-N616 PolarHBondContact O-N 2.92Å; V614-S617 WeakPolarHBondContact O-CB 3.31Å; V614-S617 PolarHBondContact O-N 3.46Å; V614-L618 HydrophobicContact CG1-CD1 4.08Å; V614-L618 WeakPolarHBondContact O-CG 3.47Å; V614-L618 PolarHBondContact O-N 3.21Å
615	L	88.3	Confident	87	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-42.6	-179	-77.8	-169.3	0	0	0	111.8	F611 E612 S617 L618 A619 F631 L632 N635 Y636	F611-L615 HydrophobicContact CD1-CD1 4.22Å; F611-L615 HydrophobicContact CD2-CG 4.24Å; F611-L615 HydrophobicContact CE1-CD1 3.48Å; F611-L615 VanDerWaalsContact CE1-CD1 3.48Å; F611-L615 HydrophobicContact CE1-CG 4.2Å; F611-L615 HydrophobicContact CE2-CD1 3.83Å; F611-L615 HydrophobicContact CE2-CD2 4.02Å; F611-L615 HydrophobicContact CE2-CG 3.75Å; F611-L615 HydrophobicContact CZ-CD1 3.28Å; F611-L615 HydrophobicContact CZ-CD2 4.21Å; F611-L615 HydrophobicContact CZ-CG 3.77Å; F611-L615 PolarHBondContact O-N 3.49Å; E612-L615 PolarHBondContact O-N 3.48Å; L615-S617 VanDerWaalsContact C-N 3.28Å; L615-S617 PolarHBondContact O-N 3.03Å; L615-L618 PolarHBondContact O-N 3.11Å; L615-A619 VanDerWaalsContact O-CB 3.26Å; L615-A619 WeakPolarHBondContact O-CB 3.28Å; L615-A619 PolarHBondContact O-N 2.88Å; L615-F631 HydrophobicContact CD2-CE1 4.03Å; L615-F631 HydrophobicContact CD2-CZ 4.17Å; L615-L632 HydrophobicContact CB-CD2 3.77Å; L615-N635 HydrophobicContact CD1-CB 3.82Å; L615-N635 HydrophobicContact CD2-CB 4Å; L615-Y636 HydrophobicContact CD1-CD1 4.18Å; L615-Y636 HydrophobicContact CD1-CE1 3.75Å; L615-Y636 HydrophobicContact CD1-CE2 4.46Å
616	N	88	Confident	86.7	Confident	58 Å²	58	47.7 Å²	47.7	31%	0.31	24%	0.241	S	C	.	.	H	α-helix	trans	-64	-34.1	176.2	-77.5	-54.1	0	0	0	112.4	E612 V614 K620	E612-N616 VanDerWaalsContact O-CB 3.32Å; E612-N616 WeakPolarHBondContact O-CB 3.45Å; E612-N616 VanDerWaalsContact O-CG 3.32Å; E612-N616 PolarHBondContact O-N 3.34Å; E612-N616 PolarHBondContact O-ND2 3.35Å; V614-N616 VanDerWaalsContact C-N 3.32Å; V614-N616 PolarHBondContact O-N 2.92Å; N616-K620 VanDerWaalsContact O-CG 3.31Å; N616-K620 WeakPolarHBondContact O-CG 3.34Å; N616-K620 PolarHBondContact O-N 3.12Å
617	S	85.3	Confident	86.3	Confident	50 Å²	50	44.4 Å²	44.4	35%	0.35	23%	0.227	S	C	.	.	H	α-helix	trans	-71.5	-41.4	176.9	-59	0	0	0	0	111.7	H613 V614 L615 K620	H613-S617 WeakPolarHBondContact O-CB 3.19Å; H613-S617 PolarHBondContact O-N 3.31Å; H613-S617 PolarHBondContact O-OG 2.77Å; V614-S617 WeakPolarHBondContact O-CB 3.31Å; V614-S617 PolarHBondContact O-N 3.46Å; L615-S617 VanDerWaalsContact C-N 3.28Å; L615-S617 PolarHBondContact O-N 3.03Å; S617-K620 PolarHBondContact O-N 3.24Å
618	L	83.4	Confident	86.2	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-42.2	172.5	-66.1	174.9	0	0	0	111.1	L487 F492 V614 L615 K620 T621 F631	L487-L618 HydrophobicContact CD2-CD1 4.23Å; L487-L618 HydrophobicContact CD2-CD2 4.35Å; L487-L618 HydrophobicContact CD2-CG 4.35Å; F492-L618 HydrophobicContact CB-CD2 3.87Å; F492-L618 HydrophobicContact CD1-CB 4.38Å; F492-L618 HydrophobicContact CD1-CD2 3.65Å; F492-L618 HydrophobicContact CD2-CD2 4.4Å; F492-L618 HydrophobicContact CE1-CB 4.22Å; F492-L618 HydrophobicContact CE1-CD2 4.29Å; F492-L618 HydrophobicContact CG-CD2 3.72Å; V614-L618 HydrophobicContact CG1-CD1 4.08Å; V614-L618 WeakPolarHBondContact O-CG 3.47Å; V614-L618 PolarHBondContact O-N 3.21Å; L615-L618 PolarHBondContact O-N 3.11Å; L618-K620 VanDerWaalsContact C-N 3.3Å; L618-K620 PolarHBondContact O-N 3.01Å; L618-T621 WeakPolarHBondContact O-CB 3.26Å; L618-T621 PolarHBondContact O-N 2.74Å; L618-T621 PolarHBondContact O-OG1 2.95Å; L618-T621 VanDerWaalsContact O-OG1 3.12Å; L618-F631 HydrophobicContact CB-CE1 3.84Å; L618-F631 HydrophobicContact CB-CZ 4.04Å; L618-F631 HydrophobicContact CD1-CZ 4.14Å
619	A	85.9	Confident	86.1	Confident	6 Å²	6	46.2 Å²	46.2	5%	0.05	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-34.3	179.3	0	0	0	0	0	113.2	L615 T621 F622 A628 F631 L632	L615-A619 VanDerWaalsContact O-CB 3.26Å; L615-A619 WeakPolarHBondContact O-CB 3.28Å; L615-A619 PolarHBondContact O-N 2.88Å; A619-T621 PolarHBondContact O-N 3.17Å; A619-T621 VanDerWaalsContact O-N 3.16Å; A619-F622 WeakPolarHBondContact O-CD2 3.37Å; A619-F622 PolarHBondContact O-N 3.39Å; A619-A628 HydrophobicContact CB-CB 4.21Å; A619-A628 WeakPolarHBondContact O-CB 3.38Å; A619-F631 HydrophobicContact CB-CD1 4.18Å; A619-L632 HydrophobicContact CB-CD1 3.79Å; A619-L632 HydrophobicContact CB-CD2 3.86Å; A619-L632 HydrophobicContact CB-CG 3.75Å
620	K	84.5	Confident	85.9	Confident	175 Å²	175	44.2 Å²	44.2	76%	0.761	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-13.4	175	-74.8	170.7	-175.5	179.3	0	114.1	N616 S617 L618 F622	N616-K620 VanDerWaalsContact O-CG 3.31Å; N616-K620 WeakPolarHBondContact O-CG 3.34Å; N616-K620 PolarHBondContact O-N 3.12Å; S617-K620 PolarHBondContact O-N 3.24Å; L618-K620 VanDerWaalsContact C-N 3.3Å; L618-K620 PolarHBondContact O-N 3.01Å; K620-F622 VanDerWaalsContact C-N 3.3Å
621	T	81	Confident	85.9	Confident	26 Å²	26	42.4 Å²	42.4	16%	0.16	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-27.1	177.3	-60.2	0	0	0	0	112.1	F492 S493 A496 L618 A619	F492-T621 HydrophobicContact CD1-CG2 4.04Å; F492-T621 HydrophobicContact CE1-CG2 4.28Å; S493-T621 VanDerWaalsContact CA-CG2 3.41Å; A496-T621 HydrophobicContact CB-CG2 3.62Å; L618-T621 WeakPolarHBondContact O-CB 3.26Å; L618-T621 PolarHBondContact O-N 2.74Å; L618-T621 PolarHBondContact O-OG1 2.95Å; L618-T621 VanDerWaalsContact O-OG1 3.12Å; A619-T621 PolarHBondContact O-N 3.17Å; A619-T621 VanDerWaalsContact O-N 3.16Å
622	F	81.2	Confident	85.9	Confident	14 Å²	14	42.7 Å²	42.7	6%	0.061	22%	0.218	C	C	.	.			trans	-73.8	130.7	-179.5	-63.8	-79.6	0	0	0	110.8	F492 M500 M527 L530 A619 K620 R624 L627 A628 F631	F492-F622 HydrophobicContact CE1-CE2 4.14Å; F492-F622 HydrophobicContact CE1-CZ 4.12Å; F492-F622 HydrophobicContact CZ-CE2 4.19Å; F492-F622 AromaticContact CZ-CZ 3.84Å; F492-F622 HydrophobicContact CZ-CZ 3.84Å; M500-F622 HydrophobicContact CE-CD1 4.37Å; M527-F622 HydrophobicContact SD-CD1 4.44Å; M527-F622 HydrophobicContact SD-CE1 4.14Å; L530-F622 HydrophobicContact CB-CE1 3.98Å; L530-F622 HydrophobicContact CB-CZ 4.13Å; L530-F622 HydrophobicContact CD1-CE1 4.49Å; A619-F622 WeakPolarHBondContact O-CD2 3.37Å; A619-F622 PolarHBondContact O-N 3.39Å; K620-F622 VanDerWaalsContact C-N 3.3Å; F622-R624 VanDerWaalsContact C-N 3.32Å; F622-R624 PolarHBondContact O-N 3.32Å; F622-L627 HydrophobicContact CB-CB 4.11Å; F622-L627 HydrophobicContact CD1-CB 4.03Å; F622-L627 HydrophobicContact CD1-CD1 4.49Å; F622-L627 HydrophobicContact CG-CB 4.15Å; F622-A628 HydrophobicContact CB-CB 4.34Å; F622-A628 HydrophobicContact CD2-CB 4.48Å; F622-F631 HydrophobicContact CE2-CB 3.8Å; F622-F631 HydrophobicContact CE2-CD1 4.04Å; F622-F631 HydrophobicContact CE2-CD2 4.12Å; F622-F631 AromaticContact CE2-CG 3.71Å; F622-F631 HydrophobicContact CE2-CG 3.71Å; F622-F631 HydrophobicContact CZ-CB 4.21Å; F622-F631 HydrophobicContact CZ-CD2 4.18Å; F622-F631 HydrophobicContact CZ-CG 4.18Å
623	S	76.8	Confident	85.9	Confident	87 Å²	87	41.4 Å²	41.4	61%	0.608	21%	0.212	S	C	*	.	S	Bend	trans	-69.4	-28.4	178.9	57.2	0	0	0	0	113.4	M500	M500-S623 WeakPolarHBondContact CE-OG 3.07Å; M500-S623 PolarHBondContact SD-OG 2.85Å
624	R	81.1	Confident	86	Confident	168 Å²	168	36.6 Å²	36.6	63%	0.634	19%	0.19	S	C	*	.	S	Bend	trans	-104.1	127.8	179.8	-56.5	-175.8	77.8	163	1.9	110	F622 K626 L627 A628	F622-R624 VanDerWaalsContact C-N 3.32Å; F622-R624 PolarHBondContact O-N 3.32Å; R624-K626 VanDerWaalsContact C-N 3.28Å; R624-K626 PolarHBondContact O-N 2.8Å; R624-L627 HydrophobicContact CB-CD1 4.05Å; R624-L627 HydrophobicContact CB-CG 4.13Å; R624-L627 HydrophobicContact CG-CD1 4.39Å; R624-L627 PolarHBondContact O-N 2.87Å; R624-L627 VanDerWaalsContact O-N 3.12Å; R624-A628 PolarHBondContact O-N 3.06Å
625	P	85	Confident	86.2	Confident	66 Å²	66	36 Å²	36	43%	0.429	19%	0.186	S	C	.	.	H	α-helix	trans	-60.5	-36	-179.9	23.6	-33.1	0	0	0	112.6	L627 A628 H629	P625-L627 VanDerWaalsContact C-N 3.28Å; P625-L627 PolarHBondContact O-N 2.88Å; P625-A628 WeakPolarHBondContact O-CB 3.13Å; P625-A628 PolarHBondContact O-N 3.5Å; P625-A628 VanDerWaalsContact O-N 3.15Å; P625-H629 PolarHBondContact O-CD2 2.89Å; P625-H629 PolarHBondContact O-N 3.43Å; P625-H629 VanDerWaalsContact O-N 3.13Å
626	K	85.8	Confident	86.4	Confident	30 Å²	30	36.2 Å²	36.2	13%	0.13	19%	0.187	C	C	.	.	H	α-helix	trans	-50	-47.6	173.8	-167.9	-171.1	-175.4	-155.8	0	111.7	R624 H629 I630 Y668 E671 E737 E741	R624-K626 VanDerWaalsContact C-N 3.28Å; R624-K626 PolarHBondContact O-N 2.8Å; K626-H629 PolarHBondContact O-N 3.41Å; K626-I630 HydrophobicContact CG-CD1 4.28Å; K626-I630 VanDerWaalsContact O-CG1 3.3Å; K626-I630 WeakPolarHBondContact O-CG1 3.43Å; K626-I630 PolarHBondContact O-N 3.34Å; K626-I630 VanDerWaalsContact O-N 3.14Å; K626-Y668 HydrophobicContact CD-CE2 4.26Å; K626-Y668 HydrophobicContact CG-CD2 3.91Å; K626-Y668 HydrophobicContact CG-CE2 3.71Å; K626-E671 HydrophobicContact CB-CB 4.34Å; K626-E737 IonicContact NZ-OE2 3.66Å; K626-E737 PolarHBondContact NZ-OE2 2.65Å; K626-E741 WeakPolarHBondContact CE-OE1 2.91Å; K626-E741 WeakPolarHBondContact CE-OE2 3.38Å; K626-E741 IonicContact NZ-OE1 2.88Å; K626-E741 PolarHBondContact NZ-OE1 3.01Å; K626-E741 IonicContact NZ-OE2 3.58Å; K626-E741 PolarHBondContact NZ-OE2 3.12Å
627	L	84.3	Confident	86.6	Confident	10 Å²	10	34.7 Å²	34.7	5%	0.052	18%	0.179	C	C	.	.	H	α-helix	trans	-68	-38.1	-177.6	-62.6	175.8	0	0	0	113	L523 M527 I531 F622 R624 P625 H629 I630 F631	L523-L627 HydrophobicContact CD2-CD2 3.94Å; M527-L627 HydrophobicContact CE-CB 4.41Å; M527-L627 HydrophobicContact CE-CD1 3.31Å; M527-L627 HydrophobicContact CE-CD2 3.45Å; M527-L627 VanDerWaalsContact CE-CD2 3.45Å; M527-L627 HydrophobicContact CE-CG 3.87Å; M527-L627 HydrophobicContact SD-CD1 4.35Å; I531-L627 HydrophobicContact CD1-CD2 3.82Å; I531-L627 HydrophobicContact CG1-CD2 4.45Å; F622-L627 HydrophobicContact CB-CB 4.11Å; F622-L627 HydrophobicContact CD1-CB 4.03Å; F622-L627 HydrophobicContact CD1-CD1 4.49Å; F622-L627 HydrophobicContact CG-CB 4.15Å; R624-L627 HydrophobicContact CB-CD1 4.05Å; R624-L627 HydrophobicContact CB-CG 4.13Å; R624-L627 HydrophobicContact CG-CD1 4.39Å; R624-L627 PolarHBondContact O-N 2.87Å; R624-L627 VanDerWaalsContact O-N 3.12Å; P625-L627 VanDerWaalsContact C-N 3.28Å; P625-L627 PolarHBondContact O-N 2.88Å; L627-H629 VanDerWaalsContact C-N 3.31Å; L627-H629 PolarHBondContact O-N 2.95Å; L627-I630 HydrophobicContact CD2-CD1 4.11Å; L627-I630 PolarHBondContact O-N 3.15Å; L627-F631 WeakPolarHBondContact O-CB 3.42Å; L627-F631 PolarHBondContact O-N 3.16Å
628	A	88.4	Confident	86.9	Confident	15 Å²	15	33.8 Å²	33.8	12%	0.124	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-41.1	175.8	0	0	0	0	0	111.3	A619 F622 R624 P625 L632	A619-A628 HydrophobicContact CB-CB 4.21Å; A619-A628 WeakPolarHBondContact O-CB 3.38Å; F622-A628 HydrophobicContact CB-CB 4.34Å; F622-A628 HydrophobicContact CD2-CB 4.48Å; R624-A628 PolarHBondContact O-N 3.06Å; P625-A628 WeakPolarHBondContact O-CB 3.13Å; P625-A628 PolarHBondContact O-N 3.5Å; P625-A628 VanDerWaalsContact O-N 3.15Å; A628-L632 VanDerWaalsContact O-CG 3.3Å; A628-L632 WeakPolarHBondContact O-CG 3.28Å; A628-L632 PolarHBondContact O-N 3.33Å; A628-L632 VanDerWaalsContact O-N 3.08Å
629	H	90.3	Very high	87.3	Confident	33 Å²	33	33.7 Å²	33.7	15%	0.153	17%	0.17	C	C	.	.	H	α-helix	trans	-67.4	-44.5	176.8	-65.5	-41.6	0	0	0	112.7	P625 K626 L627 F631 L632 I633 H664 S667	P625-H629 PolarHBondContact O-CD2 2.89Å; P625-H629 PolarHBondContact O-N 3.43Å; P625-H629 VanDerWaalsContact O-N 3.13Å; K626-H629 PolarHBondContact O-N 3.41Å; L627-H629 VanDerWaalsContact C-N 3.31Å; L627-H629 PolarHBondContact O-N 2.95Å; H629-F631 VanDerWaalsContact C-N 3.32Å; H629-F631 PolarHBondContact O-N 3.4Å; H629-L632 PolarHBondContact O-N 2.94Å; H629-I633 WeakPolarHBondContact O-CB 3.17Å; H629-I633 WeakPolarHBondContact O-CD1 3.07Å; H629-I633 WeakPolarHBondContact O-CG1 3.27Å; H629-I633 PolarHBondContact O-N 3.34Å; H629-H664 AromaticContact CE1-ND1 3.66Å; H629-H664 AromaticContact ND1-CG 3.96Å; H629-H664 AromaticContact ND1-ND1 3.15Å; H629-H664 PolarHBondContact ND1-ND1 3.15Å; H629-H664 VanDerWaalsContact ND1-ND1 3.15Å; H629-S667 WeakPolarHBondContact NE2-CB 3.34Å
630	I	87.4	Confident	87.6	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-45.6	177.4	-55.3	157.8	0	0	0	110.3	I531 K626 L627 L632 I633 N634 Y668 E741 F742	I531-I630 HydrophobicContact CG2-CB 4.03Å; I531-I630 HydrophobicContact CG2-CG2 3.25Å; K626-I630 HydrophobicContact CG-CD1 4.28Å; K626-I630 VanDerWaalsContact O-CG1 3.3Å; K626-I630 WeakPolarHBondContact O-CG1 3.43Å; K626-I630 PolarHBondContact O-N 3.34Å; K626-I630 VanDerWaalsContact O-N 3.14Å; L627-I630 HydrophobicContact CD2-CD1 4.11Å; L627-I630 PolarHBondContact O-N 3.15Å; I630-L632 PolarHBondContact O-N 2.78Å; I630-I633 PolarHBondContact O-N 3.45Å; I630-N634 WeakPolarHBondContact O-CB 3.22Å; I630-N634 PolarHBondContact O-N 3.08Å; I630-Y668 HydrophobicContact CD1-CD2 4.39Å; I630-Y668 HydrophobicContact CD1-CE2 3.79Å; I630-Y668 HydrophobicContact CG1-CD2 3.62Å; I630-Y668 HydrophobicContact CG1-CE2 3.36Å; I630-E741 HydrophobicContact CD1-CB 4.06Å; I630-E741 HydrophobicContact CD1-CG 3.85Å; I630-E741 WeakPolarHBondContact CD1-OE2 3.37Å; I630-E741 HydrophobicContact CG2-CB 4.15Å; I630-F742 HydrophobicContact CB-CE1 4.4Å; I630-F742 HydrophobicContact CB-CZ 4.21Å; I630-F742 HydrophobicContact CG1-CE2 4.42Å; I630-F742 HydrophobicContact CG1-CZ 3.96Å; I630-F742 HydrophobicContact CG2-CD1 4.22Å; I630-F742 HydrophobicContact CG2-CE1 3.72Å; I630-F742 HydrophobicContact CG2-CE2 4.35Å; I630-F742 HydrophobicContact CG2-CZ 3.79Å
631	F	89.8	Confident	87.9	Confident	1 Å²	1	28.5 Å²	28.5	0%	0.004	15%	0.153	C	C	.	.	H	α-helix	trans	-56.6	-50.6	176.8	174.2	-102.6	0	0	0	111.5	F492 L530 H534 L615 L618 A619 F622 L627 H629 I633 N634 N635	F492-F631 HydrophobicContact CZ-CE2 4.4Å; L530-F631 WeakPolarHBondContact O-CD2 3.46Å; H534-F631 HydrophobicContact CB-CE2 4.18Å; H534-F631 HydrophobicContact CB-CZ 4.16Å; L615-F631 HydrophobicContact CD2-CE1 4.03Å; L615-F631 HydrophobicContact CD2-CZ 4.17Å; L618-F631 HydrophobicContact CB-CE1 3.84Å; L618-F631 HydrophobicContact CB-CZ 4.04Å; L618-F631 HydrophobicContact CD1-CZ 4.14Å; A619-F631 HydrophobicContact CB-CD1 4.18Å; F622-F631 HydrophobicContact CE2-CB 3.8Å; F622-F631 HydrophobicContact CE2-CD1 4.04Å; F622-F631 HydrophobicContact CE2-CD2 4.12Å; F622-F631 AromaticContact CE2-CG 3.71Å; F622-F631 HydrophobicContact CE2-CG 3.71Å; F622-F631 HydrophobicContact CZ-CB 4.21Å; F622-F631 HydrophobicContact CZ-CD2 4.18Å; F622-F631 HydrophobicContact CZ-CG 4.18Å; L627-F631 WeakPolarHBondContact O-CB 3.42Å; L627-F631 PolarHBondContact O-N 3.16Å; H629-F631 VanDerWaalsContact C-N 3.32Å; H629-F631 PolarHBondContact O-N 3.4Å; F631-I633 PolarHBondContact O-N 3.32Å; F631-N634 PolarHBondContact O-N 2.91Å; F631-N635 VanDerWaalsContact CD2-ND2 3.28Å; F631-N635 WeakPolarHBondContact CD2-ND2 3.5Å; F631-N635 WeakPolarHBondContact CE2-ND2 3.12Å; F631-N635 WeakPolarHBondContact CZ-ND2 3.3Å; F631-N635 PolarHBondContact O-N 3.34Å; F631-N635 VanDerWaalsContact O-N 3.09Å; F631-N635 PolarHBondContact O-ND2 2.94Å
632	L	91.1	Very high	88.2	Confident	5 Å²	5	27.3 Å²	27.3	3%	0.026	15%	0.146	C	C	.	.	H	α-helix	trans	-61.9	-45.1	179.9	-70.4	172.3	0	0	0	111.9	L615 A619 A628 H629 I630 N635 Y636 H664	L615-L632 HydrophobicContact CB-CD2 3.77Å; A619-L632 HydrophobicContact CB-CD1 3.79Å; A619-L632 HydrophobicContact CB-CD2 3.86Å; A619-L632 HydrophobicContact CB-CG 3.75Å; A628-L632 VanDerWaalsContact O-CG 3.3Å; A628-L632 WeakPolarHBondContact O-CG 3.28Å; A628-L632 PolarHBondContact O-N 3.33Å; A628-L632 VanDerWaalsContact O-N 3.08Å; H629-L632 PolarHBondContact O-N 2.94Å; I630-L632 PolarHBondContact O-N 2.78Å; L632-N635 PolarHBondContact O-N 3.26Å; L632-Y636 HydrophobicContact CB-CD2 4.36Å; L632-Y636 HydrophobicContact CB-CE2 4.14Å; L632-Y636 HydrophobicContact CD2-CE2 4.24Å; L632-Y636 WeakPolarHBondContact O-CD2 3.38Å; L632-Y636 PolarHBondContact O-N 3.48Å; L632-H664 VanDerWaalsContact CD1-CE1 3.43Å; L632-H664 WeakPolarHBondContact CD1-CE1 3.35Å; L632-H664 WeakPolarHBondContact CD1-NE2 3.37Å
633	I	90.6	Very high	88.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59	-51.3	178.7	-69.3	164	0	0	0	110.8	H629 I630 F631 N635 Y636 D637 V661 H664 M665 F742 L747 I751	H629-I633 WeakPolarHBondContact O-CB 3.17Å; H629-I633 WeakPolarHBondContact O-CD1 3.07Å; H629-I633 WeakPolarHBondContact O-CG1 3.27Å; H629-I633 PolarHBondContact O-N 3.34Å; I630-I633 PolarHBondContact O-N 3.45Å; F631-I633 PolarHBondContact O-N 3.32Å; I633-N635 VanDerWaalsContact C-N 3.31Å; I633-N635 PolarHBondContact O-N 3.46Å; I633-Y636 PolarHBondContact O-N 3.24Å; I633-D637 VanDerWaalsContact O-CB 3.31Å; I633-D637 WeakPolarHBondContact O-CB 3.43Å; I633-D637 PolarHBondContact O-N 3.16Å; I633-V661 HydrophobicContact CG2-CG1 4.4Å; I633-H664 HydrophobicContact CD1-CB 4.2Å; I633-H664 HydrophobicContact CG1-CB 3.77Å; I633-M665 HydrophobicContact CD1-CB 4.44Å; I633-F742 HydrophobicContact CB-CE1 3.98Å; I633-F742 HydrophobicContact CD1-CE1 4.19Å; I633-F742 HydrophobicContact CD1-CZ 4.19Å; I633-F742 HydrophobicContact CG2-CD1 4.18Å; I633-F742 HydrophobicContact CG2-CE1 3.57Å; I633-L747 HydrophobicContact CG2-CD1 4.23Å; I633-L747 HydrophobicContact CG2-CD2 3.71Å; I633-L747 HydrophobicContact CG2-CG 4.29Å; I633-I751 HydrophobicContact CG2-CD1 4.15Å
634	N	90.1	Very high	89.1	Confident	10 Å²	10	25.4 Å²	25.4	5%	0.053	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-39	-179.7	-77.9	-22.5	0	0	0	112.5	I531 P533 I630 F631 L638 E741 F742	I531-N634 WeakPolarHBondContact CG2-ND2 3.43Å; I531-N634 PolarHBondContact O-ND2 3.16Å; P533-N634 HydrophobicContact CG-CB 4.3Å; I630-N634 WeakPolarHBondContact O-CB 3.22Å; I630-N634 PolarHBondContact O-N 3.08Å; F631-N634 PolarHBondContact O-N 2.91Å; N634-L638 PolarHBondContact O-N 3.39Å; N634-L638 VanDerWaalsContact O-N 3.11Å; N634-E741 PolarHBondContact ND2-O 3.48Å; N634-F742 VanDerWaalsContact OD1-CD1 3.24Å; N634-F742 WeakPolarHBondContact OD1-CD1 3.33Å
635	N	91.1	Very high	89.4	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-69.4	-44.5	178.7	-80.1	-85.3	0	0	0	112.2	H534 A537 L615 F631 L632 I633 L638 V639	H534-N635 WeakPolarHBondContact CB-OD1 3.46Å; H534-N635 PolarHBondContact N-OD1 2.79Å; A537-N635 HydrophobicContact CB-CB 4.08Å; A537-N635 WeakPolarHBondContact CB-OD1 3.39Å; L615-N635 HydrophobicContact CD1-CB 3.82Å; L615-N635 HydrophobicContact CD2-CB 4Å; F631-N635 VanDerWaalsContact CD2-ND2 3.28Å; F631-N635 WeakPolarHBondContact CD2-ND2 3.5Å; F631-N635 WeakPolarHBondContact CE2-ND2 3.12Å; F631-N635 WeakPolarHBondContact CZ-ND2 3.3Å; F631-N635 PolarHBondContact O-N 3.34Å; F631-N635 VanDerWaalsContact O-N 3.09Å; F631-N635 PolarHBondContact O-ND2 2.94Å; L632-N635 PolarHBondContact O-N 3.26Å; I633-N635 VanDerWaalsContact C-N 3.31Å; I633-N635 PolarHBondContact O-N 3.46Å; N635-L638 PolarHBondContact O-N 3.42Å; N635-V639 WeakPolarHBondContact O-CG2 3.44Å; N635-V639 PolarHBondContact O-N 3.46Å
636	Y	94.1	Very high	89.1	Confident	4 Å²	4	24.1 Å²	24.1	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-68.1	-37.5	177.1	-69.8	-54.1	0	0	0	112.1	F611 E612 L615 L632 I633 L638 V639 I640 C657 A660 V661	F611-Y636 HydrophobicContact CE1-CD1 4.22Å; F611-Y636 HydrophobicContact CE1-CE1 4.09Å; E612-Y636 HydrophobicContact CG-CE1 4.16Å; L615-Y636 HydrophobicContact CD1-CD1 4.18Å; L615-Y636 HydrophobicContact CD1-CE1 3.75Å; L615-Y636 HydrophobicContact CD1-CE2 4.46Å; L632-Y636 HydrophobicContact CB-CD2 4.36Å; L632-Y636 HydrophobicContact CB-CE2 4.14Å; L632-Y636 HydrophobicContact CD2-CE2 4.24Å; L632-Y636 WeakPolarHBondContact O-CD2 3.38Å; L632-Y636 PolarHBondContact O-N 3.48Å; I633-Y636 PolarHBondContact O-N 3.24Å; Y636-L638 PolarHBondContact O-N 3.19Å; Y636-V639 PolarHBondContact O-N 3.21Å; Y636-I640 VanDerWaalsContact O-CG1 3.28Å; Y636-I640 WeakPolarHBondContact O-CG1 3.31Å; Y636-I640 PolarHBondContact O-N 3.14Å; Y636-C657 HydrophobicContact CD1-CB 4.18Å; Y636-A660 HydrophobicContact CD2-CB 3.84Å; Y636-A660 HydrophobicContact CE1-CB 4.43Å; Y636-A660 HydrophobicContact CE2-CB 3.66Å; Y636-A660 HydrophobicContact CG-CB 4.33Å; Y636-V661 VanDerWaalsContact CB-CG2 3.47Å; Y636-V661 HydrophobicContact CG-CG2 4.44Å
637	D	91.8	Very high	88.8	Confident	26 Å²	26	25.5 Å²	25.5	14%	0.139	15%	0.15	C	C	.	.	H	α-helix	trans	-63	-40.1	175.9	-175.4	67	0	0	0	112.3	I633 V639 I640 S641 N744 L747	I633-D637 VanDerWaalsContact O-CB 3.31Å; I633-D637 WeakPolarHBondContact O-CB 3.43Å; I633-D637 PolarHBondContact O-N 3.16Å; D637-V639 VanDerWaalsContact C-N 3.34Å; D637-V639 PolarHBondContact O-N 3.38Å; D637-I640 PolarHBondContact O-N 2.92Å; D637-S641 WeakPolarHBondContact O-CB 3.44Å; D637-S641 PolarHBondContact O-N 2.78Å; D637-S641 PolarHBondContact O-OG 3Å; D637-N744 PolarHBondContact OD2-ND2 3.05Å; D637-L747 HydrophobicContact CB-CD2 3.68Å
638	L	91	Very high	88.8	Confident	32 Å²	32	25.4 Å²	25.4	17%	0.168	15%	0.151	C	C	.	.	H	α-helix	trans	-59.2	-46.5	172.6	175.3	67.2	0	0	0	111.3	P533 A537 R538 N634 N635 Y636 S641 V642	P533-L638 HydrophobicContact CB-CB 4.01Å; P533-L638 HydrophobicContact CB-CD2 3.4Å; P533-L638 VanDerWaalsContact CB-CD2 3.4Å; P533-L638 HydrophobicContact CB-CG 4.26Å; P533-L638 HydrophobicContact CG-CB 4.07Å; P533-L638 HydrophobicContact CG-CD2 4.17Å; A537-L638 HydrophobicContact CB-CD2 4.37Å; R538-L638 HydrophobicContact CB-CD2 3.93Å; N634-L638 PolarHBondContact O-N 3.39Å; N634-L638 VanDerWaalsContact O-N 3.11Å; N635-L638 PolarHBondContact O-N 3.42Å; Y636-L638 PolarHBondContact O-N 3.19Å; L638-S641 PolarHBondContact O-N 2.83Å; L638-V642 HydrophobicContact CD1-CG2 3.99Å; L638-V642 HydrophobicContact CG-CG2 4.45Å; L638-V642 WeakPolarHBondContact O-CG2 3.2Å; L638-V642 PolarHBondContact O-N 3.27Å
639	V	91.9	Very high	88.6	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-45.9	179.3	172	0	0	0	0	110.8	A537 Y540 A541 F611 N635 Y636 D637 S641 L643	A537-V639 HydrophobicContact CB-CG2 4.37Å; Y540-V639 HydrophobicContact CD1-CG1 4.18Å; Y540-V639 HydrophobicContact CD1-CG2 3.96Å; Y540-V639 HydrophobicContact CE1-CG1 3.82Å; Y540-V639 HydrophobicContact CE1-CG2 4.36Å; A541-V639 HydrophobicContact CB-CB 4.38Å; A541-V639 HydrophobicContact CB-CG2 4.1Å; F611-V639 HydrophobicContact CE1-CG2 3.85Å; F611-V639 HydrophobicContact CZ-CG2 3.74Å; N635-V639 WeakPolarHBondContact O-CG2 3.44Å; N635-V639 PolarHBondContact O-N 3.46Å; Y636-V639 PolarHBondContact O-N 3.21Å; D637-V639 VanDerWaalsContact C-N 3.34Å; D637-V639 PolarHBondContact O-N 3.38Å; V639-S641 VanDerWaalsContact C-N 3.34Å; V639-S641 PolarHBondContact O-N 3.06Å; V639-L643 HydrophobicContact CG1-CD1 3.7Å; V639-L643 HydrophobicContact CG1-CG 4.4Å; V639-L643 WeakPolarHBondContact O-CB 3.15Å; V639-L643 VanDerWaalsContact O-CG 3.32Å; V639-L643 WeakPolarHBondContact O-CG 3.44Å; V639-L643 PolarHBondContact O-N 3.42Å
640	I	91.6	Very high	88.2	Confident	22 Å²	22	30.7 Å²	30.7	11%	0.113	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-47.3	176.7	-68.1	162.1	0	0	0	110.2	Y636 D637 L643 T644 V654 C657 R658 V661	Y636-I640 VanDerWaalsContact O-CG1 3.28Å; Y636-I640 WeakPolarHBondContact O-CG1 3.31Å; Y636-I640 PolarHBondContact O-N 3.14Å; D637-I640 PolarHBondContact O-N 2.92Å; I640-L643 PolarHBondContact O-N 3.39Å; I640-T644 WeakPolarHBondContact O-CB 3.46Å; I640-T644 PolarHBondContact O-N 3.02Å; I640-T644 PolarHBondContact O-OG1 3.33Å; I640-V654 HydrophobicContact CG1-CG1 4.46Å; I640-V654 HydrophobicContact CG2-CG1 4.21Å; I640-C657 HydrophobicContact CD1-CB 3.89Å; I640-C657 HydrophobicContact CG1-CB 3.65Å; I640-R658 HydrophobicContact CD1-CB 4.48Å; I640-R658 HydrophobicContact CD1-CG 3.79Å; I640-R658 HydrophobicContact CG1-CG 4.37Å; I640-V661 HydrophobicContact CD1-CG2 4.03Å
641	S	90.7	Very high	88.2	Confident	49 Å²	49	31.3 Å²	31.3	34%	0.343	19%	0.186	S	C	.	.	H	α-helix	trans	-60.8	-50.1	-178	-63.6	0	0	0	0	111.6	D637 L638 V639 T644 E645	D637-S641 WeakPolarHBondContact O-CB 3.44Å; D637-S641 PolarHBondContact O-N 2.78Å; D637-S641 PolarHBondContact O-OG 3Å; L638-S641 PolarHBondContact O-N 2.83Å; V639-S641 VanDerWaalsContact C-N 3.34Å; V639-S641 PolarHBondContact O-N 3.06Å; S641-T644 PolarHBondContact O-N 3.42Å; S641-E645 WeakPolarHBondContact O-CB 3.4Å; S641-E645 PolarHBondContact O-N 2.73Å
642	V	88.8	Confident	88.2	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-43.5	-179.6	171.9	0	0	0	0	111.8	R538 A541 A545 L638 T644 E645 H646	R538-V642 VanDerWaalsContact NH1-CG2 3.29Å; A541-V642 HydrophobicContact CB-CB 3.82Å; A541-V642 HydrophobicContact CB-CG1 3.81Å; A541-V642 HydrophobicContact CB-CG2 4.25Å; A545-V642 HydrophobicContact CB-CG1 4.18Å; L638-V642 HydrophobicContact CD1-CG2 3.99Å; L638-V642 HydrophobicContact CG-CG2 4.45Å; L638-V642 WeakPolarHBondContact O-CG2 3.2Å; L638-V642 PolarHBondContact O-N 3.27Å; V642-T644 VanDerWaalsContact C-N 3.35Å; V642-E645 PolarHBondContact O-N 3.32Å; V642-H646 PolarHBondContact O-N 3.47Å; V642-H646 PolarHBondContact O-ND1 3.35Å
643	L	88.5	Confident	88.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-39.4	177.2	-73.8	173.2	0	0	0	111.8	A544 A545 V639 I640 H646 G647 A648 E653 V654	A544-L643 HydrophobicContact CB-CD2 3.92Å; A545-L643 HydrophobicContact CB-CD2 4.05Å; V639-L643 HydrophobicContact CG1-CD1 3.7Å; V639-L643 HydrophobicContact CG1-CG 4.4Å; V639-L643 WeakPolarHBondContact O-CB 3.15Å; V639-L643 VanDerWaalsContact O-CG 3.32Å; V639-L643 WeakPolarHBondContact O-CG 3.44Å; V639-L643 PolarHBondContact O-N 3.42Å; I640-L643 PolarHBondContact O-N 3.39Å; L643-H646 PolarHBondContact O-N 3.18Å; L643-G647 PolarHBondContact O-N 3.44Å; L643-A648 HydrophobicContact CB-CB 4.34Å; L643-A648 HydrophobicContact CD2-CB 4.26Å; L643-A648 WeakPolarHBondContact O-CA 3.43Å; L643-A648 WeakPolarHBondContact O-CB 3.48Å; L643-A648 PolarHBondContact O-N 3.35Å; L643-E653 HydrophobicContact CD1-CB 4.03Å; L643-V654 HydrophobicContact CB-CG2 3.57Å; L643-V654 HydrophobicContact CD1-CG2 3.68Å; L643-V654 HydrophobicContact CG-CG2 4.27Å
644	T	88.8	Confident	88.2	Confident	60 Å²	60	34.2 Å²	34.2	37%	0.368	21%	0.206	S	C	.	.	H	α-helix	trans	-67.1	-41.6	178.1	-57.8	0	0	0	0	111.2	I640 S641 V642 H646 G647 A649	I640-T644 WeakPolarHBondContact O-CB 3.46Å; I640-T644 PolarHBondContact O-N 3.02Å; I640-T644 PolarHBondContact O-OG1 3.33Å; S641-T644 PolarHBondContact O-N 3.42Å; V642-T644 VanDerWaalsContact C-N 3.35Å; T644-H646 VanDerWaalsContact C-N 3.27Å; T644-H646 PolarHBondContact O-N 3.38Å; T644-G647 PolarHBondContact O-N 3.4Å; T644-G647 VanDerWaalsContact O-N 3.13Å; T644-A649 HydrophobicContact CG2-CB 4.01Å
645	E	85.7	Confident	88.4	Confident	132 Å²	132	36.8 Å²	36.8	62%	0.617	22%	0.223	S	C	*	.	H	α-helix	trans	-58.6	-37.2	175.9	-174.3	-176	174.4	0	0	112.4	S641 V642 G647	S641-E645 WeakPolarHBondContact O-CB 3.4Å; S641-E645 PolarHBondContact O-N 2.73Å; V642-E645 PolarHBondContact O-N 3.32Å; E645-G647 VanDerWaalsContact C-N 3.29Å; E645-G647 PolarHBondContact O-N 3.13Å
646	H	79.7	Confident	88.5	Confident	75 Å²	75	41 Å²	41	35%	0.347	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	13.3	179.6	-66.4	75.1	0	0	0	113.8	A545 V642 L643 T644	A545-H646 HydrophobicContact CB-CB 3.84Å; V642-H646 PolarHBondContact O-N 3.47Å; V642-H646 PolarHBondContact O-ND1 3.35Å; L643-H646 PolarHBondContact O-N 3.18Å; T644-H646 VanDerWaalsContact C-N 3.27Å; T644-H646 PolarHBondContact O-N 3.38Å
647	G	80.2	Confident	88.5	Confident	59 Å²	59	40.8 Å²	40.8	61%	0.608	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.5	8.5	174.8	0	0	0	0	0	115.8	L643 T644 E645 A649	L643-G647 PolarHBondContact O-N 3.44Å; T644-G647 PolarHBondContact O-N 3.4Å; T644-G647 VanDerWaalsContact O-N 3.13Å; E645-G647 VanDerWaalsContact C-N 3.29Å; E645-G647 PolarHBondContact O-N 3.13Å; G647-A649 VanDerWaalsContact C-N 3.33Å; G647-A649 PolarHBondContact O-N 3.44Å
648	A	84.2	Confident	88.6	Confident	9 Å²	9	45 Å²	45	7%	0.074	25%	0.252	C	S	.	.			trans	-95.3	33.5	178.8	0	0	0	0	0	113	H548 L643 D650 S651 V654	H548-A648 HydrophobicContact CB-CB 3.78Å; L643-A648 HydrophobicContact CB-CB 4.34Å; L643-A648 HydrophobicContact CD2-CB 4.26Å; L643-A648 WeakPolarHBondContact O-CA 3.43Å; L643-A648 WeakPolarHBondContact O-CB 3.48Å; L643-A648 PolarHBondContact O-N 3.35Å; A648-D650 VanDerWaalsContact C-N 3.27Å; A648-D650 PolarHBondContact O-N 3.48Å; A648-S651 VanDerWaalsContact O-CB 3.29Å; A648-S651 WeakPolarHBondContact O-CB 3.47Å; A648-S651 PolarHBondContact O-N 2.84Å; A648-S651 PolarHBondContact O-OG 3.13Å; A648-V654 WeakPolarHBondContact O-CG2 3.35Å
649	A	82.8	Confident	88.8	Confident	26 Å²	26	49.6 Å²	49.6	22%	0.215	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.1	-174.1	0	0	0	0	0	114.5	T644 G647 V654 R658	T644-A649 HydrophobicContact CG2-CB 4.01Å; G647-A649 VanDerWaalsContact C-N 3.33Å; G647-A649 PolarHBondContact O-N 3.44Å; A649-V654 WeakPolarHBondContact O-CG1 3.45Å; A649-R658 PolarHBondContact O-NH2 3.45Å
650	D	82.9	Confident	88.8	Confident	133 Å²	133	50.4 Å²	50.4	71%	0.711	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	9.8	-179	-56.1	-42	0	0	0	112.7	K593 A648	K593-D650 IonicContact NZ-OD2 3.04Å; A648-D650 VanDerWaalsContact C-N 3.27Å; A648-D650 PolarHBondContact O-N 3.48Å
651	S	87.5	Confident	88.9	Confident	12 Å²	12	50.2 Å²	50.2	8%	0.084	28%	0.279	C	S	.	.	S	Bend	trans	-69.9	151.3	-179.2	62.9	0	0	0	0	112.3	H548 A648 E653 V654 V655	H548-S651 VanDerWaalsContact CE1-CB 3.47Å; H548-S651 WeakPolarHBondContact CE1-CB 3.32Å; A648-S651 VanDerWaalsContact O-CB 3.29Å; A648-S651 WeakPolarHBondContact O-CB 3.47Å; A648-S651 PolarHBondContact O-N 2.84Å; A648-S651 PolarHBondContact O-OG 3.13Å; S651-E653 WeakPolarHBondContact CB-OE2 3.18Å; S651-E653 PolarHBondContact O-N 3.31Å; S651-V654 PolarHBondContact O-N 3.27Å; S651-V654 VanDerWaalsContact OG-CG2 3.3Å; S651-V654 WeakPolarHBondContact OG-CG2 3.43Å; S651-V654 PolarHBondContact OG-N 3.15Å; S651-V655 PolarHBondContact O-N 3.4Å
652	S	89.2	Confident	89	Confident	66 Å²	66	50.1 Å²	50.1	46%	0.462	28%	0.281	S	S	.	.	H	α-helix	trans	-57.5	-30.7	176.5	53.6	0	0	0	0	112.8	V655 R656	S652-V655 PolarHBondContact O-N 3.46Å; S652-R656 WeakPolarHBondContact O-CB 3.43Å; S652-R656 PolarHBondContact O-N 3.41Å
653	E	90.1	Very high	89.3	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-66.9	-48.6	-179.6	-62.5	89.7	133.3	0	0	110.2	H548 L604 Q608 L643 S651 V655 R656 C657	H548-E653 IonicContact CD2-OE1 3.33Å; H548-E653 IonicContact CE1-OE1 3.45Å; H548-E653 IonicContact CE1-OE2 2.79Å; H548-E653 IonicContact NE2-OE1 2.58Å; H548-E653 PolarHBondContact NE2-OE1 2.91Å; H548-E653 IonicContact NE2-OE2 2.84Å; L604-E653 WeakPolarHBondContact CB-OE1 3.4Å; Q608-E653 PolarHBondContact NE2-O 3.15Å; L643-E653 HydrophobicContact CD1-CB 4.03Å; S651-E653 WeakPolarHBondContact CB-OE2 3.18Å; S651-E653 PolarHBondContact O-N 3.31Å; E653-V655 VanDerWaalsContact C-N 3.34Å; E653-V655 PolarHBondContact O-N 3.26Å; E653-R656 PolarHBondContact O-N 3.14Å; E653-C657 WeakPolarHBondContact O-CB 3.35Å; E653-C657 PolarHBondContact O-N 3.14Å; E653-C657 PolarHBondContact O-SG 3.4Å
654	V	91.8	Very high	89.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-41.5	176.8	171.1	0	0	0	0	111.1	I640 L643 A648 A649 S651 C657 R658	I640-V654 HydrophobicContact CG1-CG1 4.46Å; I640-V654 HydrophobicContact CG2-CG1 4.21Å; L643-V654 HydrophobicContact CB-CG2 3.57Å; L643-V654 HydrophobicContact CD1-CG2 3.68Å; L643-V654 HydrophobicContact CG-CG2 4.27Å; A648-V654 WeakPolarHBondContact O-CG2 3.35Å; A649-V654 WeakPolarHBondContact O-CG1 3.45Å; S651-V654 PolarHBondContact O-N 3.27Å; S651-V654 VanDerWaalsContact OG-CG2 3.3Å; S651-V654 WeakPolarHBondContact OG-CG2 3.43Å; S651-V654 PolarHBondContact OG-N 3.15Å; V654-C657 PolarHBondContact O-N 3.28Å; V654-R658 HydrophobicContact CG1-CG 4.36Å; V654-R658 VanDerWaalsContact CG1-CZ 3.46Å; V654-R658 WeakPolarHBondContact O-CB 3.49Å; V654-R658 VanDerWaalsContact O-CG 3.29Å; V654-R658 WeakPolarHBondContact O-CG 3.26Å; V654-R658 PolarHBondContact O-N 3.48Å
655	V	93.6	Very high	89.6	Confident	65 Å²	65	57.1 Å²	57.1	39%	0.394	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-52	177.5	175.4	0	0	0	0	111	S651 S652 E653 C657 R658 E659	S651-V655 PolarHBondContact O-N 3.4Å; S652-V655 PolarHBondContact O-N 3.46Å; E653-V655 VanDerWaalsContact C-N 3.34Å; E653-V655 PolarHBondContact O-N 3.26Å; V655-C657 PolarHBondContact O-N 3.05Å; V655-R658 WeakPolarHBondContact O-CB 3.37Å; V655-R658 PolarHBondContact O-N 3.43Å; V655-R658 VanDerWaalsContact O-N 3.13Å; V655-E659 WeakPolarHBondContact O-CG 3.3Å; V655-E659 PolarHBondContact O-N 2.91Å
656	R	93.6	Very high	89.9	Confident	87 Å²	87	54.1 Å²	54.1	33%	0.328	30%	0.299	S	S	.	.	H	α-helix	trans	-66.8	-34.6	-179.3	-179.7	172	170.5	-171.1	2.5	112.4	T609 E612 S652 E653 E659 A660	T609-R656 PolarHBondContact OG1-NH1 3.41Å; E612-R656 VanDerWaalsContact OE1-CD 3.3Å; E612-R656 WeakPolarHBondContact OE1-CD 3.37Å; E612-R656 WeakPolarHBondContact OE1-CG 3.47Å; E612-R656 IonicContact OE1-CZ 3.63Å; E612-R656 VanDerWaalsContact OE1-CZ 3.31Å; E612-R656 IonicContact OE1-NE 3.55Å; E612-R656 PolarHBondContact OE1-NE 2.67Å; E612-R656 IonicContact OE1-NH2 2.97Å; E612-R656 IonicContact OE2-CZ 3.05Å; E612-R656 IonicContact OE2-NE 3.83Å; E612-R656 PolarHBondContact OE2-NE 3.05Å; E612-R656 IonicContact OE2-NH2 3.37Å; E612-R656 PolarHBondContact OE2-NH2 3.07Å; S652-R656 WeakPolarHBondContact O-CB 3.43Å; S652-R656 PolarHBondContact O-N 3.41Å; E653-R656 PolarHBondContact O-N 3.14Å; R656-E659 PolarHBondContact O-N 3.36Å; R656-A660 WeakPolarHBondContact O-CB 3.48Å; R656-A660 PolarHBondContact O-N 3.32Å
657	C	93.7	Very high	90.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65	-41.2	170.4	-71.1	0	0	0	0	112.2	Y636 I640 E653 V654 V655 A660 V661	Y636-C657 HydrophobicContact CD1-CB 4.18Å; I640-C657 HydrophobicContact CD1-CB 3.89Å; I640-C657 HydrophobicContact CG1-CB 3.65Å; E653-C657 WeakPolarHBondContact O-CB 3.35Å; E653-C657 PolarHBondContact O-N 3.14Å; E653-C657 PolarHBondContact O-SG 3.4Å; V654-C657 PolarHBondContact O-N 3.28Å; V655-C657 PolarHBondContact O-N 3.05Å; C657-A660 PolarHBondContact O-N 3.17Å; C657-V661 WeakPolarHBondContact O-CG2 3.29Å; C657-V661 PolarHBondContact O-N 2.89Å
658	R	93.7	Very high	91.1	Very high	116 Å²	116	49.7 Å²	49.7	44%	0.438	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-41.8	175.9	-74.8	178.3	-163.7	159	10.5	111.7	I640 A649 V654 V655 A660 V661 A662	I640-R658 HydrophobicContact CD1-CB 4.48Å; I640-R658 HydrophobicContact CD1-CG 3.79Å; I640-R658 HydrophobicContact CG1-CG 4.37Å; A649-R658 PolarHBondContact O-NH2 3.45Å; V654-R658 HydrophobicContact CG1-CG 4.36Å; V654-R658 VanDerWaalsContact CG1-CZ 3.46Å; V654-R658 WeakPolarHBondContact O-CB 3.49Å; V654-R658 VanDerWaalsContact O-CG 3.29Å; V654-R658 WeakPolarHBondContact O-CG 3.26Å; V654-R658 PolarHBondContact O-N 3.48Å; V655-R658 WeakPolarHBondContact O-CB 3.37Å; V655-R658 PolarHBondContact O-N 3.43Å; V655-R658 VanDerWaalsContact O-N 3.13Å; R658-A660 VanDerWaalsContact C-N 3.34Å; R658-V661 PolarHBondContact O-N 3.12Å; R658-A662 WeakPolarHBondContact O-CB 3.24Å; R658-A662 PolarHBondContact O-N 3.47Å
659	E	95	Very high	91.4	Very high	127 Å²	127	49.4 Å²	49.4	59%	0.593	26%	0.264	S	S	*	.	H	α-helix	trans	-61.3	-42.7	174.4	-70.8	175	176	0	0	111.7	V655 R656 A662 K663	V655-E659 WeakPolarHBondContact O-CG 3.3Å; V655-E659 PolarHBondContact O-N 2.91Å; R656-E659 PolarHBondContact O-N 3.36Å; E659-A662 PolarHBondContact O-N 3.27Å; E659-K663 WeakPolarHBondContact O-CB 3.46Å; E659-K663 PolarHBondContact O-N 3.33Å
660	A	93.5	Very high	91.7	Very high	17 Å²	17	51.8 Å²	51.8	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-42.2	175.8	0	0	0	0	0	112.2	Y636 R656 C657 R658 K663 H664	Y636-A660 HydrophobicContact CD2-CB 3.84Å; Y636-A660 HydrophobicContact CE1-CB 4.43Å; Y636-A660 HydrophobicContact CE2-CB 3.66Å; Y636-A660 HydrophobicContact CG-CB 4.33Å; R656-A660 WeakPolarHBondContact O-CB 3.48Å; R656-A660 PolarHBondContact O-N 3.32Å; C657-A660 PolarHBondContact O-N 3.17Å; R658-A660 VanDerWaalsContact C-N 3.34Å; A660-K663 PolarHBondContact O-N 3.42Å; A660-H664 WeakPolarHBondContact O-CB 3.5Å; A660-H664 PolarHBondContact O-CD2 3.34Å; A660-H664 PolarHBondContact O-N 3.33Å
661	V	93	Very high	92	Very high	18 Å²	18	49.2 Å²	49.2	11%	0.109	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-48.7	173.8	170.2	0	0	0	0	110.3	I633 Y636 I640 C657 R658 K663 H664 M665 L747	I633-V661 HydrophobicContact CG2-CG1 4.4Å; Y636-V661 VanDerWaalsContact CB-CG2 3.47Å; Y636-V661 HydrophobicContact CG-CG2 4.44Å; I640-V661 HydrophobicContact CD1-CG2 4.03Å; C657-V661 WeakPolarHBondContact O-CG2 3.29Å; C657-V661 PolarHBondContact O-N 2.89Å; R658-V661 PolarHBondContact O-N 3.12Å; V661-K663 PolarHBondContact O-N 2.77Å; V661-H664 PolarHBondContact O-N 3.49Å; V661-M665 WeakPolarHBondContact O-CB 3.28Å; V661-M665 PolarHBondContact O-N 3.4Å; V661-L747 HydrophobicContact CG1-CD1 4.5Å
662	A	93.4	Very high	92	Very high	48 Å²	48	48.8 Å²	48.8	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-59.6	-45.2	179	0	0	0	0	0	111.8	R658 E659 M665 T666	R658-A662 WeakPolarHBondContact O-CB 3.24Å; R658-A662 PolarHBondContact O-N 3.47Å; E659-A662 PolarHBondContact O-N 3.27Å; A662-M665 PolarHBondContact O-N 2.74Å; A662-T666 WeakPolarHBondContact O-CG2 3.48Å; A662-T666 PolarHBondContact O-N 3.29Å; A662-T666 VanDerWaalsContact O-N 3.13Å
663	K	94.2	Very high	92	Very high	142 Å²	142	45.7 Å²	45.7	62%	0.617	23%	0.232	S	C	*	.	H	α-helix	trans	-59.6	-52.8	176.1	-178.8	-178.7	177.5	-179.2	0	111.6	E659 A660 V661 M665 T666 S667	E659-K663 WeakPolarHBondContact O-CB 3.46Å; E659-K663 PolarHBondContact O-N 3.33Å; A660-K663 PolarHBondContact O-N 3.42Å; V661-K663 PolarHBondContact O-N 2.77Å; K663-M665 VanDerWaalsContact C-N 3.32Å; K663-M665 PolarHBondContact O-N 3Å; K663-T666 PolarHBondContact O-N 3.37Å; K663-T666 PolarHBondContact O-OG1 3.44Å; K663-S667 PolarHBondContact O-N 2.91Å; K663-S667 PolarHBondContact O-OG 3.25Å
664	H	92.2	Very high	91.9	Very high	22 Å²	22	48.8 Å²	48.8	10%	0.102	25%	0.253	C	S	.	.	H	α-helix	trans	-69.7	-29.2	-178.7	-72.1	-54.5	0	0	0	113.2	H629 L632 I633 A660 V661 S667 Y668	H629-H664 AromaticContact CE1-ND1 3.66Å; H629-H664 AromaticContact ND1-CG 3.96Å; H629-H664 AromaticContact ND1-ND1 3.15Å; H629-H664 PolarHBondContact ND1-ND1 3.15Å; H629-H664 VanDerWaalsContact ND1-ND1 3.15Å; L632-H664 VanDerWaalsContact CD1-CE1 3.43Å; L632-H664 WeakPolarHBondContact CD1-CE1 3.35Å; L632-H664 WeakPolarHBondContact CD1-NE2 3.37Å; I633-H664 HydrophobicContact CD1-CB 4.2Å; I633-H664 HydrophobicContact CG1-CB 3.77Å; A660-H664 WeakPolarHBondContact O-CB 3.5Å; A660-H664 PolarHBondContact O-CD2 3.34Å; A660-H664 PolarHBondContact O-N 3.33Å; V661-H664 PolarHBondContact O-N 3.49Å; H664-S667 PolarHBondContact O-N 3.23Å; H664-Y668 VanDerWaalsContact O-CB 3.29Å; H664-Y668 WeakPolarHBondContact O-CB 3.19Å; H664-Y668 PolarHBondContact O-N 2.98Å
665	M	92.1	Very high	91.5	Very high	45 Å²	45	53.4 Å²	53.4	22%	0.222	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-46.2	173.4	-179.3	176	76.8	0	0	110.9	I633 V661 A662 K663 S667 Y668 I669 I751	I633-M665 HydrophobicContact CD1-CB 4.44Å; V661-M665 WeakPolarHBondContact O-CB 3.28Å; V661-M665 PolarHBondContact O-N 3.4Å; A662-M665 PolarHBondContact O-N 2.74Å; K663-M665 VanDerWaalsContact C-N 3.32Å; K663-M665 PolarHBondContact O-N 3Å; M665-S667 PolarHBondContact O-N 3.07Å; M665-Y668 PolarHBondContact O-N 3.46Å; M665-I669 HydrophobicContact CG-CD1 3.82Å; M665-I669 HydrophobicContact CG-CG1 4.44Å; M665-I669 VanDerWaalsContact O-CG1 3.22Å; M665-I669 WeakPolarHBondContact O-CG1 3.27Å; M665-I669 PolarHBondContact O-N 3.28Å; M665-I751 HydrophobicContact CG-CG1 4.02Å; M665-I751 HydrophobicContact SD-CG1 3.88Å
666	T	92.6	Very high	91.2	Very high	69 Å²	69	53.6 Å²	53.6	42%	0.423	28%	0.278	S	S	.	.	H	α-helix	trans	-60.7	-45.8	176.9	58.9	0	0	0	0	112.1	A662 K663 Y668 I669 D670	A662-T666 WeakPolarHBondContact O-CG2 3.48Å; A662-T666 PolarHBondContact O-N 3.29Å; A662-T666 VanDerWaalsContact O-N 3.13Å; K663-T666 PolarHBondContact O-N 3.37Å; K663-T666 PolarHBondContact O-OG1 3.44Å; T666-Y668 PolarHBondContact O-N 3.27Å; T666-I669 PolarHBondContact O-N 3.21Å; T666-D670 PolarHBondContact O-N 3.48Å; T666-D670 VanDerWaalsContact O-N 3.07Å
667	S	92.7	Very high	90.9	Very high	39 Å²	39	49.8 Å²	49.8	27%	0.273	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-36.3	176.8	-52.3	0	0	0	0	112.9	H629 K663 H664 M665 E671	H629-S667 WeakPolarHBondContact NE2-CB 3.34Å; K663-S667 PolarHBondContact O-N 2.91Å; K663-S667 PolarHBondContact O-OG 3.25Å; H664-S667 PolarHBondContact O-N 3.23Å; M665-S667 PolarHBondContact O-N 3.07Å; S667-E671 WeakPolarHBondContact O-CG 3.44Å; S667-E671 PolarHBondContact O-N 2.9Å; S667-E671 VanDerWaalsContact O-N 3.15Å
668	Y	92.3	Very high	90.4	Very high	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-44.8	173.8	170	-95.2	0	0	0	111.7	K626 I630 H664 M665 T666 D670 E671 A672 I738 E741 F742 I751	K626-Y668 HydrophobicContact CD-CE2 4.26Å; K626-Y668 HydrophobicContact CG-CD2 3.91Å; K626-Y668 HydrophobicContact CG-CE2 3.71Å; I630-Y668 HydrophobicContact CD1-CD2 4.39Å; I630-Y668 HydrophobicContact CD1-CE2 3.79Å; I630-Y668 HydrophobicContact CG1-CD2 3.62Å; I630-Y668 HydrophobicContact CG1-CE2 3.36Å; H664-Y668 VanDerWaalsContact O-CB 3.29Å; H664-Y668 WeakPolarHBondContact O-CB 3.19Å; H664-Y668 PolarHBondContact O-N 2.98Å; M665-Y668 PolarHBondContact O-N 3.46Å; T666-Y668 PolarHBondContact O-N 3.27Å; Y668-D670 VanDerWaalsContact C-N 3.32Å; Y668-D670 PolarHBondContact O-N 2.83Å; Y668-E671 PolarHBondContact O-N 3.31Å; Y668-A672 HydrophobicContact CE1-CB 4.13Å; Y668-A672 VanDerWaalsContact O-CB 3.29Å; Y668-A672 WeakPolarHBondContact O-CB 3.12Å; Y668-A672 PolarHBondContact O-N 2.91Å; Y668-I738 HydrophobicContact CE1-CD1 4.47Å; Y668-I738 HydrophobicContact CE1-CG1 4.15Å; Y668-I738 WeakPolarHBondContact OH-CG1 3.13Å; Y668-E741 WeakPolarHBondContact CE2-OE2 3.47Å; Y668-E741 PolarHBondContact OH-OE2 3.45Å; Y668-F742 HydrophobicContact CD1-CE2 4.46Å; Y668-F742 HydrophobicContact CD1-CZ 4.4Å; Y668-F742 HydrophobicContact CD2-CZ 4.45Å; Y668-F742 AromaticContact CE1-CE2 3.85Å; Y668-F742 HydrophobicContact CE1-CE2 3.85Å; Y668-F742 HydrophobicContact CE1-CZ 4.21Å; Y668-F742 HydrophobicContact CE2-CE2 4.15Å; Y668-F742 HydrophobicContact CE2-CZ 4.23Å; Y668-F742 AromaticContact CZ-CE2 3.66Å; Y668-I751 HydrophobicContact CD1-CG2 3.75Å; Y668-I751 HydrophobicContact CE1-CG2 3.63Å
669	I	90.6	Very high	89.9	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-61.7	-43.1	179.5	-68.1	164	0	0	0	110.3	M665 T666 E671 A672 L673 I751 L755 Q758	M665-I669 HydrophobicContact CG-CD1 3.82Å; M665-I669 HydrophobicContact CG-CG1 4.44Å; M665-I669 VanDerWaalsContact O-CG1 3.22Å; M665-I669 WeakPolarHBondContact O-CG1 3.27Å; M665-I669 PolarHBondContact O-N 3.28Å; T666-I669 PolarHBondContact O-N 3.21Å; I669-E671 VanDerWaalsContact C-N 3.34Å; I669-E671 PolarHBondContact O-N 2.91Å; I669-A672 PolarHBondContact O-N 2.92Å; I669-L673 HydrophobicContact CG2-CD1 3.81Å; I669-L673 HydrophobicContact CG2-CG 4.2Å; I669-L673 WeakPolarHBondContact O-CB 3.46Å; I669-L673 VanDerWaalsContact O-CG 3.31Å; I669-L673 WeakPolarHBondContact O-CG 3.36Å; I669-L673 PolarHBondContact O-N 3.43Å; I669-I751 HydrophobicContact CG1-CG2 4.45Å; I669-L755 HydrophobicContact CG1-CB 4.19Å; I669-L755 HydrophobicContact CG2-CB 3.98Å; I669-L755 HydrophobicContact CG2-CD1 4.31Å; I669-L755 HydrophobicContact CG2-CG 4.02Å; I669-Q758 HydrophobicContact CG2-CB 4.02Å; I669-Q758 HydrophobicContact CG2-CG 4.31Å
670	D	89.1	Confident	89.4	Confident	75 Å²	75	43.8 Å²	43.8	40%	0.401	26%	0.255	S	S	.	.	H	α-helix	trans	-57	-47	175	-75.2	-29.5	0	0	0	111.9	T666 Y668 L673 S674 Q758	T666-D670 PolarHBondContact O-N 3.48Å; T666-D670 VanDerWaalsContact O-N 3.07Å; Y668-D670 VanDerWaalsContact C-N 3.32Å; Y668-D670 PolarHBondContact O-N 2.83Å; D670-L673 PolarHBondContact O-N 3.34Å; D670-S674 PolarHBondContact O-N 3.3Å; D670-S674 VanDerWaalsContact O-N 3.09Å; D670-Q758 PolarHBondContact OD1-NE2 2.88Å
671	E	88.3	Confident	88.9	Confident	80 Å²	80	44.7 Å²	44.7	37%	0.374	26%	0.257	S	S	.	.	H	α-helix	trans	-68.5	-34.2	178.3	-70.7	-66.2	155.1	0	0	112.8	K626 S667 Y668 I669 P675	K626-E671 HydrophobicContact CB-CB 4.34Å; S667-E671 WeakPolarHBondContact O-CG 3.44Å; S667-E671 PolarHBondContact O-N 2.9Å; S667-E671 VanDerWaalsContact O-N 3.15Å; Y668-E671 PolarHBondContact O-N 3.31Å; I669-E671 VanDerWaalsContact C-N 3.34Å; I669-E671 PolarHBondContact O-N 2.91Å; E671-P675 WeakPolarHBondContact O-CD 3.22Å
672	A	87.8	Confident	88.4	Confident	3 Å²	3	45.8 Å²	45.8	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-73.2	-33.4	177.3	0	0	0	0	0	112.3	Y668 I669 P675 L755	Y668-A672 HydrophobicContact CE1-CB 4.13Å; Y668-A672 VanDerWaalsContact O-CB 3.29Å; Y668-A672 WeakPolarHBondContact O-CB 3.12Å; Y668-A672 PolarHBondContact O-N 2.91Å; I669-A672 PolarHBondContact O-N 2.92Å; A672-P675 WeakPolarHBondContact O-CD 3.45Å; A672-L755 HydrophobicContact CB-CD1 3.93Å
673	L	89.3	Confident	88	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-77.2	-28.9	175.6	-70.5	175.4	0	0	0	112.7	I669 D670 Y676 F677 G678 I681 L755 Q758 L759	I669-L673 HydrophobicContact CG2-CD1 3.81Å; I669-L673 HydrophobicContact CG2-CG 4.2Å; I669-L673 WeakPolarHBondContact O-CB 3.46Å; I669-L673 VanDerWaalsContact O-CG 3.31Å; I669-L673 WeakPolarHBondContact O-CG 3.36Å; I669-L673 PolarHBondContact O-N 3.43Å; D670-L673 PolarHBondContact O-N 3.34Å; L673-Y676 PolarHBondContact O-N 3.46Å; L673-F677 HydrophobicContact CD2-CD2 3.63Å; L673-F677 HydrophobicContact CD2-CE2 4.11Å; L673-F677 WeakPolarHBondContact O-CA 3.45Å; L673-F677 PolarHBondContact O-N 3.37Å; L673-G678 PolarHBondContact O-N 3.48Å; L673-I681 HydrophobicContact CB-CD1 3.9Å; L673-L755 HydrophobicContact CD2-CD1 4.19Å; L673-L755 HydrophobicContact CD2-CD2 3.81Å; L673-L755 HydrophobicContact CD2-CG 3.83Å; L673-L755 HydrophobicContact CG-CD1 4.3Å; L673-L755 HydrophobicContact CG-CG 4.14Å; L673-Q758 HydrophobicContact CD1-CB 4.35Å; L673-Q758 HydrophobicContact CD1-CG 4.13Å; L673-L759 HydrophobicContact CD2-CB 4.17Å; L673-L759 HydrophobicContact CD2-CD1 4.38Å
674	S	87	Confident	87.4	Confident	66 Å²	66	36.9 Å²	36.9	46%	0.462	22%	0.218	S	C	.	.	H	α-helix	trans	-51.2	-48.8	-178.2	-170.7	0	0	0	0	115.4	D670 Y676 G678	D670-S674 PolarHBondContact O-N 3.3Å; D670-S674 VanDerWaalsContact O-N 3.09Å; S674-Y676 PolarHBondContact O-N 2.8Å; S674-G678 WeakPolarHBondContact O-CA 3.25Å; S674-G678 PolarHBondContact O-N 3.43Å
675	P	84.7	Confident	87	Confident	97 Å²	97	43.8 Å²	43.8	63%	0.63	24%	0.243	S	C	*	.	H	α-helix	trans	-66.9	-30	-178.5	22.3	-32.3	0	0	0	114.6	E671 A672	E671-P675 WeakPolarHBondContact O-CD 3.22Å; A672-P675 WeakPolarHBondContact O-CD 3.45Å
676	Y	86.7	Confident	86.6	Confident	70 Å²	70	44 Å²	44	28%	0.275	25%	0.246	S	C	.	.	H	α-helix	trans	-99.4	-37.3	-175.9	-60.3	-82	0	0	0	112.9	L673 S674 S730 K733 I734 E737	L673-Y676 PolarHBondContact O-N 3.46Å; S674-Y676 PolarHBondContact O-N 2.8Å; Y676-S730 WeakPolarHBondContact CD1-OG 3.47Å; Y676-K733 HydrophobicContact CE1-CB 4.36Å; Y676-K733 HydrophobicContact CE1-CD 4.34Å; Y676-I734 HydrophobicContact CD2-CD1 3.5Å; Y676-I734 HydrophobicContact CD2-CG1 3.49Å; Y676-I734 VanDerWaalsContact CD2-CG1 3.49Å; Y676-I734 HydrophobicContact CE2-CD1 4.02Å; Y676-I734 HydrophobicContact CE2-CG1 3.43Å; Y676-I734 VanDerWaalsContact CE2-CG1 3.43Å; Y676-I734 HydrophobicContact CG-CD1 4.01Å; Y676-I734 HydrophobicContact CG-CG1 4.27Å; Y676-E737 PolarHBondContact OH-OE1 3.12Å; Y676-E737 VanDerWaalsContact OH-OE1 3.06Å
677	F	86.7	Confident	86	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-123.1	6.3	-172.1	-56.2	-70.6	0	0	0	113.3	L673 C679 L680 I681 F723 W727 I731 I734 L759	L673-F677 HydrophobicContact CD2-CD2 3.63Å; L673-F677 HydrophobicContact CD2-CE2 4.11Å; L673-F677 WeakPolarHBondContact O-CA 3.45Å; L673-F677 PolarHBondContact O-N 3.37Å; F677-C679 VanDerWaalsContact C-N 3.29Å; F677-C679 PolarHBondContact O-N 2.56Å; F677-L680 WeakPolarHBondContact O-CB 3.29Å; F677-L680 PolarHBondContact O-N 2.88Å; F677-I681 HydrophobicContact CB-CD1 4.34Å; F677-I681 WeakPolarHBondContact O-CG1 3.35Å; F677-I681 PolarHBondContact O-N 3.34Å; F677-F723 AromaticContact CD1-CD2 3.96Å; F677-F723 HydrophobicContact CD1-CD2 3.96Å; F677-F723 AromaticContact CD1-CE2 3.93Å; F677-F723 HydrophobicContact CD1-CE2 3.93Å; F677-F723 AromaticContact CE1-CD2 3.82Å; F677-F723 HydrophobicContact CE1-CD2 3.82Å; F677-F723 AromaticContact CE1-CE2 3.59Å; F677-F723 HydrophobicContact CE1-CE2 3.59Å; F677-W727 HydrophobicContact CE1-CB 4.14Å; F677-I731 HydrophobicContact CZ-CG1 4.41Å; F677-I734 HydrophobicContact CD2-CD1 4.49Å; F677-I734 HydrophobicContact CE2-CD1 3.93Å; F677-L759 HydrophobicContact CB-CD1 4.42Å; F677-L759 HydrophobicContact CD1-CD1 3.98Å; F677-L759 HydrophobicContact CD2-CD1 3.84Å; F677-L759 HydrophobicContact CD2-CD2 4.33Å; F677-L759 HydrophobicContact CE1-CD1 4.17Å; F677-L759 HydrophobicContact CE1-CD2 4.43Å; F677-L759 HydrophobicContact CE2-CD1 4.02Å; F677-L759 HydrophobicContact CE2-CD2 3.71Å; F677-L759 HydrophobicContact CG-CD1 3.81Å; F677-L759 HydrophobicContact CZ-CD1 4.18Å; F677-L759 HydrophobicContact CZ-CD2 3.77Å
678	G	84.3	Confident	85.4	Confident	19 Å²	19	41.7 Å²	41.7	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-57.8	-35.6	-178.1	0	0	0	0	0	114.2	L673 S674 L680 I681 S682	L673-G678 PolarHBondContact O-N 3.48Å; S674-G678 WeakPolarHBondContact O-CA 3.25Å; S674-G678 PolarHBondContact O-N 3.43Å; G678-L680 VanDerWaalsContact C-N 3.33Å; G678-L680 PolarHBondContact O-N 3.44Å; G678-I681 PolarHBondContact O-N 2.79Å; G678-S682 VanDerWaalsContact O-CB 3.28Å; G678-S682 WeakPolarHBondContact O-CB 3.32Å; G678-S682 PolarHBondContact O-N 2.84Å; G678-S682 PolarHBondContact O-OG 3.19Å
679	C	82.7	Confident	84.6	Confident	95 Å²	95	44.3 Å²	44.3	64%	0.642	25%	0.247	S	C	*	.	H	α-helix	trans	-62.6	-38.2	174.2	-68.7	0	0	0	0	112.6	F677 S682 F683 I719	F677-C679 VanDerWaalsContact C-N 3.29Å; F677-C679 PolarHBondContact O-N 2.56Å; C679-S682 WeakPolarHBondContact CA-OG 3.39Å; C679-S682 PolarHBondContact O-OG 3.24Å; C679-S682 VanDerWaalsContact O-OG 3.1Å; C679-F683 VanDerWaalsContact O-CB 3.29Å; C679-F683 WeakPolarHBondContact O-CB 3.37Å; C679-F683 PolarHBondContact O-N 2.92Å; C679-F683 VanDerWaalsContact O-N 3.16Å; C679-I719 HydrophobicContact CB-CG1 4.3Å; C679-I719 WeakPolarHBondContact O-CD1 3.35Å
680	L	84	Confident	83.5	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-71.6	-46.2	176.6	-176.1	152.2	0	0	0	110.6	F677 G678 F683 V684 I719 F723 H762 Y763 F766	F677-L680 WeakPolarHBondContact O-CB 3.29Å; F677-L680 PolarHBondContact O-N 2.88Å; G678-L680 VanDerWaalsContact C-N 3.33Å; G678-L680 PolarHBondContact O-N 3.44Å; L680-F683 PolarHBondContact O-N 3.15Å; L680-V684 HydrophobicContact CD2-CG2 4.27Å; L680-V684 WeakPolarHBondContact O-CG2 3.4Å; L680-V684 PolarHBondContact O-N 2.86Å; L680-I719 HydrophobicContact CB-CG2 3.99Å; L680-I719 HydrophobicContact CD1-CG2 4.31Å; L680-I719 HydrophobicContact CG-CG2 4.26Å; L680-F723 HydrophobicContact CD1-CD2 4Å; L680-F723 HydrophobicContact CD1-CE2 4.38Å; L680-H762 HydrophobicContact CD2-CB 4.22Å; L680-Y763 HydrophobicContact CD1-CD2 4.2Å; L680-F766 HydrophobicContact CD1-CD1 4.25Å; L680-F766 HydrophobicContact CD1-CG 4.26Å; L680-F766 HydrophobicContact CD2-CB 4.16Å; L680-F766 HydrophobicContact CG-CB 4.37Å; L680-F766 HydrophobicContact CG-CD2 4.26Å; L680-F766 HydrophobicContact CG-CG 4.19Å
681	I	83.5	Confident	82.1	Confident	36 Å²	36	47.9 Å²	47.9	19%	0.185	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-45.4	-178.8	-64	169.1	0	0	0	111	L673 F677 G678 V684 R685 H762	L673-I681 HydrophobicContact CB-CD1 3.9Å; F677-I681 HydrophobicContact CB-CD1 4.34Å; F677-I681 WeakPolarHBondContact O-CG1 3.35Å; F677-I681 PolarHBondContact O-N 3.34Å; G678-I681 PolarHBondContact O-N 2.79Å; I681-V684 PolarHBondContact O-N 3.23Å; I681-R685 WeakPolarHBondContact O-CB 3.45Å; I681-R685 PolarHBondContact O-N 2.91Å; I681-H762 HydrophobicContact CG1-CB 4.4Å
682	S	83.4	Confident	80.6	Confident	41 Å²	41	49 Å²	49	29%	0.287	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-43.9	176.2	53.7	0	0	0	0	112.1	G678 C679 V684 R685 D686	G678-S682 VanDerWaalsContact O-CB 3.28Å; G678-S682 WeakPolarHBondContact O-CB 3.32Å; G678-S682 PolarHBondContact O-N 2.84Å; G678-S682 PolarHBondContact O-OG 3.19Å; C679-S682 WeakPolarHBondContact CA-OG 3.39Å; C679-S682 PolarHBondContact O-OG 3.24Å; C679-S682 VanDerWaalsContact O-OG 3.1Å; S682-V684 PolarHBondContact O-N 3.5Å; S682-R685 PolarHBondContact O-N 3.2Å; S682-D686 WeakPolarHBondContact O-CB 3.45Å; S682-D686 PolarHBondContact O-N 3.11Å
683	F	83.8	Confident	79.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.4	-48.8	175.2	174.1	-89.1	0	0	0	112.2	C679 L680 R685 D686 V687 E712 R715 V716 I719 F766 V769 Y775	C679-F683 VanDerWaalsContact O-CB 3.29Å; C679-F683 WeakPolarHBondContact O-CB 3.37Å; C679-F683 PolarHBondContact O-N 2.92Å; C679-F683 VanDerWaalsContact O-N 3.16Å; L680-F683 PolarHBondContact O-N 3.15Å; F683-R685 VanDerWaalsContact C-N 3.32Å; F683-R685 PolarHBondContact O-N 3.01Å; F683-D686 PolarHBondContact O-N 3.13Å; F683-V687 HydrophobicContact CD1-CG2 4.38Å; F683-V687 HydrophobicContact CD2-CG2 4.36Å; F683-V687 HydrophobicContact CE1-CG2 3.95Å; F683-V687 HydrophobicContact CE2-CG2 3.92Å; F683-V687 HydrophobicContact CZ-CG2 3.68Å; F683-V687 WeakPolarHBondContact O-CG2 3.22Å; F683-V687 PolarHBondContact O-N 3.2Å; F683-E712 HydrophobicContact CE2-CG 4.46Å; F683-E712 WeakPolarHBondContact CE2-OE1 3.42Å; F683-R715 HydrophobicContact CD2-CG 4.3Å; F683-V716 HydrophobicContact CD2-CG2 4.38Å; F683-V716 HydrophobicContact CE1-CG2 4.35Å; F683-V716 HydrophobicContact CE2-CG2 3.36Å; F683-V716 HydrophobicContact CZ-CG2 3.35Å; F683-I719 HydrophobicContact CB-CD1 3.44Å; F683-I719 VanDerWaalsContact CB-CD1 3.44Å; F683-I719 HydrophobicContact CD1-CD1 4.47Å; F683-I719 HydrophobicContact CD2-CD1 3.85Å; F683-I719 HydrophobicContact CG-CD1 3.67Å; F683-F766 AromaticContact CD1-CD2 3.63Å; F683-F766 HydrophobicContact CD1-CD2 3.63Å; F683-F766 AromaticContact CD1-CE2 3.47Å; F683-F766 HydrophobicContact CD1-CE2 3.47Å; F683-F766 VanDerWaalsContact CD1-CE2 3.47Å; F683-F766 AromaticContact CE1-CD2 3.83Å; F683-F766 HydrophobicContact CE1-CD2 3.83Å; F683-F766 AromaticContact CE1-CE2 3.52Å; F683-F766 HydrophobicContact CE1-CE2 3.52Å; F683-F766 HydrophobicContact CG-CE2 4.42Å; F683-V769 HydrophobicContact CE1-CG1 3.97Å; F683-V769 HydrophobicContact CZ-CG1 4.45Å; F683-Y775 HydrophobicContact CZ-CE1 4.23Å
684	V	82.3	Confident	77.3	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.012	33%	0.331	C	S	.	.	H	α-helix	trans	-58.6	-46.4	178.5	171.1	0	0	0	0	110.8	L680 I681 S682 V687 E688 R765 F766	L680-V684 HydrophobicContact CD2-CG2 4.27Å; L680-V684 WeakPolarHBondContact O-CG2 3.4Å; L680-V684 PolarHBondContact O-N 2.86Å; I681-V684 PolarHBondContact O-N 3.23Å; S682-V684 PolarHBondContact O-N 3.5Å; V684-V687 PolarHBondContact O-N 3.24Å; V684-E688 HydrophobicContact CG1-CG 4.45Å; V684-E688 WeakPolarHBondContact O-CB 3.3Å; V684-E688 WeakPolarHBondContact O-CG 3.4Å; V684-E688 PolarHBondContact O-N 3.36Å; V684-R765 HydrophobicContact CG1-CB 3.68Å; V684-F766 HydrophobicContact CG2-CB 3.6Å; V684-F766 HydrophobicContact CG2-CD2 3.88Å; V684-F766 HydrophobicContact CG2-CG 4.24Å
685	R	84.2	Confident	75.6	Confident	168 Å²	168	61.1 Å²	61.1	63%	0.634	34%	0.344	S	S	*	.	H	α-helix	trans	-62.8	-43.6	179.4	-171.6	-176.3	69.1	-175.4	1.3	112.1	I681 S682 F683 A689	I681-R685 WeakPolarHBondContact O-CB 3.45Å; I681-R685 PolarHBondContact O-N 2.91Å; S682-R685 PolarHBondContact O-N 3.2Å; F683-R685 VanDerWaalsContact C-N 3.32Å; F683-R685 PolarHBondContact O-N 3.01Å; R685-A689 VanDerWaalsContact O-CB 3.29Å; R685-A689 WeakPolarHBondContact O-CB 3.31Å; R685-A689 PolarHBondContact O-N 3.35Å
686	D	82.9	Confident	73.6	Confident	50 Å²	50	66.5 Å²	66.5	27%	0.267	35%	0.352	S	S	.	.	H	α-helix	trans	-64.4	-42.2	-180	-68.1	-11.7	0	0	0	111.4	S682 F683 R690 R715	S682-D686 WeakPolarHBondContact O-CB 3.45Å; S682-D686 PolarHBondContact O-N 3.11Å; F683-D686 PolarHBondContact O-N 3.13Å; D686-R690 VanDerWaalsContact O-CG 3.3Å; D686-R690 WeakPolarHBondContact O-CG 3.28Å; D686-R690 PolarHBondContact O-N 3.25Å; D686-R715 IonicContact OD2-CZ 2.77Å; D686-R715 IonicContact OD2-NH1 2.77Å; D686-R715 PolarHBondContact OD2-NH1 3.09Å; D686-R715 IonicContact OD2-NH2 3.64Å
687	V	79.2	Confident	71.6	Confident	7 Å²	7	70.9 Å²	70.9	4%	0.042	38%	0.375	C	S	.	.	H	α-helix	trans	-70.3	-44.4	-179.7	177.9	0	0	0	0	111.3	F683 V684 A689 R690 S691 V769 Y775	F683-V687 HydrophobicContact CD1-CG2 4.38Å; F683-V687 HydrophobicContact CD2-CG2 4.36Å; F683-V687 HydrophobicContact CE1-CG2 3.95Å; F683-V687 HydrophobicContact CE2-CG2 3.92Å; F683-V687 HydrophobicContact CZ-CG2 3.68Å; F683-V687 WeakPolarHBondContact O-CG2 3.22Å; F683-V687 PolarHBondContact O-N 3.2Å; V684-V687 PolarHBondContact O-N 3.24Å; V687-A689 VanDerWaalsContact C-N 3.34Å; V687-A689 PolarHBondContact O-N 3.48Å; V687-R690 WeakPolarHBondContact O-CB 2.9Å; V687-R690 PolarHBondContact O-N 3.03Å; V687-R690 VanDerWaalsContact O-N 3.16Å; V687-S691 PolarHBondContact O-N 3.48Å; V687-S691 PolarHBondContact O-OG 3.09Å; V687-V769 HydrophobicContact CB-CG1 3.91Å; V687-V769 HydrophobicContact CG1-CG1 3.44Å; V687-V769 VanDerWaalsContact CG1-CG1 3.44Å; V687-V769 HydrophobicContact CG1-CG2 4.31Å; V687-V769 HydrophobicContact CG2-CG1 4.19Å; V687-Y775 HydrophobicContact CG1-CE2 3.87Å; V687-Y775 HydrophobicContact CG2-CE2 4.38Å
688	E	80.4	Confident	69.4	Low	52 Å²	52	80 Å²	80	24%	0.243	42%	0.418	C	S	.	.	H	α-helix	trans	-64.8	-37.3	177.7	-70.8	170.7	157.4	0	0	112.2	V684 R690 S691 T692 R765 V769	V684-E688 HydrophobicContact CG1-CG 4.45Å; V684-E688 WeakPolarHBondContact O-CB 3.3Å; V684-E688 WeakPolarHBondContact O-CG 3.4Å; V684-E688 PolarHBondContact O-N 3.36Å; E688-R690 VanDerWaalsContact C-N 3.28Å; E688-R690 PolarHBondContact O-N 3.35Å; E688-S691 PolarHBondContact O-N 2.65Å; E688-T692 PolarHBondContact O-N 3.47Å; E688-T692 PolarHBondContact O-OG1 3.25Å; E688-R765 IonicContact OE1-CZ 3.72Å; E688-R765 IonicContact OE1-NE 3.72Å; E688-R765 PolarHBondContact OE1-NE 2.96Å; E688-R765 IonicContact OE1-NH2 3.68Å; E688-R765 PolarHBondContact OE1-NH2 3.34Å; E688-R765 IonicContact OE2-CZ 3.9Å; E688-R765 IonicContact OE2-NE 2.64Å; E688-R765 PolarHBondContact OE2-NE 3.47Å; E688-R765 IonicContact OE2-NH2 3.77Å; E688-R765 PolarHBondContact OE2-NH2 3.02Å; E688-V769 HydrophobicContact CG-CG2 4.25Å
689	A	76.5	Confident	67.4	Low	55 Å²	55	84.1 Å²	84.1	46%	0.455	44%	0.443	S	S	.	.	H	α-helix	trans	-61.6	-36.4	173.9	0	0	0	0	0	112.3	R685 V687 S693	R685-A689 VanDerWaalsContact O-CB 3.29Å; R685-A689 WeakPolarHBondContact O-CB 3.31Å; R685-A689 PolarHBondContact O-N 3.35Å; V687-A689 VanDerWaalsContact C-N 3.34Å; V687-A689 PolarHBondContact O-N 3.48Å; A689-S693 PolarHBondContact O-N 3.21Å; A689-S693 VanDerWaalsContact O-N 3.11Å; A689-S693 PolarHBondContact O-OG 2.9Å
690	R	67.3	Low	65.6	Low	106 Å²	106	88.1 Å²	88.1	40%	0.4	45%	0.45	S	S	.	.	H	α-helix	trans	-71	-45.6	174.3	-70.2	172	-174.2	176.5	3.4	112.1	D686 V687 E688 T692 S693 E694 E712	D686-R690 VanDerWaalsContact O-CG 3.3Å; D686-R690 WeakPolarHBondContact O-CG 3.28Å; D686-R690 PolarHBondContact O-N 3.25Å; V687-R690 WeakPolarHBondContact O-CB 2.9Å; V687-R690 PolarHBondContact O-N 3.03Å; V687-R690 VanDerWaalsContact O-N 3.16Å; E688-R690 VanDerWaalsContact C-N 3.28Å; E688-R690 PolarHBondContact O-N 3.35Å; R690-T692 PolarHBondContact O-N 2.89Å; R690-T692 VanDerWaalsContact O-N 3.16Å; R690-S693 PolarHBondContact O-N 3.44Å; R690-E694 WeakPolarHBondContact O-CG 3.06Å; R690-E694 PolarHBondContact O-N 3.13Å; R690-E712 IonicContact CZ-OE2 3.5Å; R690-E712 IonicContact NH1-OE2 2.81Å; R690-E712 PolarHBondContact NH1-OE2 3.42Å; R690-E712 IonicContact NH2-OE2 2.87Å
691	S	59.7	Low	63.9	Low	48 Å²	48	93.7 Å²	93.7	34%	0.336	48%	0.48	S	S	.	.	H	α-helix	trans	-56.6	-33.1	175.2	-55.8	0	0	0	0	112.2	V687 E688	V687-S691 PolarHBondContact O-N 3.48Å; V687-S691 PolarHBondContact O-OG 3.09Å; E688-S691 PolarHBondContact O-N 2.65Å
692	T	57.2	Low	62.2	Low	105 Å²	105	99.6 Å²	99.6	64%	0.644	51%	0.506	S	S	*	.	H	α-helix	trans	-74.1	-38.2	175.2	-37	0	0	0	0	112.2	E688 R690	E688-T692 PolarHBondContact O-N 3.47Å; E688-T692 PolarHBondContact O-OG1 3.25Å; R690-T692 PolarHBondContact O-N 2.89Å; R690-T692 VanDerWaalsContact O-N 3.16Å
693	S	54.4	Low	60.6	Low	81 Å²	81	104.2 Å²	104.2	57%	0.566	53%	0.528	S	S	*	.	H	α-helix	trans	-79.3	-32.6	-179.2	-69.1	0	0	0	0	114.3	A689 R690 S695 R696	A689-S693 PolarHBondContact O-N 3.21Å; A689-S693 VanDerWaalsContact O-N 3.11Å; A689-S693 PolarHBondContact O-OG 2.9Å; R690-S693 PolarHBondContact O-N 3.44Å; S693-S695 PolarHBondContact O-N 3.04Å; S693-R696 PolarHBondContact O-N 3.06Å
694	E	52.1	Low	59.1	Low	135 Å²	135	109.9 Å²	109.9	63%	0.631	55%	0.554	S	S	*	*	H	α-helix	trans	-62.5	-23.2	179.1	-78.1	-179.1	178.2	0	0	112.3	R690 R696	R690-E694 WeakPolarHBondContact O-CG 3.06Å; R690-E694 PolarHBondContact O-N 3.13Å; E694-R696 PolarHBondContact O-N 3.4Å; E694-R696 VanDerWaalsContact O-N 3.09Å
695	S	51	Low	57.6	Low	106 Å²	106	114.6 Å²	114.6	74%	0.741	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-10	171.3	-66.4	0	0	0	0	114	S693	S693-S695 PolarHBondContact O-N 3.04Å
696	R	44.1	Very low	56.1	Low	211 Å²	211	109.8 Å²	109.8	80%	0.796	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	-11.7	179.5	-76.4	-171.3	175.3	-170.6	-0.9	116.4	S693 E694	S693-R696 PolarHBondContact O-N 3.06Å; E694-R696 PolarHBondContact O-N 3.4Å; E694-R696 VanDerWaalsContact O-N 3.09Å
697	H	43.9	Very low	54.8	Low	162 Å²	162	114.7 Å²	114.7	75%	0.75	59%	0.589	S	S	*	*			trans	-137.8	78.5	-177.6	-68.6	-59.7	0	0	0	112.5	S699	H697-S699 PolarHBondContact O-N 2.96Å; H697-S699 VanDerWaalsContact O-N 3.12Å
698	Q	40.8	Very low	54	Low	198 Å²	198	118.7 Å²	118.7	93%	0.925	61%	0.611	S	S	*	*			trans	-71	92.8	158.2	-72.6	176.4	3.4	0	0	108.7
699	S	41.9	Very low	53.1	Low	104 Å²	104	118.9 Å²	118.9	73%	0.727	61%	0.613	S	S	*	*			trans	161.2	102.3	153.4	177.5	0	0	0	0	108.3	H697	H697-S699 PolarHBondContact O-N 2.96Å; H697-S699 VanDerWaalsContact O-N 3.12Å
700	K	45.6	Very low	52.7	Low	180 Å²	180	125 Å²	125	78%	0.783	62%	0.624	S	S	*	*			trans	-166.1	140.5	154.5	-105.7	160.6	-168.9	-170.5	0	112.5
701	N	46.6	Very low	52.7	Low	121 Å²	121	123.2 Å²	123.2	65%	0.647	63%	0.628	S	S	*	*			trans	-28	138.6	-172.8	-62.2	-23.9	0	0	0	119.8	D703 E704 L705	N701-D703 PolarHBondContact O-N 3.39Å; N701-E704 PolarHBondContact O-N 3.49Å; N701-L705 PolarHBondContact O-N 3.22Å
702	Q	49.2	Very low	53.3	Low	160 Å²	160	121.4 Å²	121.4	75%	0.748	61%	0.614	S	S	*	*	H	α-helix	trans	-66.7	-27.2	-175.4	-160.9	164	1	0	0	114.5	L705 T706	Q702-L705 WeakPolarHBondContact O-CB 3.42Å; Q702-L705 PolarHBondContact O-N 3.46Å; Q702-T706 PolarHBondContact O-N 3.36Å; Q702-T706 VanDerWaalsContact O-N 3.12Å; Q702-T706 PolarHBondContact O-OG1 3.29Å
703	D	50.5	Low	54	Low	138 Å²	138	120.3 Å²	120.3	74%	0.738	60%	0.602	S	S	*	*	H	α-helix	trans	-76.1	-41.2	178.5	-78.9	-20.2	0	0	0	112.8	N701 L705 T706 Q707	N701-D703 PolarHBondContact O-N 3.39Å; D703-L705 PolarHBondContact O-N 2.73Å; D703-T706 PolarHBondContact O-N 2.93Å; D703-Q707 PolarHBondContact O-N 3.38Å; D703-Q707 VanDerWaalsContact O-N 3.09Å
704	E	50.9	Low	55	Low	118 Å²	118	119.1 Å²	119.1	55%	0.551	60%	0.597	S	S	*	*	H	α-helix	trans	-61.3	-36.8	170.4	-85.7	-173.1	147.2	0	0	110.7	N701 N708	N701-E704 PolarHBondContact O-N 3.49Å; E704-N708 WeakPolarHBondContact O-CB 3.31Å; E704-N708 VanDerWaalsContact O-CG 3.27Å; E704-N708 PolarHBondContact O-N 2.98Å; E704-N708 PolarHBondContact O-ND2 3.16Å
705	L	50.4	Low	56.4	Low	101 Å²	101	116 Å²	116	53%	0.529	58%	0.579	S	S	.	*	H	α-helix	trans	-60.5	-46.3	175.8	-154.7	79.6	0	0	0	111.3	N701 Q702 D703 I709	N701-L705 PolarHBondContact O-N 3.22Å; Q702-L705 WeakPolarHBondContact O-CB 3.42Å; Q702-L705 PolarHBondContact O-N 3.46Å; D703-L705 PolarHBondContact O-N 2.73Å; L705-I709 HydrophobicContact CG-CD1 4.29Å; L705-I709 VanDerWaalsContact O-CD1 3.32Å; L705-I709 WeakPolarHBondContact O-CD1 3.44Å; L705-I709 WeakPolarHBondContact O-CG1 3.47Å; L705-I709 PolarHBondContact O-N 3.03Å
706	T	53.1	Low	57.7	Low	67 Å²	67	110.9 Å²	110.9	41%	0.411	54%	0.544	S	S	.	.	H	α-helix	trans	-71.3	-40	-175.2	-48	0	0	0	0	112.5	Q702 D703 I709 R710	Q702-T706 PolarHBondContact O-N 3.36Å; Q702-T706 VanDerWaalsContact O-N 3.12Å; Q702-T706 PolarHBondContact O-OG1 3.29Å; D703-T706 PolarHBondContact O-N 2.93Å; T706-I709 PolarHBondContact O-N 3.44Å; T706-R710 PolarHBondContact O-N 3.39Å
707	Q	56	Low	59.3	Low	153 Å²	153	103 Å²	103	72%	0.715	52%	0.519	S	S	*	.	H	α-helix	trans	-70.1	-40	176.5	-129.9	-176.3	-1.9	0	0	111.7	D703 I709 R710 S711	D703-Q707 PolarHBondContact O-N 3.38Å; D703-Q707 VanDerWaalsContact O-N 3.09Å; Q707-I709 VanDerWaalsContact C-N 3.34Å; Q707-I709 PolarHBondContact O-N 3.09Å; Q707-R710 PolarHBondContact O-N 2.95Å; Q707-S711 PolarHBondContact O-N 3.22Å; Q707-S711 VanDerWaalsContact O-N 3.13Å; Q707-S711 PolarHBondContact O-OG 2.97Å
708	N	62.7	Low	61.2	Low	91 Å²	91	104.6 Å²	104.6	49%	0.487	52%	0.518	S	S	.	.	H	α-helix	trans	-58.3	-46.8	172.8	-83.7	-20.4	0	0	0	110.7	E704 R710 S711 E712	E704-N708 WeakPolarHBondContact O-CB 3.31Å; E704-N708 VanDerWaalsContact O-CG 3.27Å; E704-N708 PolarHBondContact O-N 2.98Å; E704-N708 PolarHBondContact O-ND2 3.16Å; N708-R710 PolarHBondContact O-N 2.58Å; N708-S711 PolarHBondContact O-N 3.11Å; N708-S711 PolarHBondContact O-OG 2.69Å; N708-E712 WeakPolarHBondContact O-CB 3.38Å; N708-E712 PolarHBondContact O-N 3.05Å
709	I	62.2	Low	63.2	Low	56 Å²	56	96 Å²	96	29%	0.287	48%	0.479	S	S	.	.	H	α-helix	trans	-57.7	-47.6	179.9	-68.9	160.5	0	0	0	112.1	L705 T706 Q707 E712 E713	L705-I709 HydrophobicContact CG-CD1 4.29Å; L705-I709 VanDerWaalsContact O-CD1 3.32Å; L705-I709 WeakPolarHBondContact O-CD1 3.44Å; L705-I709 WeakPolarHBondContact O-CG1 3.47Å; L705-I709 PolarHBondContact O-N 3.03Å; T706-I709 PolarHBondContact O-N 3.44Å; Q707-I709 VanDerWaalsContact C-N 3.34Å; Q707-I709 PolarHBondContact O-N 3.09Å; I709-E712 WeakPolarHBondContact O-CB 3.47Å; I709-E712 PolarHBondContact O-N 3.01Å; I709-E713 WeakPolarHBondContact O-CG 3.29Å; I709-E713 PolarHBondContact O-N 3.35Å
710	R	66.7	Low	64.9	Low	184 Å²	184	91.2 Å²	91.2	69%	0.694	45%	0.445	S	S	*	.	H	α-helix	trans	-66.3	-41.2	-179.7	-74	-174.2	-178.1	172.7	2.6	113.4	T706 Q707 N708 E712 E713 A714	T706-R710 PolarHBondContact O-N 3.39Å; Q707-R710 PolarHBondContact O-N 2.95Å; N708-R710 PolarHBondContact O-N 2.58Å; R710-E712 PolarHBondContact O-N 2.86Å; R710-E713 WeakPolarHBondContact O-CB 3.17Å; R710-E713 PolarHBondContact O-N 3.42Å; R710-A714 PolarHBondContact O-N 3.46Å; R710-A714 VanDerWaalsContact O-N 3.15Å
711	S	68.6	Low	66.6	Low	69 Å²	69	87.8 Å²	87.8	48%	0.483	43%	0.43	S	S	.	.	H	α-helix	trans	-64.3	-35.6	176.8	73.5	0	0	0	0	111.3	Q707 N708 A714 R715	Q707-S711 PolarHBondContact O-N 3.22Å; Q707-S711 VanDerWaalsContact O-N 3.13Å; Q707-S711 PolarHBondContact O-OG 2.97Å; N708-S711 PolarHBondContact O-N 3.11Å; N708-S711 PolarHBondContact O-OG 2.69Å; S711-A714 PolarHBondContact O-N 2.88Å; S711-R715 PolarHBondContact O-N 3.3Å; S711-R715 VanDerWaalsContact O-N 3.09Å
712	E	70.9	Confident	68.3	Low	10 Å²	10	83.6 Å²	83.6	5%	0.047	42%	0.415	C	S	.	.	H	α-helix	trans	-71.6	-41	177.6	-154.4	69.3	-125.5	0	0	111.6	F683 R690 N708 I709 R710 A714 R715 V716 Y775	F683-E712 HydrophobicContact CE2-CG 4.46Å; F683-E712 WeakPolarHBondContact CE2-OE1 3.42Å; R690-E712 IonicContact CZ-OE2 3.5Å; R690-E712 IonicContact NH1-OE2 2.81Å; R690-E712 PolarHBondContact NH1-OE2 3.42Å; R690-E712 IonicContact NH2-OE2 2.87Å; N708-E712 WeakPolarHBondContact O-CB 3.38Å; N708-E712 PolarHBondContact O-N 3.05Å; I709-E712 WeakPolarHBondContact O-CB 3.47Å; I709-E712 PolarHBondContact O-N 3.01Å; R710-E712 PolarHBondContact O-N 2.86Å; E712-A714 VanDerWaalsContact C-N 3.32Å; E712-A714 PolarHBondContact O-N 2.98Å; E712-R715 WeakPolarHBondContact O-CB 3.28Å; E712-R715 PolarHBondContact O-N 3.36Å; E712-R715 VanDerWaalsContact O-N 3.14Å; E712-R715 IonicContact OE1-CZ 2.77Å; E712-R715 IonicContact OE1-NE 3.12Å; E712-R715 PolarHBondContact OE1-NE 3.02Å; E712-R715 IonicContact OE1-NH2 2.98Å; E712-R715 PolarHBondContact OE1-NH2 3.19Å; E712-R715 IonicContact OE2-NH2 3.56Å; E712-V716 VanDerWaalsContact O-CG2 3.31Å; E712-V716 WeakPolarHBondContact O-CG2 3.36Å; E712-V716 PolarHBondContact O-N 3.37Å; E712-Y775 HydrophobicContact CG-CE1 3.6Å; E712-Y775 WeakPolarHBondContact CG-OH 3.17Å
713	E	72.2	Confident	70	Confident	82 Å²	82	76.9 Å²	76.9	38%	0.383	38%	0.384	S	S	.	.	H	α-helix	trans	-54.3	-46.6	171	-83.4	179.8	172.1	0	0	112.2	I709 R710 R715 T717 M778	I709-E713 WeakPolarHBondContact O-CG 3.29Å; I709-E713 PolarHBondContact O-N 3.35Å; R710-E713 WeakPolarHBondContact O-CB 3.17Å; R710-E713 PolarHBondContact O-N 3.42Å; E713-R715 VanDerWaalsContact C-N 3.34Å; E713-T717 VanDerWaalsContact O-CB 3.29Å; E713-T717 WeakPolarHBondContact O-CB 3.47Å; E713-T717 PolarHBondContact O-N 3.31Å; E713-T717 PolarHBondContact O-OG1 3.36Å; E713-M778 HydrophobicContact CB-CE 4.19Å; E713-M778 HydrophobicContact CB-SD 4.42Å; E713-M778 HydrophobicContact CG-CE 3.05Å; E713-M778 HydrophobicContact CG-CG 4.48Å; E713-M778 HydrophobicContact CG-SD 3.61Å
714	A	76	Confident	71.4	Confident	56 Å²	56	73 Å²	73	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-38.9	177.8	0	0	0	0	0	111.8	R710 S711 E712 R718	R710-A714 PolarHBondContact O-N 3.46Å; R710-A714 VanDerWaalsContact O-N 3.15Å; S711-A714 PolarHBondContact O-N 2.88Å; E712-A714 VanDerWaalsContact C-N 3.32Å; E712-A714 PolarHBondContact O-N 2.98Å; A714-R718 WeakPolarHBondContact O-CB 3.43Å; A714-R718 PolarHBondContact O-N 2.82Å; A714-R718 VanDerWaalsContact O-N 3.1Å
715	R	80.2	Confident	72.9	Confident	68 Å²	68	73.2 Å²	73.2	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-64.5	-50	176.8	-170.3	164.6	78.9	140.2	2.8	111.5	F683 D686 S711 E712 E713 T717 R718 I719	F683-R715 HydrophobicContact CD2-CG 4.3Å; D686-R715 IonicContact OD2-CZ 2.77Å; D686-R715 IonicContact OD2-NH1 2.77Å; D686-R715 PolarHBondContact OD2-NH1 3.09Å; D686-R715 IonicContact OD2-NH2 3.64Å; S711-R715 PolarHBondContact O-N 3.3Å; S711-R715 VanDerWaalsContact O-N 3.09Å; E712-R715 WeakPolarHBondContact O-CB 3.28Å; E712-R715 PolarHBondContact O-N 3.36Å; E712-R715 VanDerWaalsContact O-N 3.14Å; E712-R715 IonicContact OE1-CZ 2.77Å; E712-R715 IonicContact OE1-NE 3.12Å; E712-R715 PolarHBondContact OE1-NE 3.02Å; E712-R715 IonicContact OE1-NH2 2.98Å; E712-R715 PolarHBondContact OE1-NH2 3.19Å; E712-R715 IonicContact OE2-NH2 3.56Å; E713-R715 VanDerWaalsContact C-N 3.34Å; R715-T717 PolarHBondContact O-N 2.86Å; R715-R718 PolarHBondContact O-N 3.41Å; R715-I719 HydrophobicContact CG-CD1 4.17Å; R715-I719 WeakPolarHBondContact O-CG1 3.39Å; R715-I719 PolarHBondContact O-N 2.98Å; R715-I719 VanDerWaalsContact O-N 3.11Å
716	V	79.8	Confident	74.5	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-59.2	-47	176.3	174.6	0	0	0	0	111	F683 E712 R718 I719 V720 M770 Y775 I780	F683-V716 HydrophobicContact CD2-CG2 4.38Å; F683-V716 HydrophobicContact CE1-CG2 4.35Å; F683-V716 HydrophobicContact CE2-CG2 3.36Å; F683-V716 HydrophobicContact CZ-CG2 3.35Å; E712-V716 VanDerWaalsContact O-CG2 3.31Å; E712-V716 WeakPolarHBondContact O-CG2 3.36Å; E712-V716 PolarHBondContact O-N 3.37Å; V716-R718 VanDerWaalsContact C-N 3.28Å; V716-R718 PolarHBondContact O-N 2.95Å; V716-I719 PolarHBondContact O-N 3.44Å; V716-I719 VanDerWaalsContact O-N 3.16Å; V716-V720 HydrophobicContact CG1-CG2 4.23Å; V716-V720 WeakPolarHBondContact O-CG2 3.28Å; V716-V720 PolarHBondContact O-N 3.17Å; V716-M770 HydrophobicContact CG1-CE 3.67Å; V716-M770 HydrophobicContact CG1-SD 3.65Å; V716-Y775 HydrophobicContact CG2-CD1 4.17Å; V716-Y775 HydrophobicContact CG2-CE1 4.16Å; V716-I780 HydrophobicContact CG1-CG2 3.87Å
717	T	77.9	Confident	76	Confident	44 Å²	44	69.7 Å²	69.7	27%	0.27	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-39.5	-179.2	-60.4	0	0	0	0	111.9	E713 R715 K721 I780	E713-T717 VanDerWaalsContact O-CB 3.29Å; E713-T717 WeakPolarHBondContact O-CB 3.47Å; E713-T717 PolarHBondContact O-N 3.31Å; E713-T717 PolarHBondContact O-OG1 3.36Å; R715-T717 PolarHBondContact O-N 2.86Å; T717-K721 HydrophobicContact CG2-CD 4.17Å; T717-K721 WeakPolarHBondContact O-CB 3.37Å; T717-K721 WeakPolarHBondContact O-CG 3.34Å; T717-K721 PolarHBondContact O-N 3.47Å; T717-K721 VanDerWaalsContact O-N 3.11Å; T717-I780 HydrophobicContact CG2-CD1 3.89Å
718	R	82.5	Confident	77.2	Confident	197 Å²	197	66.2 Å²	66.2	74%	0.743	33%	0.327	S	S	*	.	H	α-helix	trans	-65.5	-43.5	176.2	-167	-174.7	-59.3	172.2	1.4	111.9	A714 R715 V716 G722	A714-R718 WeakPolarHBondContact O-CB 3.43Å; A714-R718 PolarHBondContact O-N 2.82Å; A714-R718 VanDerWaalsContact O-N 3.1Å; R715-R718 PolarHBondContact O-N 3.41Å; V716-R718 VanDerWaalsContact C-N 3.28Å; V716-R718 PolarHBondContact O-N 2.95Å; R718-G722 PolarHBondContact O-N 2.99Å
719	I	82.3	Confident	78.4	Confident	18 Å²	18	65.9 Å²	65.9	9%	0.092	33%	0.325	C	S	.	.	H	α-helix	trans	-64.7	-47.9	179.8	-66.4	165	0	0	0	110.9	C679 L680 F683 R715 V716 F723 F766	C679-I719 HydrophobicContact CB-CG1 4.3Å; C679-I719 WeakPolarHBondContact O-CD1 3.35Å; L680-I719 HydrophobicContact CB-CG2 3.99Å; L680-I719 HydrophobicContact CD1-CG2 4.31Å; L680-I719 HydrophobicContact CG-CG2 4.26Å; F683-I719 HydrophobicContact CB-CD1 3.44Å; F683-I719 VanDerWaalsContact CB-CD1 3.44Å; F683-I719 HydrophobicContact CD1-CD1 4.47Å; F683-I719 HydrophobicContact CD2-CD1 3.85Å; F683-I719 HydrophobicContact CG-CD1 3.67Å; R715-I719 HydrophobicContact CG-CD1 4.17Å; R715-I719 WeakPolarHBondContact O-CG1 3.39Å; R715-I719 PolarHBondContact O-N 2.98Å; R715-I719 VanDerWaalsContact O-N 3.11Å; V716-I719 PolarHBondContact O-N 3.44Å; V716-I719 VanDerWaalsContact O-N 3.16Å; I719-F723 VanDerWaalsContact O-CB 3.23Å; I719-F723 WeakPolarHBondContact O-CB 3.29Å; I719-F723 PolarHBondContact O-N 3.4Å; I719-F766 HydrophobicContact CG2-CE2 4.14Å; I719-F766 HydrophobicContact CG2-CZ 4Å
720	V	79.6	Confident	79.6	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-65.9	-43.8	-178.4	177.5	0	0	0	0	111.6	V716 N724 F766 I780 Q783 L784	V716-V720 HydrophobicContact CG1-CG2 4.23Å; V716-V720 WeakPolarHBondContact O-CG2 3.28Å; V716-V720 PolarHBondContact O-N 3.17Å; V720-N724 WeakPolarHBondContact O-CB 3.39Å; V720-N724 PolarHBondContact O-N 3.46Å; V720-N724 PolarHBondContact O-ND2 2.91Å; V720-N724 VanDerWaalsContact O-ND2 3.07Å; V720-F766 HydrophobicContact CG2-CE1 3.99Å; V720-F766 HydrophobicContact CG2-CZ 3.81Å; V720-I780 HydrophobicContact CB-CG1 4.01Å; V720-I780 HydrophobicContact CG1-CG1 4.03Å; V720-I780 HydrophobicContact CG2-CG1 4.42Å; V720-I780 HydrophobicContact CG2-CG2 4.49Å; V720-Q783 HydrophobicContact CG1-CB 4.23Å; V720-L784 HydrophobicContact CG2-CD2 4.11Å
721	K	81.4	Confident	80.4	Confident	108 Å²	108	55.3 Å²	55.3	47%	0.47	29%	0.285	S	S	.	.	H	α-helix	trans	-66.1	-45.6	177.8	-73.1	-174.7	177.8	-176.1	0	111.9	T717 N724 I725	T717-K721 HydrophobicContact CG2-CD 4.17Å; T717-K721 WeakPolarHBondContact O-CB 3.37Å; T717-K721 WeakPolarHBondContact O-CG 3.34Å; T717-K721 PolarHBondContact O-N 3.47Å; T717-K721 VanDerWaalsContact O-N 3.11Å; K721-N724 PolarHBondContact O-N 2.89Å; K721-I725 WeakPolarHBondContact O-CD1 3.47Å; K721-I725 VanDerWaalsContact O-CG1 3.27Å; K721-I725 WeakPolarHBondContact O-CG1 3.34Å; K721-I725 PolarHBondContact O-N 2.99Å
722	G	82.2	Confident	81.2	Confident	33 Å²	33	57.1 Å²	57.1	34%	0.34	29%	0.285	S	S	.	.	H	α-helix	trans	-62.2	-44.8	177.4	0	0	0	0	0	112.2	R718 N724 I725 D726	R718-G722 PolarHBondContact O-N 2.99Å; G722-N724 PolarHBondContact O-N 3.47Å; G722-I725 PolarHBondContact O-N 2.9Å; G722-D726 PolarHBondContact O-N 2.78Å
723	F	83.2	Confident	82	Confident	19 Å²	19	62.1 Å²	62.1	8%	0.083	31%	0.307	C	S	.	.	H	α-helix	trans	-59	-50.4	176.5	-176.4	-92.4	0	0	0	111.2	F677 L680 I719 I725 D726 W727 Y763 V785 I790	F677-F723 AromaticContact CD1-CD2 3.96Å; F677-F723 HydrophobicContact CD1-CD2 3.96Å; F677-F723 AromaticContact CD1-CE2 3.93Å; F677-F723 HydrophobicContact CD1-CE2 3.93Å; F677-F723 AromaticContact CE1-CD2 3.82Å; F677-F723 HydrophobicContact CE1-CD2 3.82Å; F677-F723 AromaticContact CE1-CE2 3.59Å; F677-F723 HydrophobicContact CE1-CE2 3.59Å; L680-F723 HydrophobicContact CD1-CD2 4Å; L680-F723 HydrophobicContact CD1-CE2 4.38Å; I719-F723 VanDerWaalsContact O-CB 3.23Å; I719-F723 WeakPolarHBondContact O-CB 3.29Å; I719-F723 PolarHBondContact O-N 3.4Å; F723-I725 PolarHBondContact O-N 3.23Å; F723-I725 VanDerWaalsContact O-N 3.17Å; F723-D726 PolarHBondContact O-N 3.29Å; F723-W727 HydrophobicContact CD1-CB 4.29Å; F723-W727 HydrophobicContact CD1-CG 4.36Å; F723-W727 HydrophobicContact CD2-CB 4Å; F723-W727 HydrophobicContact CE1-CB 4.08Å; F723-W727 HydrophobicContact CE1-CD2 4.46Å; F723-W727 AromaticContact CE1-CG 3.97Å; F723-W727 HydrophobicContact CE1-CG 3.97Å; F723-W727 HydrophobicContact CE2-CB 3.79Å; F723-W727 HydrophobicContact CE2-CG 4.5Å; F723-W727 HydrophobicContact CG-CB 4.26Å; F723-W727 HydrophobicContact CZ-CB 3.82Å; F723-W727 HydrophobicContact CZ-CD2 4.42Å; F723-W727 HydrophobicContact CZ-CG 4.05Å; F723-W727 WeakPolarHBondContact O-CB 3.42Å; F723-W727 PolarHBondContact O-N 3.47Å; F723-W727 VanDerWaalsContact O-N 3.07Å; F723-Y763 AromaticContact CD1-CE2 3.91Å; F723-Y763 HydrophobicContact CD1-CE2 3.91Å; F723-Y763 AromaticContact CE1-CD2 3.93Å; F723-Y763 HydrophobicContact CE1-CD2 3.93Å; F723-Y763 AromaticContact CE1-CE2 3.45Å; F723-Y763 HydrophobicContact CE1-CE2 3.45Å; F723-Y763 VanDerWaalsContact CE1-CE2 3.45Å; F723-Y763 HydrophobicContact CE2-CD2 4.11Å; F723-Y763 HydrophobicContact CE2-CE2 4.37Å; F723-Y763 AromaticContact CZ-CD2 3.67Å; F723-Y763 HydrophobicContact CZ-CD2 3.67Å; F723-Y763 AromaticContact CZ-CE2 3.71Å; F723-Y763 HydrophobicContact CZ-CE2 3.71Å; F723-V785 HydrophobicContact CD1-CG2 4.17Å; F723-V785 HydrophobicContact CE1-CB 4.43Å; F723-V785 HydrophobicContact CE1-CG2 4Å; F723-I790 HydrophobicContact CE1-CD1 3.92Å; F723-I790 HydrophobicContact CZ-CD1 3.97Å
724	N	80.4	Confident	82.7	Confident	57 Å²	57	58.3 Å²	58.3	31%	0.305	29%	0.289	S	S	.	.	H	α-helix	trans	-55.8	-34	-178.9	-90.8	-50.6	0	0	0	114.6	V720 K721 G722 Q783 V785	V720-N724 WeakPolarHBondContact O-CB 3.39Å; V720-N724 PolarHBondContact O-N 3.46Å; V720-N724 PolarHBondContact O-ND2 2.91Å; V720-N724 VanDerWaalsContact O-ND2 3.07Å; K721-N724 PolarHBondContact O-N 2.89Å; G722-N724 PolarHBondContact O-N 3.47Å; N724-Q783 PolarHBondContact ND2-O 2.97Å; N724-Q783 PolarHBondContact OD1-O 3.07Å; N724-V785 WeakPolarHBondContact OD1-CG2 3.47Å
725	I	82	Confident	83.1	Confident	122 Å²	122	56.3 Å²	56.3	63%	0.626	27%	0.27	S	S	*	.	H	α-helix	trans	-81.4	-45.9	-174.9	-63.1	164.7	0	0	0	110.8	K721 G722 F723	K721-I725 WeakPolarHBondContact O-CD1 3.47Å; K721-I725 VanDerWaalsContact O-CG1 3.27Å; K721-I725 WeakPolarHBondContact O-CG1 3.34Å; K721-I725 PolarHBondContact O-N 2.99Å; G722-I725 PolarHBondContact O-N 2.9Å; F723-I725 PolarHBondContact O-N 3.23Å; F723-I725 VanDerWaalsContact O-N 3.17Å
726	D	84.6	Confident	83.3	Confident	80 Å²	80	57.9 Å²	57.9	43%	0.428	28%	0.284	S	S	.	.	H	α-helix	trans	-113.6	-5.6	-162.7	-68.3	-45.8	0	0	0	115.2	G722 F723 K728 N729 S730	G722-D726 PolarHBondContact O-N 2.78Å; F723-D726 PolarHBondContact O-N 3.29Å; D726-K728 VanDerWaalsContact C-N 3.31Å; D726-K728 PolarHBondContact O-N 2.88Å; D726-N729 PolarHBondContact O-N 3.15Å; D726-S730 VanDerWaalsContact O-CB 3.31Å; D726-S730 WeakPolarHBondContact O-CB 3.35Å; D726-S730 PolarHBondContact O-N 2.94Å; D726-S730 PolarHBondContact O-OG 3.34Å
727	W	83.9	Confident	83.6	Confident	14 Å²	14	60.5 Å²	60.5	5%	0.053	30%	0.296	C	S	.	.	H	α-helix	trans	-58.6	-39.3	-172.7	72.5	-81.9	0	0	0	113.5	F677 F723 S730 I731 I790 E793	F677-W727 HydrophobicContact CE1-CB 4.14Å; F723-W727 HydrophobicContact CD1-CB 4.29Å; F723-W727 HydrophobicContact CD1-CG 4.36Å; F723-W727 HydrophobicContact CD2-CB 4Å; F723-W727 HydrophobicContact CE1-CB 4.08Å; F723-W727 HydrophobicContact CE1-CD2 4.46Å; F723-W727 AromaticContact CE1-CG 3.97Å; F723-W727 HydrophobicContact CE1-CG 3.97Å; F723-W727 HydrophobicContact CE2-CB 3.79Å; F723-W727 HydrophobicContact CE2-CG 4.5Å; F723-W727 HydrophobicContact CG-CB 4.26Å; F723-W727 HydrophobicContact CZ-CB 3.82Å; F723-W727 HydrophobicContact CZ-CD2 4.42Å; F723-W727 HydrophobicContact CZ-CG 4.05Å; F723-W727 WeakPolarHBondContact O-CB 3.42Å; F723-W727 PolarHBondContact O-N 3.47Å; F723-W727 VanDerWaalsContact O-N 3.07Å; W727-S730 PolarHBondContact O-N 3.3Å; W727-I731 HydrophobicContact CE3-CD1 3.61Å; W727-I731 HydrophobicContact CZ3-CD1 3.81Å; W727-I731 WeakPolarHBondContact O-CG1 3.28Å; W727-I731 PolarHBondContact O-N 2.89Å; W727-I790 HydrophobicContact CH2-CG1 4.35Å; W727-E793 HydrophobicContact CH2-CB 3.82Å; W727-E793 HydrophobicContact CH2-CG 4.09Å; W727-E793 HydrophobicContact CZ3-CB 4.44Å
728	K	82.8	Confident	84	Confident	80 Å²	80	58.4 Å²	58.4	35%	0.348	28%	0.283	S	S	.	.	H	α-helix	trans	-65.7	-52.1	178.2	-65.3	-165.2	179.7	-160.4	0	111.9	D726 S730 I731 E732 E793	D726-K728 VanDerWaalsContact C-N 3.31Å; D726-K728 PolarHBondContact O-N 2.88Å; K728-S730 PolarHBondContact O-N 3.42Å; K728-I731 PolarHBondContact O-N 3.06Å; K728-I731 VanDerWaalsContact O-N 3.09Å; K728-E732 PolarHBondContact O-N 3.33Å; K728-E732 VanDerWaalsContact O-N 3.07Å; K728-E793 IonicContact NZ-OE2 3.38Å; K728-E793 PolarHBondContact NZ-OE2 2.96Å
729	N	86.6	Confident	84	Confident	83 Å²	83	51.3 Å²	51.3	44%	0.444	26%	0.259	S	S	.	.	H	α-helix	trans	-60.3	-33.8	178.1	-63.7	-20.6	0	0	0	111.3	D726 K733	D726-N729 PolarHBondContact O-N 3.15Å; N729-K733 WeakPolarHBondContact O-CB 3.44Å; N729-K733 VanDerWaalsContact O-CG 3.27Å; N729-K733 WeakPolarHBondContact O-CG 3.39Å; N729-K733 PolarHBondContact O-N 3.46Å
730	S	87	Confident	84	Confident	14 Å²	14	54.7 Å²	54.7	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-68.4	-40.8	176.5	-58.3	0	0	0	0	111.8	Y676 D726 W727 K728 K733 I734	Y676-S730 WeakPolarHBondContact CD1-OG 3.47Å; D726-S730 VanDerWaalsContact O-CB 3.31Å; D726-S730 WeakPolarHBondContact O-CB 3.35Å; D726-S730 PolarHBondContact O-N 2.94Å; D726-S730 PolarHBondContact O-OG 3.34Å; W727-S730 PolarHBondContact O-N 3.3Å; K728-S730 PolarHBondContact O-N 3.42Å; S730-K733 PolarHBondContact O-N 3.22Å; S730-I734 WeakPolarHBondContact O-CB 3.26Å; S730-I734 WeakPolarHBondContact O-CD1 3.28Å; S730-I734 WeakPolarHBondContact O-CG1 3.39Å; S730-I734 PolarHBondContact O-N 3.38Å
731	I	85.2	Confident	84.1	Confident	5 Å²	5	55 Å²	55	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-44	175.7	-70.5	172.1	0	0	0	111.2	F677 W727 K728 I734 H735 F752 L756 L759 M794	F677-I731 HydrophobicContact CZ-CG1 4.41Å; W727-I731 HydrophobicContact CE3-CD1 3.61Å; W727-I731 HydrophobicContact CZ3-CD1 3.81Å; W727-I731 WeakPolarHBondContact O-CG1 3.28Å; W727-I731 PolarHBondContact O-N 2.89Å; K728-I731 PolarHBondContact O-N 3.06Å; K728-I731 VanDerWaalsContact O-N 3.09Å; I731-I734 PolarHBondContact O-N 3.09Å; I731-H735 WeakPolarHBondContact O-CB 3.32Å; I731-H735 PolarHBondContact O-N 2.97Å; I731-F752 HydrophobicContact CG2-CE2 4.08Å; I731-F752 HydrophobicContact CG2-CZ 3.82Å; I731-L756 HydrophobicContact CD1-CD2 4.49Å; I731-L756 HydrophobicContact CG2-CD2 4.05Å; I731-L759 HydrophobicContact CD1-CD2 4.02Å; I731-L759 HydrophobicContact CG1-CD2 4.11Å; I731-M794 HydrophobicContact CD1-CE 4.25Å; I731-M794 HydrophobicContact CD1-CG 4.4Å
732	E	84.8	Confident	84.2	Confident	106 Å²	106	50 Å²	50	50%	0.495	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-44.5	177.1	-71.5	177	-178	0	0	111.4	K728 I734 H735 D736	K728-E732 PolarHBondContact O-N 3.33Å; K728-E732 VanDerWaalsContact O-N 3.07Å; E732-I734 PolarHBondContact O-N 3.22Å; E732-H735 WeakPolarHBondContact O-CB 3.33Å; E732-H735 PolarHBondContact O-N 3.3Å; E732-D736 PolarHBondContact O-N 3.48Å
733	K	87.6	Confident	83.7	Confident	115 Å²	115	52.6 Å²	52.6	50%	0.5	27%	0.273	S	S	.	.	H	α-helix	trans	-61.1	-44	175.1	-74.2	175.8	-178.5	-177.8	0	112.7	Y676 N729 S730 H735 D736 E737	Y676-K733 HydrophobicContact CE1-CB 4.36Å; Y676-K733 HydrophobicContact CE1-CD 4.34Å; N729-K733 WeakPolarHBondContact O-CB 3.44Å; N729-K733 VanDerWaalsContact O-CG 3.27Å; N729-K733 WeakPolarHBondContact O-CG 3.39Å; N729-K733 PolarHBondContact O-N 3.46Å; S730-K733 PolarHBondContact O-N 3.22Å; K733-H735 VanDerWaalsContact C-N 3.32Å; K733-H735 PolarHBondContact O-N 3.44Å; K733-D736 PolarHBondContact O-N 3.46Å; K733-E737 WeakPolarHBondContact O-CG 3.43Å; K733-E737 PolarHBondContact O-N 2.87Å
734	I	86.4	Confident	83.5	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-40.6	176.8	-69.6	165.8	0	0	0	110.9	Y676 F677 S730 I731 E732 E737 I738 L755	Y676-I734 HydrophobicContact CD2-CD1 3.5Å; Y676-I734 HydrophobicContact CD2-CG1 3.49Å; Y676-I734 VanDerWaalsContact CD2-CG1 3.49Å; Y676-I734 HydrophobicContact CE2-CD1 4.02Å; Y676-I734 HydrophobicContact CE2-CG1 3.43Å; Y676-I734 VanDerWaalsContact CE2-CG1 3.43Å; Y676-I734 HydrophobicContact CG-CD1 4.01Å; Y676-I734 HydrophobicContact CG-CG1 4.27Å; F677-I734 HydrophobicContact CD2-CD1 4.49Å; F677-I734 HydrophobicContact CE2-CD1 3.93Å; S730-I734 WeakPolarHBondContact O-CB 3.26Å; S730-I734 WeakPolarHBondContact O-CD1 3.28Å; S730-I734 WeakPolarHBondContact O-CG1 3.39Å; S730-I734 PolarHBondContact O-N 3.38Å; I731-I734 PolarHBondContact O-N 3.09Å; E732-I734 PolarHBondContact O-N 3.22Å; I734-E737 PolarHBondContact O-N 2.92Å; I734-I738 HydrophobicContact CG2-CD1 3.78Å; I734-I738 HydrophobicContact CG2-CG1 4.43Å; I734-I738 VanDerWaalsContact O-CG1 3.32Å; I734-I738 WeakPolarHBondContact O-CG1 3.32Å; I734-I738 PolarHBondContact O-N 3.18Å; I734-L755 HydrophobicContact CG2-CD1 3.48Å; I734-L755 VanDerWaalsContact CG2-CD1 3.48Å; I734-L755 HydrophobicContact CG2-CD2 3.97Å; I734-L755 HydrophobicContact CG2-CG 4.39Å
735	H	84.7	Confident	83.5	Confident	15 Å²	15	56.6 Å²	56.6	7%	0.069	29%	0.29	C	S	.	.	H	α-helix	trans	-59.2	-50.4	175.9	170.7	-93.2	0	0	0	111.3	I731 E732 K733 E737 I738 M739 F752 F801	I731-H735 WeakPolarHBondContact O-CB 3.32Å; I731-H735 PolarHBondContact O-N 2.97Å; E732-H735 WeakPolarHBondContact O-CB 3.33Å; E732-H735 PolarHBondContact O-N 3.3Å; K733-H735 VanDerWaalsContact C-N 3.32Å; K733-H735 PolarHBondContact O-N 3.44Å; H735-E737 VanDerWaalsContact C-N 3.29Å; H735-E737 PolarHBondContact O-N 3.24Å; H735-I738 PolarHBondContact O-N 2.81Å; H735-I738 VanDerWaalsContact O-N 3.15Å; H735-M739 VanDerWaalsContact NE2-CE 3.31Å; H735-M739 WeakPolarHBondContact NE2-CE 3.44Å; H735-M739 WeakPolarHBondContact O-CG 3.43Å; H735-M739 PolarHBondContact O-N 3.16Å; H735-F752 HydrophobicContact CB-CD2 4.13Å; H735-F752 HydrophobicContact CB-CE2 3.61Å; H735-F752 HydrophobicContact CB-CZ 3.91Å; H735-F752 AromaticContact CD2-CE1 3.98Å; H735-F801 AromaticContact CD2-CD2 3.86Å; H735-F801 AromaticContact CD2-CG 3.84Å; H735-F801 AromaticContact CE1-CD1 3.43Å; H735-F801 VanDerWaalsContact CE1-CD1 3.43Å; H735-F801 WeakPolarHBondContact CE1-CD1 3.12Å; H735-F801 AromaticContact CE1-CE1 3.58Å; H735-F801 AromaticContact CE1-CG 3.87Å; H735-F801 AromaticContact NE2-CD1 3.37Å; H735-F801 WeakPolarHBondContact NE2-CD1 3.42Å; H735-F801 AromaticContact NE2-CD2 3.85Å; H735-F801 AromaticContact NE2-CE1 3.93Å; H735-F801 AromaticContact NE2-CG 3.34Å; H735-F801 VanDerWaalsContact NE2-CG 3.34Å; H735-F801 WeakPolarHBondContact NE2-CG 3.4Å
736	D	85.2	Confident	83.7	Confident	101 Å²	101	54.7 Å²	54.7	54%	0.54	29%	0.285	S	S	.	.	H	α-helix	trans	-64.2	-36.3	-179.3	-65.4	-14.5	0	0	0	111.6	E732 K733 M740	E732-D736 PolarHBondContact O-N 3.48Å; K733-D736 PolarHBondContact O-N 3.46Å; D736-M740 VanDerWaalsContact O-CB 3.28Å; D736-M740 WeakPolarHBondContact O-CB 3.17Å; D736-M740 PolarHBondContact O-N 3.19Å; D736-M740 VanDerWaalsContact O-N 3.11Å
737	E	85.2	Confident	83.7	Confident	55 Å²	55	51 Å²	51	26%	0.257	27%	0.265	S	S	.	.	H	α-helix	trans	-61.9	-47.7	171.1	-76.4	-177.4	-164.6	0	0	112	K626 Y676 K733 I734 H735 M739 M740 E741	K626-E737 IonicContact NZ-OE2 3.66Å; K626-E737 PolarHBondContact NZ-OE2 2.65Å; Y676-E737 PolarHBondContact OH-OE1 3.12Å; Y676-E737 VanDerWaalsContact OH-OE1 3.06Å; K733-E737 WeakPolarHBondContact O-CG 3.43Å; K733-E737 PolarHBondContact O-N 2.87Å; I734-E737 PolarHBondContact O-N 2.92Å; H735-E737 VanDerWaalsContact C-N 3.29Å; H735-E737 PolarHBondContact O-N 3.24Å; E737-M739 PolarHBondContact O-N 3.45Å; E737-M740 PolarHBondContact O-N 3.05Å; E737-E741 VanDerWaalsContact O-CB 3.3Å; E737-E741 WeakPolarHBondContact O-CB 3.36Å; E737-E741 VanDerWaalsContact O-CG 3.22Å; E737-E741 WeakPolarHBondContact O-CG 3.43Å; E737-E741 PolarHBondContact O-N 2.86Å
738	I	85.9	Confident	83.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-47.3	178.9	-74.4	167.6	0	0	0	110.6	Y668 I734 H735 M740 E741 F742 G748 I751 F752 L755	Y668-I738 HydrophobicContact CE1-CD1 4.47Å; Y668-I738 HydrophobicContact CE1-CG1 4.15Å; Y668-I738 WeakPolarHBondContact OH-CG1 3.13Å; I734-I738 HydrophobicContact CG2-CD1 3.78Å; I734-I738 HydrophobicContact CG2-CG1 4.43Å; I734-I738 VanDerWaalsContact O-CG1 3.32Å; I734-I738 WeakPolarHBondContact O-CG1 3.32Å; I734-I738 PolarHBondContact O-N 3.18Å; H735-I738 PolarHBondContact O-N 2.81Å; H735-I738 VanDerWaalsContact O-N 3.15Å; I738-M740 PolarHBondContact O-N 3.15Å; I738-E741 PolarHBondContact O-N 2.9Å; I738-F742 HydrophobicContact CB-CD2 4.49Å; I738-F742 HydrophobicContact CG2-CD2 3.88Å; I738-F742 HydrophobicContact CG2-CE2 4.44Å; I738-F742 WeakPolarHBondContact O-CD2 3.27Å; I738-F742 PolarHBondContact O-N 3.18Å; I738-G748 WeakPolarHBondContact CG2-O 3.3Å; I738-I751 HydrophobicContact CD1-CG2 4.3Å; I738-F752 HydrophobicContact CD1-CB 4.25Å; I738-F752 HydrophobicContact CD1-CD2 4.02Å; I738-L755 HydrophobicContact CD1-CD1 4.14Å
739	M	82.9	Confident	84	Confident	47 Å²	47	47.1 Å²	47.1	23%	0.232	25%	0.249	C	C	.	.	H	α-helix	trans	-65.9	-24.1	-179.2	-66.8	-57.6	173	0	0	112.9	H735 E737 F745	H735-M739 VanDerWaalsContact NE2-CE 3.31Å; H735-M739 WeakPolarHBondContact NE2-CE 3.44Å; H735-M739 WeakPolarHBondContact O-CG 3.43Å; H735-M739 PolarHBondContact O-N 3.16Å; E737-M739 PolarHBondContact O-N 3.45Å; M739-F745 HydrophobicContact CE-CD2 4.36Å; M739-F745 HydrophobicContact CE-CE2 4.03Å; M739-F745 HydrophobicContact SD-CD2 3.9Å; M739-F745 HydrophobicContact SD-CE2 4.04Å
740	M	81.4	Confident	84	Confident	89 Å²	89	48.7 Å²	48.7	44%	0.438	25%	0.254	S	S	.	.	H	α-helix	trans	-85.2	-33.2	174.4	-171.7	175.6	53.7	0	0	112.8	Y528 D736 E737 I738	Y528-M740 HydrophobicContact CE1-CE 4.35Å; Y528-M740 HydrophobicContact CE1-CG 3.73Å; Y528-M740 HydrophobicContact CE1-SD 4.26Å; Y528-M740 HydrophobicContact CE2-CG 4.45Å; Y528-M740 HydrophobicContact CE2-SD 4.29Å; Y528-M740 WeakPolarHBondContact OH-CE 3.29Å; Y528-M740 PolarHBondContact OH-SD 3.24Å; D736-M740 VanDerWaalsContact O-CB 3.28Å; D736-M740 WeakPolarHBondContact O-CB 3.17Å; D736-M740 PolarHBondContact O-N 3.19Å; D736-M740 VanDerWaalsContact O-N 3.11Å; E737-M740 PolarHBondContact O-N 3.05Å; I738-M740 PolarHBondContact O-N 3.15Å
741	E	83	Confident	84.1	Confident	10 Å²	10	48 Å²	48	5%	0.047	25%	0.249	C	C	.	.	H	α-helix	trans	-79.8	-32.5	-179.3	-74.5	175.5	172.3	0	0	113.1	K626 I630 N634 Y668 E737 I738	K626-E741 WeakPolarHBondContact CE-OE1 2.91Å; K626-E741 WeakPolarHBondContact CE-OE2 3.38Å; K626-E741 IonicContact NZ-OE1 2.88Å; K626-E741 PolarHBondContact NZ-OE1 3.01Å; K626-E741 IonicContact NZ-OE2 3.58Å; K626-E741 PolarHBondContact NZ-OE2 3.12Å; I630-E741 HydrophobicContact CD1-CB 4.06Å; I630-E741 HydrophobicContact CD1-CG 3.85Å; I630-E741 WeakPolarHBondContact CD1-OE2 3.37Å; I630-E741 HydrophobicContact CG2-CB 4.15Å; N634-E741 PolarHBondContact ND2-O 3.48Å; Y668-E741 WeakPolarHBondContact CE2-OE2 3.47Å; Y668-E741 PolarHBondContact OH-OE2 3.45Å; E737-E741 VanDerWaalsContact O-CB 3.3Å; E737-E741 WeakPolarHBondContact O-CB 3.36Å; E737-E741 VanDerWaalsContact O-CG 3.22Å; E737-E741 WeakPolarHBondContact O-CG 3.43Å; E737-E741 PolarHBondContact O-N 2.86Å; I738-E741 PolarHBondContact O-N 2.9Å
742	F	82.9	Confident	84.2	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.009	25%	0.248	C	C	.	.			trans	-111.9	106.5	-179.4	-61.7	-82.3	0	0	0	111	I630 I633 N634 Y668 I738 N744 L747 I751	I630-F742 HydrophobicContact CB-CE1 4.4Å; I630-F742 HydrophobicContact CB-CZ 4.21Å; I630-F742 HydrophobicContact CG1-CE2 4.42Å; I630-F742 HydrophobicContact CG1-CZ 3.96Å; I630-F742 HydrophobicContact CG2-CD1 4.22Å; I630-F742 HydrophobicContact CG2-CE1 3.72Å; I630-F742 HydrophobicContact CG2-CE2 4.35Å; I630-F742 HydrophobicContact CG2-CZ 3.79Å; I633-F742 HydrophobicContact CB-CE1 3.98Å; I633-F742 HydrophobicContact CD1-CE1 4.19Å; I633-F742 HydrophobicContact CD1-CZ 4.19Å; I633-F742 HydrophobicContact CG2-CD1 4.18Å; I633-F742 HydrophobicContact CG2-CE1 3.57Å; N634-F742 VanDerWaalsContact OD1-CD1 3.24Å; N634-F742 WeakPolarHBondContact OD1-CD1 3.33Å; Y668-F742 HydrophobicContact CD1-CE2 4.46Å; Y668-F742 HydrophobicContact CD1-CZ 4.4Å; Y668-F742 HydrophobicContact CD2-CZ 4.45Å; Y668-F742 AromaticContact CE1-CE2 3.85Å; Y668-F742 HydrophobicContact CE1-CE2 3.85Å; Y668-F742 HydrophobicContact CE1-CZ 4.21Å; Y668-F742 HydrophobicContact CE2-CE2 4.15Å; Y668-F742 HydrophobicContact CE2-CZ 4.23Å; Y668-F742 AromaticContact CZ-CE2 3.66Å; I738-F742 HydrophobicContact CB-CD2 4.49Å; I738-F742 HydrophobicContact CG2-CD2 3.88Å; I738-F742 HydrophobicContact CG2-CE2 4.44Å; I738-F742 WeakPolarHBondContact O-CD2 3.27Å; I738-F742 PolarHBondContact O-N 3.18Å; F742-N744 VanDerWaalsContact C-N 3.27Å; F742-N744 PolarHBondContact O-N 3.37Å; F742-L747 HydrophobicContact CD1-CD2 3.97Å; F742-L747 HydrophobicContact CD1-CG 4.4Å; F742-I751 HydrophobicContact CD1-CD1 3.65Å; F742-I751 HydrophobicContact CD2-CD1 3.91Å; F742-I751 HydrophobicContact CE1-CD1 3.36Å; F742-I751 HydrophobicContact CE2-CD1 3.62Å; F742-I751 HydrophobicContact CE2-CG2 4.37Å; F742-I751 HydrophobicContact CG-CD1 3.93Å; F742-I751 HydrophobicContact CZ-CD1 3.35Å
743	A	71.2	Confident	84.3	Confident	88 Å²	88	45.5 Å²	45.5	73%	0.727	24%	0.237	S	C	*	.	S	Bend	trans	-67.9	-26.5	180	0	0	0	0	0	113.4	F745	A743-F745 PolarHBondContact O-N 2.87Å
744	N	80.1	Confident	84.3	Confident	47 Å²	47	41 Å²	41	25%	0.251	22%	0.224	S	C	.	.			trans	-79.8	105.8	173.1	-178.1	-8.5	0	0	0	109.1	D637 F742 T746 L747 G748	D637-N744 PolarHBondContact OD2-ND2 3.05Å; F742-N744 VanDerWaalsContact C-N 3.27Å; F742-N744 PolarHBondContact O-N 3.37Å; N744-T746 VanDerWaalsContact C-N 3.27Å; N744-T746 PolarHBondContact ND2-OG1 3.19Å; N744-T746 PolarHBondContact O-N 3.01Å; N744-T746 PolarHBondContact OD1-N 3.42Å; N744-T746 VanDerWaalsContact OD1-N 3.07Å; N744-T746 PolarHBondContact OD1-OG1 3.41Å; N744-L747 HydrophobicContact CB-CB 3.91Å; N744-L747 WeakPolarHBondContact O-CB 3.44Å; N744-L747 PolarHBondContact O-N 3.48Å; N744-L747 VanDerWaalsContact O-N 3.14Å; N744-G748 PolarHBondContact O-N 2.89Å
745	F	81	Confident	84.5	Confident	113 Å²	113	41 Å²	41	50%	0.496	22%	0.223	S	C	.	.	H	α-helix	trans	-55.2	-40.7	-179.8	-178.7	-102.6	0	0	0	112.6	M739 A743 L747 G748 T749 F801	M739-F745 HydrophobicContact CE-CD2 4.36Å; M739-F745 HydrophobicContact CE-CE2 4.03Å; M739-F745 HydrophobicContact SD-CD2 3.9Å; M739-F745 HydrophobicContact SD-CE2 4.04Å; A743-F745 PolarHBondContact O-N 2.87Å; F745-L747 VanDerWaalsContact C-N 3.33Å; F745-L747 PolarHBondContact O-N 3.46Å; F745-G748 PolarHBondContact O-N 3.26Å; F745-T749 WeakPolarHBondContact O-CB 3.47Å; F745-T749 PolarHBondContact O-N 2.92Å; F745-T749 PolarHBondContact O-OG1 2.64Å; F745-T749 VanDerWaalsContact O-OG1 3.05Å; F745-F801 VanDerWaalsContact CZ-O 3.28Å; F745-F801 WeakPolarHBondContact CZ-O 3.39Å
746	T	85	Confident	84.6	Confident	83 Å²	83	40.6 Å²	40.6	51%	0.509	22%	0.222	S	C	.	.	H	α-helix	trans	-64.2	-40.3	-179.6	64	0	0	0	0	111.9	N744 Q750	N744-T746 VanDerWaalsContact C-N 3.27Å; N744-T746 PolarHBondContact ND2-OG1 3.19Å; N744-T746 PolarHBondContact O-N 3.01Å; N744-T746 PolarHBondContact OD1-N 3.42Å; N744-T746 VanDerWaalsContact OD1-N 3.07Å; N744-T746 PolarHBondContact OD1-OG1 3.41Å; T746-Q750 VanDerWaalsContact O-CG 3.26Å; T746-Q750 WeakPolarHBondContact O-CG 3.39Å; T746-Q750 PolarHBondContact O-N 3.01Å
747	L	85.3	Confident	84.7	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-45.5	175.2	-177.6	66.3	0	0	0	111	I633 D637 V661 F742 N744 F745 T749 Q750 I751	I633-L747 HydrophobicContact CG2-CD1 4.23Å; I633-L747 HydrophobicContact CG2-CD2 3.71Å; I633-L747 HydrophobicContact CG2-CG 4.29Å; D637-L747 HydrophobicContact CB-CD2 3.68Å; V661-L747 HydrophobicContact CG1-CD1 4.5Å; F742-L747 HydrophobicContact CD1-CD2 3.97Å; F742-L747 HydrophobicContact CD1-CG 4.4Å; N744-L747 HydrophobicContact CB-CB 3.91Å; N744-L747 WeakPolarHBondContact O-CB 3.44Å; N744-L747 PolarHBondContact O-N 3.48Å; N744-L747 VanDerWaalsContact O-N 3.14Å; F745-L747 VanDerWaalsContact C-N 3.33Å; F745-L747 PolarHBondContact O-N 3.46Å; L747-T749 VanDerWaalsContact C-N 3.33Å; L747-T749 PolarHBondContact O-N 3.32Å; L747-Q750 WeakPolarHBondContact O-CB 3.35Å; L747-Q750 PolarHBondContact O-N 2.85Å; L747-Q750 VanDerWaalsContact O-N 3.15Å; L747-I751 HydrophobicContact CD1-CD1 4.23Å; L747-I751 HydrophobicContact CD1-CG1 4.47Å; L747-I751 HydrophobicContact CG-CD1 3.93Å; L747-I751 VanDerWaalsContact O-CG1 3.28Å; L747-I751 WeakPolarHBondContact O-CG1 3.47Å; L747-I751 PolarHBondContact O-N 3.1Å
748	G	85.9	Confident	84.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-55.8	-46.7	176	0	0	0	0	0	112.1	I738 N744 F745 Q750 I751 F752	I738-G748 WeakPolarHBondContact CG2-O 3.3Å; N744-G748 PolarHBondContact O-N 2.89Å; F745-G748 PolarHBondContact O-N 3.26Å; G748-Q750 PolarHBondContact O-N 3.16Å; G748-I751 PolarHBondContact O-N 2.71Å; G748-F752 WeakPolarHBondContact O-CB 3.47Å; G748-F752 PolarHBondContact O-N 2.85Å
749	T	86.2	Confident	84.9	Confident	11 Å²	11	37.8 Å²	37.8	7%	0.067	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-39.2	176.5	-57.8	0	0	0	0	112.2	F745 L747 F752 Q753 F801 S802	F745-T749 WeakPolarHBondContact O-CB 3.47Å; F745-T749 PolarHBondContact O-N 2.92Å; F745-T749 PolarHBondContact O-OG1 2.64Å; F745-T749 VanDerWaalsContact O-OG1 3.05Å; L747-T749 VanDerWaalsContact C-N 3.33Å; L747-T749 PolarHBondContact O-N 3.32Å; T749-F752 PolarHBondContact O-N 3.35Å; T749-Q753 WeakPolarHBondContact O-CB 3.41Å; T749-Q753 VanDerWaalsContact O-CG 3.25Å; T749-Q753 WeakPolarHBondContact O-CG 3.39Å; T749-Q753 PolarHBondContact O-N 2.77Å; T749-F801 PolarHBondContact OG1-O 3.37Å; T749-S802 WeakPolarHBondContact CG2-OG 3.45Å
750	Q	87.5	Confident	85	Confident	116 Å²	116	37.8 Å²	37.8	54%	0.542	22%	0.216	S	C	.	.	H	α-helix	trans	-63.3	-45	175	-74.8	173	18.7	0	0	112.1	T746 L747 G748 Q753 G754	T746-Q750 VanDerWaalsContact O-CG 3.26Å; T746-Q750 WeakPolarHBondContact O-CG 3.39Å; T746-Q750 PolarHBondContact O-N 3.01Å; L747-Q750 WeakPolarHBondContact O-CB 3.35Å; L747-Q750 PolarHBondContact O-N 2.85Å; L747-Q750 VanDerWaalsContact O-N 3.15Å; G748-Q750 PolarHBondContact O-N 3.16Å; Q750-Q753 PolarHBondContact O-N 2.72Å; Q750-G754 PolarHBondContact O-N 3.37Å
751	I	88.1	Confident	85.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.7	-44.1	177.7	-66	171.5	0	0	0	110.2	I633 M665 Y668 I669 I738 F742 L747 G748 Q753 G754 L755	I633-I751 HydrophobicContact CG2-CD1 4.15Å; M665-I751 HydrophobicContact CG-CG1 4.02Å; M665-I751 HydrophobicContact SD-CG1 3.88Å; Y668-I751 HydrophobicContact CD1-CG2 3.75Å; Y668-I751 HydrophobicContact CE1-CG2 3.63Å; I669-I751 HydrophobicContact CG1-CG2 4.45Å; I738-I751 HydrophobicContact CD1-CG2 4.3Å; F742-I751 HydrophobicContact CD1-CD1 3.65Å; F742-I751 HydrophobicContact CD2-CD1 3.91Å; F742-I751 HydrophobicContact CE1-CD1 3.36Å; F742-I751 HydrophobicContact CE2-CD1 3.62Å; F742-I751 HydrophobicContact CE2-CG2 4.37Å; F742-I751 HydrophobicContact CG-CD1 3.93Å; F742-I751 HydrophobicContact CZ-CD1 3.35Å; L747-I751 HydrophobicContact CD1-CD1 4.23Å; L747-I751 HydrophobicContact CD1-CG1 4.47Å; L747-I751 HydrophobicContact CG-CD1 3.93Å; L747-I751 VanDerWaalsContact O-CG1 3.28Å; L747-I751 WeakPolarHBondContact O-CG1 3.47Å; L747-I751 PolarHBondContact O-N 3.1Å; G748-I751 PolarHBondContact O-N 2.71Å; I751-Q753 PolarHBondContact O-N 2.85Å; I751-G754 PolarHBondContact O-N 2.87Å; I751-L755 WeakPolarHBondContact O-CB 3.36Å; I751-L755 PolarHBondContact O-N 3.45Å
752	F	88.1	Confident	85.4	Confident	1 Å²	1	39.5 Å²	39.5	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-43.9	176.3	-175.7	-115.3	0	0	0	111.5	I731 H735 I738 G748 T749 G754 L755 L756 C797 F801	I731-F752 HydrophobicContact CG2-CE2 4.08Å; I731-F752 HydrophobicContact CG2-CZ 3.82Å; H735-F752 HydrophobicContact CB-CD2 4.13Å; H735-F752 HydrophobicContact CB-CE2 3.61Å; H735-F752 HydrophobicContact CB-CZ 3.91Å; H735-F752 AromaticContact CD2-CE1 3.98Å; I738-F752 HydrophobicContact CD1-CB 4.25Å; I738-F752 HydrophobicContact CD1-CD2 4.02Å; G748-F752 WeakPolarHBondContact O-CB 3.47Å; G748-F752 PolarHBondContact O-N 2.85Å; T749-F752 PolarHBondContact O-N 3.35Å; F752-G754 VanDerWaalsContact C-N 3.33Å; F752-G754 PolarHBondContact O-N 2.85Å; F752-L755 WeakPolarHBondContact O-CB 3.33Å; F752-L755 PolarHBondContact O-N 2.88Å; F752-L756 HydrophobicContact CD1-CD1 3.94Å; F752-L756 HydrophobicContact CD1-CG 4.36Å; F752-L756 HydrophobicContact CE1-CD1 3.56Å; F752-L756 HydrophobicContact CE1-CD2 4.33Å; F752-L756 HydrophobicContact CE1-CG 4.1Å; F752-L756 HydrophobicContact CE2-CD2 4.13Å; F752-L756 HydrophobicContact CE2-CG 4.33Å; F752-L756 HydrophobicContact CZ-CD1 3.97Å; F752-L756 HydrophobicContact CZ-CD2 3.87Å; F752-L756 HydrophobicContact CZ-CG 4.09Å; F752-L756 VanDerWaalsContact O-CG 3.29Å; F752-L756 WeakPolarHBondContact O-CG 3.29Å; F752-L756 PolarHBondContact O-N 2.97Å; F752-C797 HydrophobicContact CE1-CB 4.18Å; F752-C797 HydrophobicContact CZ-CB 4.4Å; F752-F801 AromaticContact CE1-CD2 3.98Å; F752-F801 HydrophobicContact CE1-CD2 3.98Å
753	Q	87	Confident	85.5	Confident	58 Å²	58	39.5 Å²	39.5	27%	0.271	22%	0.223	S	C	.	.	H	α-helix	trans	-61.5	-40.3	174.5	-72.8	-178.5	28.1	0	0	112.6	T749 Q750 I751 L756 A757 K798 S802	T749-Q753 WeakPolarHBondContact O-CB 3.41Å; T749-Q753 VanDerWaalsContact O-CG 3.25Å; T749-Q753 WeakPolarHBondContact O-CG 3.39Å; T749-Q753 PolarHBondContact O-N 2.77Å; Q750-Q753 PolarHBondContact O-N 2.72Å; I751-Q753 PolarHBondContact O-N 2.85Å; Q753-L756 PolarHBondContact O-N 2.75Å; Q753-A757 PolarHBondContact O-N 3.24Å; Q753-K798 VanDerWaalsContact CD-CE 3.44Å; Q753-K798 HydrophobicContact CG-CD 4.12Å; Q753-K798 HydrophobicContact CG-CG 4.23Å; Q753-S802 PolarHBondContact NE2-OG 3.44Å
754	G	87.2	Confident	86.2	Confident	21 Å²	21	40.3 Å²	40.3	22%	0.216	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-44	173	0	0	0	0	0	112.4	Q750 I751 F752 L756 A757 Q758	Q750-G754 PolarHBondContact O-N 3.37Å; I751-G754 PolarHBondContact O-N 2.87Å; F752-G754 VanDerWaalsContact C-N 3.33Å; F752-G754 PolarHBondContact O-N 2.85Å; G754-L756 PolarHBondContact O-N 3.34Å; G754-A757 PolarHBondContact O-N 3.3Å; G754-Q758 PolarHBondContact O-N 3.07Å
755	L	90.6	Very high	86.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-44.9	176.7	-175.4	144	0	0	0	111.9	I669 A672 L673 I734 I738 I751 F752 A757 Q758 L759	I669-L755 HydrophobicContact CG1-CB 4.19Å; I669-L755 HydrophobicContact CG2-CB 3.98Å; I669-L755 HydrophobicContact CG2-CD1 4.31Å; I669-L755 HydrophobicContact CG2-CG 4.02Å; A672-L755 HydrophobicContact CB-CD1 3.93Å; L673-L755 HydrophobicContact CD2-CD1 4.19Å; L673-L755 HydrophobicContact CD2-CD2 3.81Å; L673-L755 HydrophobicContact CD2-CG 3.83Å; L673-L755 HydrophobicContact CG-CD1 4.3Å; L673-L755 HydrophobicContact CG-CG 4.14Å; I734-L755 HydrophobicContact CG2-CD1 3.48Å; I734-L755 VanDerWaalsContact CG2-CD1 3.48Å; I734-L755 HydrophobicContact CG2-CD2 3.97Å; I734-L755 HydrophobicContact CG2-CG 4.39Å; I738-L755 HydrophobicContact CD1-CD1 4.14Å; I751-L755 WeakPolarHBondContact O-CB 3.36Å; I751-L755 PolarHBondContact O-N 3.45Å; F752-L755 WeakPolarHBondContact O-CB 3.33Å; F752-L755 PolarHBondContact O-N 2.88Å; L755-A757 VanDerWaalsContact C-N 3.34Å; L755-A757 PolarHBondContact O-N 3.45Å; L755-Q758 PolarHBondContact O-N 3.26Å; L755-L759 WeakPolarHBondContact O-CB 3.49Å; L755-L759 PolarHBondContact O-N 3.36Å
756	L	87.3	Confident	86.7	Confident	8 Å²	8	37.1 Å²	37.1	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-44.9	176.5	-68.8	179.8	0	0	0	111.2	I731 F752 Q753 G754 Q758 L759 I760 M794	I731-L756 HydrophobicContact CD1-CD2 4.49Å; I731-L756 HydrophobicContact CG2-CD2 4.05Å; F752-L756 HydrophobicContact CD1-CD1 3.94Å; F752-L756 HydrophobicContact CD1-CG 4.36Å; F752-L756 HydrophobicContact CE1-CD1 3.56Å; F752-L756 HydrophobicContact CE1-CD2 4.33Å; F752-L756 HydrophobicContact CE1-CG 4.1Å; F752-L756 HydrophobicContact CE2-CD2 4.13Å; F752-L756 HydrophobicContact CE2-CG 4.33Å; F752-L756 HydrophobicContact CZ-CD1 3.97Å; F752-L756 HydrophobicContact CZ-CD2 3.87Å; F752-L756 HydrophobicContact CZ-CG 4.09Å; F752-L756 VanDerWaalsContact O-CG 3.29Å; F752-L756 WeakPolarHBondContact O-CG 3.29Å; F752-L756 PolarHBondContact O-N 2.97Å; Q753-L756 PolarHBondContact O-N 2.75Å; G754-L756 PolarHBondContact O-N 3.34Å; L756-Q758 PolarHBondContact O-N 2.91Å; L756-L759 PolarHBondContact O-N 3.07Å; L756-I760 VanDerWaalsContact O-CG1 3.26Å; L756-I760 WeakPolarHBondContact O-CG1 3.32Å; L756-I760 PolarHBondContact O-N 2.89Å; L756-M794 HydrophobicContact CB-CE 3.7Å; L756-M794 HydrophobicContact CD1-CB 4.38Å; L756-M794 HydrophobicContact CD2-CB 4.41Å; L756-M794 HydrophobicContact CD2-CE 3.26Å; L756-M794 HydrophobicContact CD2-CG 4.02Å; L756-M794 HydrophobicContact CD2-SD 4.44Å; L756-M794 HydrophobicContact CG-CE 4.03Å; L756-M794 VanDerWaalsContact O-CE 3.28Å; L756-M794 WeakPolarHBondContact O-CE 3.44Å
757	A	87.7	Confident	86.5	Confident	57 Å²	57	36 Å²	36	47%	0.471	18%	0.182	S	C	.	.	H	α-helix	trans	-61.7	-42.9	177.9	0	0	0	0	0	112.2	Q753 G754 L755 I760 Q761	Q753-A757 PolarHBondContact O-N 3.24Å; G754-A757 PolarHBondContact O-N 3.3Å; L755-A757 VanDerWaalsContact C-N 3.34Å; L755-A757 PolarHBondContact O-N 3.45Å; A757-I760 PolarHBondContact O-N 2.86Å; A757-Q761 PolarHBondContact O-N 3.3Å
758	Q	88	Confident	86.3	Confident	35 Å²	35	42.1 Å²	42.1	16%	0.164	21%	0.208	C	C	.	.	H	α-helix	trans	-68.7	-39.4	178.8	-172.1	163.6	3.9	0	0	112.3	I669 D670 L673 G754 L755 L756 I760 Q761 H762	I669-Q758 HydrophobicContact CG2-CB 4.02Å; I669-Q758 HydrophobicContact CG2-CG 4.31Å; D670-Q758 PolarHBondContact OD1-NE2 2.88Å; L673-Q758 HydrophobicContact CD1-CB 4.35Å; L673-Q758 HydrophobicContact CD1-CG 4.13Å; G754-Q758 PolarHBondContact O-N 3.07Å; L755-Q758 PolarHBondContact O-N 3.26Å; L756-Q758 PolarHBondContact O-N 2.91Å; Q758-I760 VanDerWaalsContact C-N 3.33Å; Q758-I760 PolarHBondContact O-N 3.27Å; Q758-Q761 WeakPolarHBondContact O-CB 3.21Å; Q758-Q761 PolarHBondContact O-N 2.77Å; Q758-Q761 VanDerWaalsContact O-N 3.17Å; Q758-H762 PolarHBondContact O-CD2 3.11Å; Q758-H762 PolarHBondContact O-N 3.48Å
759	L	86.3	Confident	86.1	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-42	173.2	177.7	58.4	0	0	0	111.5	L673 F677 I731 L755 L756 Q761 H762 Y763 M794	L673-L759 HydrophobicContact CD2-CB 4.17Å; L673-L759 HydrophobicContact CD2-CD1 4.38Å; F677-L759 HydrophobicContact CB-CD1 4.42Å; F677-L759 HydrophobicContact CD1-CD1 3.98Å; F677-L759 HydrophobicContact CD2-CD1 3.84Å; F677-L759 HydrophobicContact CD2-CD2 4.33Å; F677-L759 HydrophobicContact CE1-CD1 4.17Å; F677-L759 HydrophobicContact CE1-CD2 4.43Å; F677-L759 HydrophobicContact CE2-CD1 4.02Å; F677-L759 HydrophobicContact CE2-CD2 3.71Å; F677-L759 HydrophobicContact CG-CD1 3.81Å; F677-L759 HydrophobicContact CZ-CD1 4.18Å; F677-L759 HydrophobicContact CZ-CD2 3.77Å; I731-L759 HydrophobicContact CD1-CD2 4.02Å; I731-L759 HydrophobicContact CG1-CD2 4.11Å; L755-L759 WeakPolarHBondContact O-CB 3.49Å; L755-L759 PolarHBondContact O-N 3.36Å; L756-L759 PolarHBondContact O-N 3.07Å; L759-Q761 VanDerWaalsContact C-N 3.31Å; L759-Q761 PolarHBondContact O-N 2.81Å; L759-H762 PolarHBondContact O-N 3.3Å; L759-Y763 WeakPolarHBondContact O-CB 3.43Å; L759-Y763 PolarHBondContact O-N 3.16Å; L759-M794 HydrophobicContact CB-CE 4Å; L759-M794 HydrophobicContact CD2-CE 3.69Å; L759-M794 HydrophobicContact CG-CE 4Å
760	I	85.7	Confident	85.7	Confident	47 Å²	47	41.8 Å²	41.8	24%	0.241	21%	0.206	C	C	.	.	H	α-helix	trans	-59.8	-43.5	173.8	-68.7	165.7	0	0	0	110.5	L756 A757 Q758 Y763 H764 M794	L756-I760 VanDerWaalsContact O-CG1 3.26Å; L756-I760 WeakPolarHBondContact O-CG1 3.32Å; L756-I760 PolarHBondContact O-N 2.89Å; A757-I760 PolarHBondContact O-N 2.86Å; Q758-I760 VanDerWaalsContact C-N 3.33Å; Q758-I760 PolarHBondContact O-N 3.27Å; I760-Y763 PolarHBondContact O-N 3.33Å; I760-H764 VanDerWaalsContact O-CB 3.32Å; I760-H764 WeakPolarHBondContact O-CB 3.49Å; I760-H764 PolarHBondContact O-N 2.93Å; I760-M794 HydrophobicContact CD1-CE 4.36Å; I760-M794 HydrophobicContact CD1-SD 3.67Å; I760-M794 HydrophobicContact CG1-CE 3.95Å; I760-M794 HydrophobicContact CG1-SD 3.39Å; I760-M794 WeakPolarHBondContact CG1-SD 3.31Å
761	Q	87.1	Confident	85.1	Confident	118 Å²	118	39.1 Å²	39.1	55%	0.551	20%	0.198	S	C	*	.	H	α-helix	trans	-63.6	-44.6	179.2	-170.5	-179.3	8.6	0	0	112.1	A757 Q758 L759 H764 R765	A757-Q761 PolarHBondContact O-N 3.3Å; Q758-Q761 WeakPolarHBondContact O-CB 3.21Å; Q758-Q761 PolarHBondContact O-N 2.77Å; Q758-Q761 VanDerWaalsContact O-N 3.17Å; L759-Q761 VanDerWaalsContact C-N 3.31Å; L759-Q761 PolarHBondContact O-N 2.81Å; Q761-H764 PolarHBondContact O-N 3.17Å; Q761-R765 WeakPolarHBondContact O-CG 3.44Å; Q761-R765 PolarHBondContact O-N 3.44Å
762	H	86.1	Confident	84.5	Confident	17 Å²	17	42.8 Å²	42.8	8%	0.079	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-41.5	175.6	-76	-64.8	0	0	0	112.1	L680 I681 Q758 L759 R765 F766	L680-H762 HydrophobicContact CD2-CB 4.22Å; I681-H762 HydrophobicContact CG1-CB 4.4Å; Q758-H762 PolarHBondContact O-CD2 3.11Å; Q758-H762 PolarHBondContact O-N 3.48Å; L759-H762 PolarHBondContact O-N 3.3Å; H762-R765 PolarHBondContact O-N 3.32Å; H762-F766 WeakPolarHBondContact O-CB 3.45Å; H762-F766 PolarHBondContact O-N 3.08Å
763	Y	85	Confident	83.2	Confident	3 Å²	3	47.8 Å²	47.8	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-38.3	176.5	-169.1	-97.3	0	0	0	112.2	L680 F723 L759 I760 F766 Q767 V785 I790	L680-Y763 HydrophobicContact CD1-CD2 4.2Å; F723-Y763 AromaticContact CD1-CE2 3.91Å; F723-Y763 HydrophobicContact CD1-CE2 3.91Å; F723-Y763 AromaticContact CE1-CD2 3.93Å; F723-Y763 HydrophobicContact CE1-CD2 3.93Å; F723-Y763 AromaticContact CE1-CE2 3.45Å; F723-Y763 HydrophobicContact CE1-CE2 3.45Å; F723-Y763 VanDerWaalsContact CE1-CE2 3.45Å; F723-Y763 HydrophobicContact CE2-CD2 4.11Å; F723-Y763 HydrophobicContact CE2-CE2 4.37Å; F723-Y763 AromaticContact CZ-CD2 3.67Å; F723-Y763 HydrophobicContact CZ-CD2 3.67Å; F723-Y763 AromaticContact CZ-CE2 3.71Å; F723-Y763 HydrophobicContact CZ-CE2 3.71Å; L759-Y763 WeakPolarHBondContact O-CB 3.43Å; L759-Y763 PolarHBondContact O-N 3.16Å; I760-Y763 PolarHBondContact O-N 3.33Å; Y763-F766 HydrophobicContact CE2-CD1 4.37Å; Y763-F766 WeakPolarHBondContact O-CB 3.49Å; Y763-F766 PolarHBondContact O-N 3.19Å; Y763-Q767 WeakPolarHBondContact O-CB 3.39Å; Y763-Q767 PolarHBondContact O-N 3.12Å; Y763-V785 WeakPolarHBondContact CE1-O 3.32Å; Y763-V785 PolarHBondContact OH-N 2.69Å; Y763-V785 VanDerWaalsContact OH-N 3.08Å; Y763-V785 PolarHBondContact OH-O 3Å; Y763-I790 HydrophobicContact CD1-CD1 3.45Å; Y763-I790 VanDerWaalsContact CD1-CD1 3.45Å; Y763-I790 HydrophobicContact CD2-CD1 4.04Å; Y763-I790 HydrophobicContact CE1-CD1 3.22Å; Y763-I790 HydrophobicContact CE2-CD1 3.84Å; Y763-I790 HydrophobicContact CG-CD1 3.85Å; Y763-I790 VanDerWaalsContact CZ-CD1 3.43Å
764	H	85.2	Confident	82.1	Confident	104 Å²	104	48 Å²	48	48%	0.481	26%	0.256	S	S	.	.	H	α-helix	trans	-64.1	-42.2	175.1	-169.1	70.6	0	0	0	111.8	I760 Q761 Q767 K768 I787	I760-H764 VanDerWaalsContact O-CB 3.32Å; I760-H764 WeakPolarHBondContact O-CB 3.49Å; I760-H764 PolarHBondContact O-N 2.93Å; Q761-H764 PolarHBondContact O-N 3.17Å; H764-Q767 PolarHBondContact O-N 2.86Å; H764-K768 WeakPolarHBondContact O-CB 3.31Å; H764-K768 PolarHBondContact O-N 2.96Å; H764-I787 HydrophobicContact CB-CD1 3.98Å; H764-I787 VanDerWaalsContact ND1-CD1 3.33Å; H764-I787 WeakPolarHBondContact ND1-CD1 3.39Å
765	R	86.2	Confident	81.2	Confident	90 Å²	90	47.8 Å²	47.8	34%	0.34	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-43.4	172.7	-70.7	168.7	73.6	171.8	10.9	111.3	V684 E688 Q761 H762 Q767 K768 V769	V684-R765 HydrophobicContact CG1-CB 3.68Å; E688-R765 IonicContact OE1-CZ 3.72Å; E688-R765 IonicContact OE1-NE 3.72Å; E688-R765 PolarHBondContact OE1-NE 2.96Å; E688-R765 IonicContact OE1-NH2 3.68Å; E688-R765 PolarHBondContact OE1-NH2 3.34Å; E688-R765 IonicContact OE2-CZ 3.9Å; E688-R765 IonicContact OE2-NE 2.64Å; E688-R765 PolarHBondContact OE2-NE 3.47Å; E688-R765 IonicContact OE2-NH2 3.77Å; E688-R765 PolarHBondContact OE2-NH2 3.02Å; Q761-R765 WeakPolarHBondContact O-CG 3.44Å; Q761-R765 PolarHBondContact O-N 3.44Å; H762-R765 PolarHBondContact O-N 3.32Å; R765-Q767 PolarHBondContact O-N 3.33Å; R765-K768 PolarHBondContact O-N 3.03Å; R765-V769 WeakPolarHBondContact O-CG2 3.21Å; R765-V769 PolarHBondContact O-N 3.49Å
766	F	84.7	Confident	79.8	Confident	3 Å²	3	53.7 Å²	53.7	1%	0.013	27%	0.274	C	S	.	.	H	α-helix	trans	-58.1	-47.3	174.1	-178.5	-110.2	0	0	0	111.9	L680 F683 V684 I719 V720 H762 Y763 K768 V769 M770 L784	L680-F766 HydrophobicContact CD1-CD1 4.25Å; L680-F766 HydrophobicContact CD1-CG 4.26Å; L680-F766 HydrophobicContact CD2-CB 4.16Å; L680-F766 HydrophobicContact CG-CB 4.37Å; L680-F766 HydrophobicContact CG-CD2 4.26Å; L680-F766 HydrophobicContact CG-CG 4.19Å; F683-F766 AromaticContact CD1-CD2 3.63Å; F683-F766 HydrophobicContact CD1-CD2 3.63Å; F683-F766 AromaticContact CD1-CE2 3.47Å; F683-F766 HydrophobicContact CD1-CE2 3.47Å; F683-F766 VanDerWaalsContact CD1-CE2 3.47Å; F683-F766 AromaticContact CE1-CD2 3.83Å; F683-F766 HydrophobicContact CE1-CD2 3.83Å; F683-F766 AromaticContact CE1-CE2 3.52Å; F683-F766 HydrophobicContact CE1-CE2 3.52Å; F683-F766 HydrophobicContact CG-CE2 4.42Å; V684-F766 HydrophobicContact CG2-CB 3.6Å; V684-F766 HydrophobicContact CG2-CD2 3.88Å; V684-F766 HydrophobicContact CG2-CG 4.24Å; I719-F766 HydrophobicContact CG2-CE2 4.14Å; I719-F766 HydrophobicContact CG2-CZ 4Å; V720-F766 HydrophobicContact CG2-CE1 3.99Å; V720-F766 HydrophobicContact CG2-CZ 3.81Å; H762-F766 WeakPolarHBondContact O-CB 3.45Å; H762-F766 PolarHBondContact O-N 3.08Å; Y763-F766 HydrophobicContact CE2-CD1 4.37Å; Y763-F766 WeakPolarHBondContact O-CB 3.49Å; Y763-F766 PolarHBondContact O-N 3.19Å; F766-K768 VanDerWaalsContact C-N 3.31Å; F766-K768 PolarHBondContact O-N 3.42Å; F766-V769 PolarHBondContact O-N 2.88Å; F766-M770 HydrophobicContact CD1-CG 4.41Å; F766-M770 HydrophobicContact CE1-CG 4.13Å; F766-M770 HydrophobicContact CE2-CG 4.35Å; F766-M770 HydrophobicContact CE2-SD 4.41Å; F766-M770 HydrophobicContact CZ-CG 4.09Å; F766-M770 HydrophobicContact CZ-SD 4.2Å; F766-M770 VanDerWaalsContact O-CG 3.28Å; F766-M770 WeakPolarHBondContact O-CG 3.35Å; F766-M770 PolarHBondContact O-N 3.42Å; F766-L784 HydrophobicContact CD1-CD2 4.08Å; F766-L784 HydrophobicContact CE1-CD2 3.53Å
767	Q	80.8	Confident	78.7	Confident	60 Å²	60	60.2 Å²	60.2	28%	0.28	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-37.4	177	-167	178.1	0.3	0	0	112.2	Y763 H764 R765 M770 T771	Y763-Q767 WeakPolarHBondContact O-CB 3.39Å; Y763-Q767 PolarHBondContact O-N 3.12Å; H764-Q767 PolarHBondContact O-N 2.86Å; R765-Q767 PolarHBondContact O-N 3.33Å; Q767-M770 PolarHBondContact O-N 3.34Å; Q767-T771 PolarHBondContact O-N 3.07Å
768	K	82.7	Confident	77.8	Confident	132 Å²	132	58.2 Å²	58.2	57%	0.574	29%	0.291	S	S	*	.	H	α-helix	trans	-69.4	-33.3	175.2	-174	-179.8	178.8	-177.9	0	112.9	H764 R765 F766 T771 Q772	H764-K768 WeakPolarHBondContact O-CB 3.31Å; H764-K768 PolarHBondContact O-N 2.96Å; R765-K768 PolarHBondContact O-N 3.03Å; F766-K768 VanDerWaalsContact C-N 3.31Å; F766-K768 PolarHBondContact O-N 3.42Å; K768-T771 PolarHBondContact O-OG1 3.17Å; K768-Q772 PolarHBondContact O-NE2 3.32Å; K768-Q772 VanDerWaalsContact O-NE2 3.12Å
769	V	81	Confident	76.7	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.018	32%	0.317	C	S	.	.	H	α-helix	trans	-67.5	-41.9	171.6	167.5	0	0	0	0	109.9	F683 V687 E688 R765 F766 T771 Q772 Y775	F683-V769 HydrophobicContact CE1-CG1 3.97Å; F683-V769 HydrophobicContact CZ-CG1 4.45Å; V687-V769 HydrophobicContact CB-CG1 3.91Å; V687-V769 HydrophobicContact CG1-CG1 3.44Å; V687-V769 VanDerWaalsContact CG1-CG1 3.44Å; V687-V769 HydrophobicContact CG1-CG2 4.31Å; V687-V769 HydrophobicContact CG2-CG1 4.19Å; E688-V769 HydrophobicContact CG-CG2 4.25Å; R765-V769 WeakPolarHBondContact O-CG2 3.21Å; R765-V769 PolarHBondContact O-N 3.49Å; F766-V769 PolarHBondContact O-N 2.88Å; V769-T771 PolarHBondContact O-N 2.77Å; V769-T771 VanDerWaalsContact O-N 3.16Å; V769-Q772 PolarHBondContact O-N 3.22Å; V769-Q772 VanDerWaalsContact O-N 3.07Å; V769-Y775 HydrophobicContact CG1-CD2 4.14Å; V769-Y775 HydrophobicContact CG1-CE2 4.15Å
770	M	76.9	Confident	75.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-15.4	178.5	-70.1	-60.1	-62.3	0	0	114.4	V716 F766 Q767 I780 L784	V716-M770 HydrophobicContact CG1-CE 3.67Å; V716-M770 HydrophobicContact CG1-SD 3.65Å; F766-M770 HydrophobicContact CD1-CG 4.41Å; F766-M770 HydrophobicContact CE1-CG 4.13Å; F766-M770 HydrophobicContact CE2-CG 4.35Å; F766-M770 HydrophobicContact CE2-SD 4.41Å; F766-M770 HydrophobicContact CZ-CG 4.09Å; F766-M770 HydrophobicContact CZ-SD 4.2Å; F766-M770 VanDerWaalsContact O-CG 3.28Å; F766-M770 WeakPolarHBondContact O-CG 3.35Å; F766-M770 PolarHBondContact O-N 3.42Å; Q767-M770 PolarHBondContact O-N 3.34Å; M770-I780 HydrophobicContact CE-CG2 4.07Å; M770-L784 HydrophobicContact CB-CD1 4.07Å; M770-L784 HydrophobicContact CG-CD1 4.24Å; M770-L784 HydrophobicContact CG-CD2 4.5Å
771	T	75.9	Confident	74.6	Confident	61 Å²	61	65.4 Å²	65.4	37%	0.374	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-10.5	174.1	55.1	0	0	0	0	114	Q767 K768 V769	Q767-T771 PolarHBondContact O-N 3.07Å; K768-T771 PolarHBondContact O-OG1 3.17Å; V769-T771 PolarHBondContact O-N 2.77Å; V769-T771 VanDerWaalsContact O-N 3.16Å
772	Q	74.7	Confident	73.6	Confident	77 Å²	77	67 Å²	67	36%	0.36	34%	0.341	S	S	.	.	S	Bend	trans	-88	154.8	179.7	-65.3	172.1	46.8	0	0	111.5	K768 V769 Y775 K776	K768-Q772 PolarHBondContact O-NE2 3.32Å; K768-Q772 VanDerWaalsContact O-NE2 3.12Å; V769-Q772 PolarHBondContact O-N 3.22Å; V769-Q772 VanDerWaalsContact O-N 3.07Å; Q772-Y775 PolarHBondContact O-N 2.76Å; Q772-K776 PolarHBondContact O-N 3.37Å
773	S	62.1	Low	72.9	Confident	105 Å²	105	70.8 Å²	70.8	73%	0.734	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	139.4	169.3	-169.9	0	0	0	0	109.1
774	P	62.5	Low	72.4	Confident	62 Å²	62	72 Å²	72	40%	0.403	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89	-2.8	6.7	33	-33.6	0	0	0	115.7	K776	P774-K776 VanDerWaalsContact C-N 3.33Å; P774-K776 PolarHBondContact O-N 3.47Å
775	Y	68.6	Low	71.8	Confident	17 Å²	17	67.5 Å²	67.5	7%	0.067	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-72.6	-21.8	-173.6	-50.7	-68.5	0	0	0	114.8	F683 V687 E712 V716 V769 Q772 N777 M778	F683-Y775 HydrophobicContact CZ-CE1 4.23Å; V687-Y775 HydrophobicContact CG1-CE2 3.87Å; V687-Y775 HydrophobicContact CG2-CE2 4.38Å; E712-Y775 HydrophobicContact CG-CE1 3.6Å; E712-Y775 WeakPolarHBondContact CG-OH 3.17Å; V716-Y775 HydrophobicContact CG2-CD1 4.17Å; V716-Y775 HydrophobicContact CG2-CE1 4.16Å; V769-Y775 HydrophobicContact CG1-CD2 4.14Å; V769-Y775 HydrophobicContact CG1-CE2 4.15Å; Q772-Y775 PolarHBondContact O-N 2.76Å; Y775-N777 PolarHBondContact O-N 2.97Å; Y775-M778 HydrophobicContact CD1-CE 3.91Å; Y775-M778 HydrophobicContact CD1-SD 4.34Å; Y775-M778 PolarHBondContact O-N 3.32Å; Y775-M778 VanDerWaalsContact O-N 3.09Å
776	K	61.6	Low	71.2	Confident	124 Å²	124	67.5 Å²	67.5	54%	0.539	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-52.4	-31.9	-177.3	-172.4	178.5	177.5	-176.5	0	114	Q772 P774	Q772-K776 PolarHBondContact O-N 3.37Å; P774-K776 VanDerWaalsContact C-N 3.33Å; P774-K776 PolarHBondContact O-N 3.47Å
777	N	63.8	Low	70.5	Confident	146 Å²	146	68.8 Å²	68.8	78%	0.781	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-92.5	1.1	-174.7	-65.3	-10.7	0	0	0	114	Y775	Y775-N777 PolarHBondContact O-N 2.97Å
778	M	68.3	Low	70	Confident	15 Å²	15	71.9 Å²	71.9	7%	0.074	37%	0.373	C	S	.	.			trans	-79.1	132.7	-175.5	-66.2	-167.8	-173.7	0	0	113	E713 Y775 I780 R781	E713-M778 HydrophobicContact CB-CE 4.19Å; E713-M778 HydrophobicContact CB-SD 4.42Å; E713-M778 HydrophobicContact CG-CE 3.05Å; E713-M778 HydrophobicContact CG-CG 4.48Å; E713-M778 HydrophobicContact CG-SD 3.61Å; Y775-M778 HydrophobicContact CD1-CE 3.91Å; Y775-M778 HydrophobicContact CD1-SD 4.34Å; Y775-M778 PolarHBondContact O-N 3.32Å; Y775-M778 VanDerWaalsContact O-N 3.09Å; M778-I780 HydrophobicContact CB-CG2 4.28Å; M778-I780 PolarHBondContact O-N 3.24Å; M778-I780 VanDerWaalsContact O-N 3.16Å; M778-R781 WeakPolarHBondContact O-CB 3.35Å; M778-R781 PolarHBondContact O-N 3.39Å
779	P	65.2	Low	69.6	Low	111 Å²	111	70.5 Å²	70.5	72%	0.721	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-59.2	-29.1	178.6	-22.9	31.4	0	0	0	114.1	R781 N782	P779-R781 PolarHBondContact O-N 3.48Å; P779-R781 VanDerWaalsContact O-N 3.11Å; P779-N782 PolarHBondContact O-N 3Å; P779-N782 VanDerWaalsContact O-N 3.17Å
780	I	65.8	Low	69.3	Low	15 Å²	15	70.5 Å²	70.5	8%	0.077	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-63.6	-18.2	-177.3	-150.4	77.1	0	0	0	112.7	V716 T717 V720 M770 M778 N782 Q783	V716-I780 HydrophobicContact CG1-CG2 3.87Å; T717-I780 HydrophobicContact CG2-CD1 3.89Å; V720-I780 HydrophobicContact CB-CG1 4.01Å; V720-I780 HydrophobicContact CG1-CG1 4.03Å; V720-I780 HydrophobicContact CG2-CG1 4.42Å; V720-I780 HydrophobicContact CG2-CG2 4.49Å; M770-I780 HydrophobicContact CE-CG2 4.07Å; M778-I780 HydrophobicContact CB-CG2 4.28Å; M778-I780 PolarHBondContact O-N 3.24Å; M778-I780 VanDerWaalsContact O-N 3.16Å; I780-N782 PolarHBondContact O-N 3.38Å; I780-Q783 WeakPolarHBondContact O-CB 3.28Å; I780-Q783 PolarHBondContact O-N 3.12Å
781	R	63.5	Low	69.2	Low	110 Å²	110	72.3 Å²	72.3	42%	0.415	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-57.8	-33	175	-170.6	-172.9	170.9	-150.2	-6.2	112	M778 P779 Q783 L784	M778-R781 WeakPolarHBondContact O-CB 3.35Å; M778-R781 PolarHBondContact O-N 3.39Å; P779-R781 PolarHBondContact O-N 3.48Å; P779-R781 VanDerWaalsContact O-N 3.11Å; R781-Q783 PolarHBondContact O-N 2.98Å; R781-L784 HydrophobicContact CB-CD1 4.25Å; R781-L784 HydrophobicContact CG-CD1 3.66Å; R781-L784 WeakPolarHBondContact O-CB 3.46Å; R781-L784 WeakPolarHBondContact O-CD1 3.49Å; R781-L784 WeakPolarHBondContact O-CG 3.31Å; R781-L784 PolarHBondContact O-N 3.09Å; R781-L784 VanDerWaalsContact O-N 3.17Å
782	N	65.6	Low	69.2	Low	152 Å²	152	73.8 Å²	73.8	81%	0.813	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-69.3	-14.2	177.5	-67	-12.7	0	0	0	113	P779 I780	P779-N782 PolarHBondContact O-N 3Å; P779-N782 VanDerWaalsContact O-N 3.17Å; I780-N782 PolarHBondContact O-N 3.38Å
783	Q	71.2	Confident	69.1	Low	96 Å²	96	72.3 Å²	72.3	45%	0.449	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-97	1.6	176.1	-59.5	-178.8	5.8	0	0	112.6	V720 N724 I780 R781 V785	V720-Q783 HydrophobicContact CG1-CB 4.23Å; N724-Q783 PolarHBondContact ND2-O 2.97Å; N724-Q783 PolarHBondContact OD1-O 3.07Å; I780-Q783 WeakPolarHBondContact O-CB 3.28Å; I780-Q783 PolarHBondContact O-N 3.12Å; R781-Q783 PolarHBondContact O-N 2.98Å; Q783-V785 PolarHBondContact O-N 3.09Å
784	L	75	Confident	69.4	Low	29 Å²	29	67.6 Å²	67.6	15%	0.152	34%	0.344	C	S	.	.	S	Bend	trans	-65.1	128	175	-73.3	160.8	0	0	0	109.6	V720 F766 M770 R781 N786	V720-L784 HydrophobicContact CG2-CD2 4.11Å; F766-L784 HydrophobicContact CD1-CD2 4.08Å; F766-L784 HydrophobicContact CE1-CD2 3.53Å; M770-L784 HydrophobicContact CB-CD1 4.07Å; M770-L784 HydrophobicContact CG-CD1 4.24Å; M770-L784 HydrophobicContact CG-CD2 4.5Å; R781-L784 HydrophobicContact CB-CD1 4.25Å; R781-L784 HydrophobicContact CG-CD1 3.66Å; R781-L784 WeakPolarHBondContact O-CB 3.46Å; R781-L784 WeakPolarHBondContact O-CD1 3.49Å; R781-L784 WeakPolarHBondContact O-CG 3.31Å; R781-L784 PolarHBondContact O-N 3.09Å; R781-L784 VanDerWaalsContact O-N 3.17Å; L784-N786 PolarHBondContact O-N 3.13Å
785	V	72.1	Confident	69.8	Low	10 Å²	10	70.8 Å²	70.8	6%	0.061	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-58.5	132.5	172.6	-172	0	0	0	0	108.6	F723 N724 Y763 Q783 I787 Q789 I790	F723-V785 HydrophobicContact CD1-CG2 4.17Å; F723-V785 HydrophobicContact CE1-CB 4.43Å; F723-V785 HydrophobicContact CE1-CG2 4Å; N724-V785 WeakPolarHBondContact OD1-CG2 3.47Å; Y763-V785 WeakPolarHBondContact CE1-O 3.32Å; Y763-V785 PolarHBondContact OH-N 2.69Å; Y763-V785 VanDerWaalsContact OH-N 3.08Å; Y763-V785 PolarHBondContact OH-O 3Å; Q783-V785 PolarHBondContact O-N 3.09Å; V785-I787 PolarHBondContact O-N 3.43Å; V785-Q789 HydrophobicContact CG1-CB 4.16Å; V785-Q789 HydrophobicContact CG1-CG 4.4Å; V785-I790 HydrophobicContact CB-CD1 3.95Å; V785-I790 HydrophobicContact CB-CG1 4.16Å; V785-I790 HydrophobicContact CG1-CD1 4.01Å; V785-I790 HydrophobicContact CG1-CG1 3.65Å
786	N	73	Confident	69.9	Low	89 Å²	89	75.4 Å²	75.4	48%	0.476	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-62	130.7	176.4	-169.9	-18.6	0	0	0	109.4	L784 H788 Q789 I790	L784-N786 PolarHBondContact O-N 3.13Å; N786-H788 PolarHBondContact O-N 3.29Å; N786-H788 VanDerWaalsContact O-N 3.12Å; N786-H788 PolarHBondContact OD1-CD2 3.4Å; N786-H788 PolarHBondContact OD1-N 3.47Å; N786-Q789 HydrophobicContact CB-CB 4.38Å; N786-Q789 WeakPolarHBondContact O-CA 3.23Å; N786-Q789 WeakPolarHBondContact O-CB 3.27Å; N786-Q789 PolarHBondContact O-N 3.42Å; N786-I790 PolarHBondContact O-N 2.85Å
787	I	69.7	Low	70	Confident	30 Å²	30	70.7 Å²	70.7	15%	0.154	35%	0.354	C	S	.	.	H	α-helix	trans	-56.1	-31.6	179.2	-162.9	158.4	0	0	0	112.2	H764 V785 Q789 I790 T791	H764-I787 HydrophobicContact CB-CD1 3.98Å; H764-I787 VanDerWaalsContact ND1-CD1 3.33Å; H764-I787 WeakPolarHBondContact ND1-CD1 3.39Å; V785-I787 PolarHBondContact O-N 3.43Å; I787-Q789 VanDerWaalsContact C-N 3.34Å; I787-I790 PolarHBondContact O-N 3.28Å; I787-T791 VanDerWaalsContact O-CB 3.31Å; I787-T791 WeakPolarHBondContact O-CB 2.89Å; I787-T791 PolarHBondContact O-N 2.89Å; I787-T791 PolarHBondContact O-OG1 3.24Å
788	H	70.6	Confident	69.9	Low	126 Å²	126	68.2 Å²	68.2	58%	0.583	34%	0.337	S	S	*	.	H	α-helix	trans	-66	-34.9	174.4	-69.2	-68.6	0	0	0	112.6	N786 N792	N786-H788 PolarHBondContact O-N 3.29Å; N786-H788 VanDerWaalsContact O-N 3.12Å; N786-H788 PolarHBondContact OD1-CD2 3.4Å; N786-H788 PolarHBondContact OD1-N 3.47Å; H788-N792 WeakPolarHBondContact O-CB 3.32Å; H788-N792 VanDerWaalsContact O-CG 3.26Å; H788-N792 PolarHBondContact O-N 3.17Å
789	Q	74.2	Confident	69.5	Low	102 Å²	102	72.1 Å²	72.1	48%	0.477	36%	0.362	S	S	.	.	H	α-helix	trans	-70	-43.8	177.1	-171.7	177.8	6.7	0	0	110.7	V785 N786 I787 N792 E793	V785-Q789 HydrophobicContact CG1-CB 4.16Å; V785-Q789 HydrophobicContact CG1-CG 4.4Å; N786-Q789 HydrophobicContact CB-CB 4.38Å; N786-Q789 WeakPolarHBondContact O-CA 3.23Å; N786-Q789 WeakPolarHBondContact O-CB 3.27Å; N786-Q789 PolarHBondContact O-N 3.42Å; I787-Q789 VanDerWaalsContact C-N 3.34Å; Q789-N792 PolarHBondContact O-N 3.44Å; Q789-E793 WeakPolarHBondContact O-CB 3.43Å; Q789-E793 VanDerWaalsContact O-CG 3.27Å; Q789-E793 WeakPolarHBondContact O-CG 3.2Å; Q789-E793 PolarHBondContact O-N 3.48Å
790	I	75.3	Confident	69.3	Low	4 Å²	4	72.5 Å²	72.5	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-59.9	-50.9	173.3	-67.9	165.4	0	0	0	109.7	F723 W727 Y763 V785 N786 I787 N792 E793 M794	F723-I790 HydrophobicContact CE1-CD1 3.92Å; F723-I790 HydrophobicContact CZ-CD1 3.97Å; W727-I790 HydrophobicContact CH2-CG1 4.35Å; Y763-I790 HydrophobicContact CD1-CD1 3.45Å; Y763-I790 VanDerWaalsContact CD1-CD1 3.45Å; Y763-I790 HydrophobicContact CD2-CD1 4.04Å; Y763-I790 HydrophobicContact CE1-CD1 3.22Å; Y763-I790 HydrophobicContact CE2-CD1 3.84Å; Y763-I790 HydrophobicContact CG-CD1 3.85Å; Y763-I790 VanDerWaalsContact CZ-CD1 3.43Å; V785-I790 HydrophobicContact CB-CD1 3.95Å; V785-I790 HydrophobicContact CB-CG1 4.16Å; V785-I790 HydrophobicContact CG1-CD1 4.01Å; V785-I790 HydrophobicContact CG1-CG1 3.65Å; N786-I790 PolarHBondContact O-N 2.85Å; I787-I790 PolarHBondContact O-N 3.28Å; I790-N792 VanDerWaalsContact C-N 3.34Å; I790-N792 PolarHBondContact O-N 3.09Å; I790-E793 PolarHBondContact O-N 3.46Å; I790-M794 HydrophobicContact CG2-CG 4.21Å; I790-M794 HydrophobicContact CG2-SD 3.32Å; I790-M794 WeakPolarHBondContact CG2-SD 3.37Å; I790-M794 VanDerWaalsContact O-CB 3.32Å; I790-M794 WeakPolarHBondContact O-CB 3.45Å; I790-M794 WeakPolarHBondContact O-CG 3.37Å; I790-M794 PolarHBondContact O-N 2.96Å
791	T	75	Confident	68.8	Low	37 Å²	37	74.6 Å²	74.6	23%	0.227	37%	0.366	C	S	.	.	H	α-helix	trans	-62.4	-39.2	-178.8	-52.4	0	0	0	0	112.1	I787 K795	I787-T791 VanDerWaalsContact O-CB 3.31Å; I787-T791 WeakPolarHBondContact O-CB 2.89Å; I787-T791 PolarHBondContact O-N 2.89Å; I787-T791 PolarHBondContact O-OG1 3.24Å; T791-K795 WeakPolarHBondContact O-CB 3.18Å; T791-K795 WeakPolarHBondContact O-CG 3.4Å; T791-K795 PolarHBondContact O-N 3.35Å
792	N	75.5	Confident	68	Low	92 Å²	92	74.3 Å²	74.3	49%	0.492	38%	0.381	S	S	.	.	H	α-helix	trans	-69.3	-44	177.8	-82.1	-0.5	0	0	0	112.3	H788 Q789 I790 M794 K795 K796	H788-N792 WeakPolarHBondContact O-CB 3.32Å; H788-N792 VanDerWaalsContact O-CG 3.26Å; H788-N792 PolarHBondContact O-N 3.17Å; Q789-N792 PolarHBondContact O-N 3.44Å; I790-N792 VanDerWaalsContact C-N 3.34Å; I790-N792 PolarHBondContact O-N 3.09Å; N792-M794 VanDerWaalsContact C-N 3.34Å; N792-K795 PolarHBondContact O-N 2.76Å; N792-K796 WeakPolarHBondContact O-CG 3.14Å; N792-K796 PolarHBondContact O-N 2.95Å
793	E	71.7	Confident	68.2	Low	46 Å²	46	70.4 Å²	70.4	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-66.1	-39	176.3	-67.7	-73.3	110	0	0	110.8	W727 K728 Q789 I790 K795 K796 C797	W727-E793 HydrophobicContact CH2-CB 3.82Å; W727-E793 HydrophobicContact CH2-CG 4.09Å; W727-E793 HydrophobicContact CZ3-CB 4.44Å; K728-E793 IonicContact NZ-OE2 3.38Å; K728-E793 PolarHBondContact NZ-OE2 2.96Å; Q789-E793 WeakPolarHBondContact O-CB 3.43Å; Q789-E793 VanDerWaalsContact O-CG 3.27Å; Q789-E793 WeakPolarHBondContact O-CG 3.2Å; Q789-E793 PolarHBondContact O-N 3.48Å; I790-E793 PolarHBondContact O-N 3.46Å; E793-K795 VanDerWaalsContact C-N 3.35Å; E793-K795 PolarHBondContact O-N 2.94Å; E793-K796 WeakPolarHBondContact O-CB 3.46Å; E793-K796 PolarHBondContact O-N 3.36Å; E793-K796 VanDerWaalsContact O-N 3.15Å; E793-K796 IonicContact OE1-NZ 2.76Å; E793-K796 PolarHBondContact OE1-NZ 2.86Å; E793-C797 PolarHBondContact O-N 3.15Å; E793-C797 PolarHBondContact O-SG 3.41Å
794	M	69.6	Low	68	Low	7 Å²	7	69.1 Å²	69.1	3%	0.034	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-34.1	174.3	-67.5	172.8	110.9	0	0	112.5	I731 L756 L759 I760 I790 N792 C797 K798	I731-M794 HydrophobicContact CD1-CE 4.25Å; I731-M794 HydrophobicContact CD1-CG 4.4Å; L756-M794 HydrophobicContact CB-CE 3.7Å; L756-M794 HydrophobicContact CD1-CB 4.38Å; L756-M794 HydrophobicContact CD2-CB 4.41Å; L756-M794 HydrophobicContact CD2-CE 3.26Å; L756-M794 HydrophobicContact CD2-CG 4.02Å; L756-M794 HydrophobicContact CD2-SD 4.44Å; L756-M794 HydrophobicContact CG-CE 4.03Å; L756-M794 VanDerWaalsContact O-CE 3.28Å; L756-M794 WeakPolarHBondContact O-CE 3.44Å; L759-M794 HydrophobicContact CB-CE 4Å; L759-M794 HydrophobicContact CD2-CE 3.69Å; L759-M794 HydrophobicContact CG-CE 4Å; I760-M794 HydrophobicContact CD1-CE 4.36Å; I760-M794 HydrophobicContact CD1-SD 3.67Å; I760-M794 HydrophobicContact CG1-CE 3.95Å; I760-M794 HydrophobicContact CG1-SD 3.39Å; I760-M794 WeakPolarHBondContact CG1-SD 3.31Å; I790-M794 HydrophobicContact CG2-CG 4.21Å; I790-M794 HydrophobicContact CG2-SD 3.32Å; I790-M794 WeakPolarHBondContact CG2-SD 3.37Å; I790-M794 VanDerWaalsContact O-CB 3.32Å; I790-M794 WeakPolarHBondContact O-CB 3.45Å; I790-M794 WeakPolarHBondContact O-CG 3.37Å; I790-M794 PolarHBondContact O-N 2.96Å; N792-M794 VanDerWaalsContact C-N 3.34Å; M794-C797 PolarHBondContact O-N 3.14Å; M794-K798 WeakPolarHBondContact O-CB 3.29Å; M794-K798 PolarHBondContact O-N 3.41Å
795	K	69.7	Low	67.6	Low	129 Å²	129	71.3 Å²	71.3	56%	0.561	37%	0.366	S	S	*	.	H	α-helix	trans	-64.6	-39.5	169.6	-82.2	-179.2	179.1	-177.8	0	111.8	T791 N792 E793 K798 T799	T791-K795 WeakPolarHBondContact O-CB 3.18Å; T791-K795 WeakPolarHBondContact O-CG 3.4Å; T791-K795 PolarHBondContact O-N 3.35Å; N792-K795 PolarHBondContact O-N 2.76Å; E793-K795 VanDerWaalsContact C-N 3.35Å; E793-K795 PolarHBondContact O-N 2.94Å; K795-K798 WeakPolarHBondContact O-CB 3.45Å; K795-K798 PolarHBondContact O-N 3.33Å; K795-T799 PolarHBondContact O-N 2.95Å; K795-T799 PolarHBondContact O-OG1 3.16Å
796	K	71.4	Confident	67.3	Low	113 Å²	113	74.9 Å²	74.9	49%	0.491	38%	0.384	S	S	.	.	H	α-helix	trans	-64	-42.7	173.4	-71.1	177.2	-174.3	169.8	0	111.7	N792 E793 K798 T799 N800	N792-K796 WeakPolarHBondContact O-CG 3.14Å; N792-K796 PolarHBondContact O-N 2.95Å; E793-K796 WeakPolarHBondContact O-CB 3.46Å; E793-K796 PolarHBondContact O-N 3.36Å; E793-K796 VanDerWaalsContact O-N 3.15Å; E793-K796 IonicContact OE1-NZ 2.76Å; E793-K796 PolarHBondContact OE1-NZ 2.86Å; K796-K798 VanDerWaalsContact C-N 3.3Å; K796-K798 PolarHBondContact O-N 3.1Å; K796-T799 WeakPolarHBondContact CA-OG1 3.49Å; K796-T799 PolarHBondContact O-N 3.11Å; K796-T799 PolarHBondContact O-OG1 3.07Å; K796-N800 WeakPolarHBondContact O-CB 3.44Å; K796-N800 PolarHBondContact O-N 2.83Å; K796-N800 PolarHBondContact O-ND2 3.17Å; K796-N800 PolarHBondContact O-OD1 3.24Å
797	C	64.2	Low	67	Low	25 Å²	25	74 Å²	74	17%	0.169	38%	0.378	C	S	.	.	H	α-helix	trans	-58.2	-46.1	171.6	-63.8	0	0	0	0	110.1	F752 E793 M794 T799 N800 F801	F752-C797 HydrophobicContact CE1-CB 4.18Å; F752-C797 HydrophobicContact CZ-CB 4.4Å; E793-C797 PolarHBondContact O-N 3.15Å; E793-C797 PolarHBondContact O-SG 3.41Å; M794-C797 PolarHBondContact O-N 3.14Å; C797-T799 VanDerWaalsContact C-N 3.31Å; C797-T799 PolarHBondContact O-N 3.48Å; C797-N800 PolarHBondContact O-N 2.77Å; C797-F801 HydrophobicContact CB-CD2 3.89Å; C797-F801 HydrophobicContact CB-CE2 3.81Å; C797-F801 WeakPolarHBondContact O-CB 3.49Å; C797-F801 WeakPolarHBondContact O-CD2 3.37Å; C797-F801 WeakPolarHBondContact O-CG 3.47Å; C797-F801 PolarHBondContact O-N 3.21Å
798	K	62.3	Low	66.8	Low	95 Å²	95	76.9 Å²	76.9	41%	0.413	39%	0.393	S	S	.	.	H	α-helix	trans	-58.4	-38.1	176.8	-175.8	170.5	171.3	154.8	0	113.2	Q753 M794 K795 K796 S802	Q753-K798 VanDerWaalsContact CD-CE 3.44Å; Q753-K798 HydrophobicContact CG-CD 4.12Å; Q753-K798 HydrophobicContact CG-CG 4.23Å; M794-K798 WeakPolarHBondContact O-CB 3.29Å; M794-K798 PolarHBondContact O-N 3.41Å; K795-K798 WeakPolarHBondContact O-CB 3.45Å; K795-K798 PolarHBondContact O-N 3.33Å; K796-K798 VanDerWaalsContact C-N 3.3Å; K796-K798 PolarHBondContact O-N 3.1Å; K798-S802 VanDerWaalsContact O-CB 3.28Å; K798-S802 WeakPolarHBondContact O-CB 3.27Å; K798-S802 PolarHBondContact O-N 3.11Å; K798-S802 VanDerWaalsContact O-N 3.13Å; K798-S802 PolarHBondContact O-OG 3.16Å
799	T	59.2	Low	66.5	Low	97 Å²	97	73.4 Å²	73.4	60%	0.595	38%	0.379	S	S	*	.	H	α-helix	trans	-79.9	-28.3	177.3	52.2	0	0	0	0	114.1	K795 K796 C797 F801	K795-T799 PolarHBondContact O-N 2.95Å; K795-T799 PolarHBondContact O-OG1 3.16Å; K796-T799 WeakPolarHBondContact CA-OG1 3.49Å; K796-T799 PolarHBondContact O-N 3.11Å; K796-T799 PolarHBondContact O-OG1 3.07Å; C797-T799 VanDerWaalsContact C-N 3.31Å; C797-T799 PolarHBondContact O-N 3.48Å; T799-F801 VanDerWaalsContact C-N 3.34Å
800	N	60	Low	66	Low	119 Å²	119	71.2 Å²	71.2	64%	0.636	37%	0.372	S	S	*	.	H	α-helix	trans	-79.2	-21.3	178.8	-69.4	-7.9	0	0	0	112.2	K796 C797	K796-N800 WeakPolarHBondContact O-CB 3.44Å; K796-N800 PolarHBondContact O-N 2.83Å; K796-N800 PolarHBondContact O-ND2 3.17Å; K796-N800 PolarHBondContact O-OD1 3.24Å; C797-N800 PolarHBondContact O-N 2.77Å
801	F	56	Low	65.2	Low	59 Å²	59	76.8 Å²	76.8	26%	0.259	40%	0.401	S	S	.	.	H	α-helix	trans	-119.9	-0.4	-173.3	-53.6	-56.9	0	0	0	114.6	H735 F745 T749 F752 C797 T799	H735-F801 AromaticContact CD2-CD2 3.86Å; H735-F801 AromaticContact CD2-CG 3.84Å; H735-F801 AromaticContact CE1-CD1 3.43Å; H735-F801 VanDerWaalsContact CE1-CD1 3.43Å; H735-F801 WeakPolarHBondContact CE1-CD1 3.12Å; H735-F801 AromaticContact CE1-CE1 3.58Å; H735-F801 AromaticContact CE1-CG 3.87Å; H735-F801 AromaticContact NE2-CD1 3.37Å; H735-F801 WeakPolarHBondContact NE2-CD1 3.42Å; H735-F801 AromaticContact NE2-CD2 3.85Å; H735-F801 AromaticContact NE2-CE1 3.93Å; H735-F801 AromaticContact NE2-CG 3.34Å; H735-F801 VanDerWaalsContact NE2-CG 3.34Å; H735-F801 WeakPolarHBondContact NE2-CG 3.4Å; F745-F801 VanDerWaalsContact CZ-O 3.28Å; F745-F801 WeakPolarHBondContact CZ-O 3.39Å; T749-F801 PolarHBondContact OG1-O 3.37Å; F752-F801 AromaticContact CE1-CD2 3.98Å; F752-F801 HydrophobicContact CE1-CD2 3.98Å; C797-F801 HydrophobicContact CB-CD2 3.89Å; C797-F801 HydrophobicContact CB-CE2 3.81Å; C797-F801 WeakPolarHBondContact O-CB 3.49Å; C797-F801 WeakPolarHBondContact O-CD2 3.37Å; C797-F801 WeakPolarHBondContact O-CG 3.47Å; C797-F801 PolarHBondContact O-N 3.21Å; T799-F801 VanDerWaalsContact C-N 3.34Å
802	S	47.5	Very low	64.3	Low	103 Å²	103	80.5 Å²	80.5	72%	0.72	42%	0.417	S	S	*	.			trans	-93.5	0	160.9	-86.2	0	0	0	0	108.9	T749 Q753 K798	T749-S802 WeakPolarHBondContact CG2-OG 3.45Å; Q753-S802 PolarHBondContact NE2-OG 3.44Å; K798-S802 VanDerWaalsContact O-CB 3.28Å; K798-S802 WeakPolarHBondContact O-CB 3.27Å; K798-S802 PolarHBondContact O-N 3.11Å; K798-S802 VanDerWaalsContact O-N 3.13Å; K798-S802 PolarHBondContact O-OG 3.16Å

Retrieved 802 of 802 residues in 220 ms (Link to these results)

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