A0A087Y4A5_POEFO Loading...

General transcription factor IIH subunit 1

Component of the general transcription and DNA repair factor IIH (TFIIH) core complex, which is involved in general and transcription-coupled nucleotide excision repair (NER) of damaged DNA and, when complexed to CAK, in RNA transcription by RNA polymerase II. In NER, TFIIH acts by opening DNA around the lesion to allow the excision of the damaged oligonucleotide and its replacement by a new DNA fragment. In transcription, TFIIH has an essential role in transcription initiation. When the pre-initiation complex (PIC) has been established, TFIIH is required for promoter opening and promoter escape. Phosphorylation of the C-terminal tail (CTD) of the largest subunit of RNA polymerase II by the kinase module CAK controls the initiation of transcription.

AlphaFold DB , UniProt , Accession A0A087Y4A5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 550 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.1	Very low	57.6	Low	246 Å²	246	109.5 Å²	109.5	100%	1.212	63%	0.627	S	S	*	*				0	136.5	0	-78.2	-161.7	-96.1	0	0	108.5
2	A	25.9	Very low	60	Low	98 Å²	98	100.8 Å²	100.8	81%	0.81	58%	0.577	S	S	*	*			trans	14	131.2	173.2	0	0	0	0	0	121.2	L4	A2-L4 PolarHBondContact O-N 3.06Å
3	S	29.4	Very low	61.9	Low	102 Å²	102	104 Å²	104	71%	0.713	58%	0.581	S	S	*	*			trans	-18.7	119.2	167	52.1	0	0	0	0	116.2	S5	S3-S5 PolarHBondContact O-N 3.39Å
4	L	35.8	Very low	63.4	Low	173 Å²	173	104.7 Å²	104.7	91%	0.906	58%	0.575	S	S	*	*			trans	-43.7	108.9	164	-72.4	150.3	0	0	0	109.2	A2 E6	A2-L4 PolarHBondContact O-N 3.06Å; L4-E6 PolarHBondContact O-N 3.35Å; L4-E6 VanDerWaalsContact O-N 3.08Å
5	S	42.1	Very low	64.9	Low	116 Å²	116	97.7 Å²	97.7	81%	0.811	54%	0.536	S	S	*	.			trans	-71.8	101.5	175.8	-49.8	0	0	0	0	106.6	S3 E7	S3-S5 PolarHBondContact O-N 3.39Å; S5-E7 PolarHBondContact O-N 3.04Å
6	E	60.9	Low	66.2	Low	80 Å²	80	98.4 Å²	98.4	37%	0.374	53%	0.528	S	S	.	.			trans	-60.6	126.4	175.7	-73.7	176.2	179.9	0	0	109.2	L4 V8 R30	L4-E6 PolarHBondContact O-N 3.35Å; L4-E6 VanDerWaalsContact O-N 3.08Å; E6-V8 PolarHBondContact O-N 3.14Å; E6-R30 IonicContact OE1-CZ 3.99Å; E6-R30 IonicContact OE1-NE 3.95Å; E6-R30 PolarHBondContact OE1-NE 2.96Å; E6-R30 IonicContact OE1-NH1 2.64Å; E6-R30 IonicContact OE1-NH2 3.43Å; E6-R30 PolarHBondContact OE1-NH2 2.74Å; E6-R30 IonicContact OE2-CZ 3.08Å; E6-R30 IonicContact OE2-NE 2.76Å; E6-R30 PolarHBondContact OE2-NE 3.41Å; E6-R30 IonicContact OE2-NH2 2.69Å; E6-R30 PolarHBondContact OE2-NH2 2.91Å
7	E	75	Confident	67.4	Low	137 Å²	137	93.8 Å²	93.8	64%	0.64	50%	0.503	S	S	*	.			trans	-64.9	120.3	178.7	-171.7	-179.3	-176.8	0	0	109.7	S5 L9 M27 A28	S5-E7 PolarHBondContact O-N 3.04Å; E7-L9 HydrophobicContact CG-CD2 4.43Å; E7-M27 CarbonylContact O-C 3.48Å; E7-M27 WeakPolarHBondContact O-CA 3.02Å; E7-A28 HydrophobicContact CB-CB 4.4Å; E7-A28 PolarHBondContact O-N 3.01Å
8	V	80.6	Confident	68.1	Low	68 Å²	68	100.7 Å²	100.7	41%	0.412	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	112.5	179.7	-175.1	0	0	0	0	108.6	E6 V11 Y25 M27	E6-V8 PolarHBondContact O-N 3.14Å; V8-V11 HydrophobicContact CG1-CG2 3.35Å; V8-Y25 HydrophobicContact CG1-CD1 4.33Å; V8-M27 HydrophobicContact CG2-CG 4.29Å
9	L	83.2	Confident	68.8	Low	70 Å²	70	106.3 Å²	106.3	37%	0.366	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-37.5	-176.4	-60.5	177.6	0	0	0	112.4	E7 L26 L95 L99	E7-L9 HydrophobicContact CG-CD2 4.43Å; L9-L26 WeakPolarHBondContact CA-O 3.31Å; L9-L26 WeakPolarHBondContact CB-O 3.47Å; L9-L26 PolarHBondContact N-O 3.24Å; L9-L95 HydrophobicContact CB-CD2 3.84Å; L9-L95 HydrophobicContact CD1-CD1 4.49Å; L9-L99 HydrophobicContact CD1-CD1 3.76Å; L9-L99 HydrophobicContact CD1-CD2 4.36Å
10	L	84.6	Confident	69.5	Low	48 Å²	48	106.2 Å²	106.2	25%	0.251	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	136.5	177.4	-173.3	67	0	0	0	111.1	V12 L26 A91 A92 L95	L10-V12 HydrophobicContact CD2-CG2 4.1Å; L10-V12 HydrophobicContact CG-CG2 4.12Å; L10-L26 HydrophobicContact CB-CB 4.18Å; L10-L26 HydrophobicContact CB-CD1 4.05Å; L10-L26 HydrophobicContact CD2-CD1 4.06Å; L10-L26 HydrophobicContact CG-CD1 4.33Å; L10-L26 PolarHBondContact N-O 2.74Å; L10-L26 VanDerWaalsContact N-O 3.09Å; L10-L26 PolarHBondContact O-N 3.2Å; L10-A91 HydrophobicContact CD2-CB 4.01Å; L10-A92 HydrophobicContact CD2-CB 4.26Å; L10-L95 HydrophobicContact CB-CD2 3.65Å; L10-L95 HydrophobicContact CD2-CD2 4.41Å
11	V	86.6	Confident	70.2	Confident	67 Å²	67	103.9 Å²	103.9	41%	0.406	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122	174.3	-176.3	0	0	0	0	109.1	V8 T23 Y25	V8-V11 HydrophobicContact CG1-CG2 3.35Å; V11-T23 HydrophobicContact CG1-CG2 3.46Å; V11-T23 VanDerWaalsContact CG1-CG2 3.46Å; V11-Y25 HydrophobicContact CG1-CD1 4.05Å; V11-Y25 HydrophobicContact CG1-CE1 3.84Å; V11-Y25 HydrophobicContact CG2-CD1 3.84Å; V11-Y25 HydrophobicContact CG2-CE1 4.16Å
12	V	85.8	Confident	73	Confident	4 Å²	4	92.2 Å²	92.2	2%	0.024	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113.1	176	-172.8	0	0	0	0	109.6	L10 V15 T23 L24 F79 D88	L10-V12 HydrophobicContact CD2-CG2 4.1Å; L10-V12 HydrophobicContact CG-CG2 4.12Å; V12-V15 HydrophobicContact CB-CG2 4.02Å; V12-V15 HydrophobicContact CG1-CG2 3.6Å; V12-T23 WeakPolarHBondContact O-CA 3.48Å; V12-T23 WeakPolarHBondContact O-CG2 3.43Å; V12-L24 HydrophobicContact CB-CB 4.39Å; V12-L24 PolarHBondContact N-O 2.76Å; V12-L24 PolarHBondContact O-N 2.84Å; V12-F79 HydrophobicContact CB-CE1 4.47Å; V12-F79 HydrophobicContact CG1-CD1 3.87Å; V12-F79 HydrophobicContact CG1-CE1 3.87Å; V12-D88 HydrophobicContact CG1-CB 3.66Å; V12-D88 HydrophobicContact CG2-CB 4.45Å
13	K	84.9	Confident	76	Confident	143 Å²	143	88.4 Å²	88.4	62%	0.622	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	159.4	177.7	-61.9	-176.5	179.8	-179.3	0	110.9	T23	K13-T23 HydrophobicContact CG-CG2 4.15Å
14	K	82.8	Confident	78.8	Confident	114 Å²	114	83.5 Å²	83.5	50%	0.496	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59.2	46.9	177.3	-56.8	-176.7	177.2	-177.5	0	113.7	G22 A80	K14-G22 WeakPolarHBondContact CA-O 3.2Å; K14-G22 PolarHBondContact N-O 3.09Å; K14-G22 VanDerWaalsContact N-O 3.12Å; K14-A80 PolarHBondContact O-N 2.91Å; K14-A80 VanDerWaalsContact O-N 3.07Å
15	V	86.6	Confident	81.3	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122	173.3	-178.8	0	0	0	0	109.3	V12 G22 L24 W33 F77 H78 F79	V12-V15 HydrophobicContact CB-CG2 4.02Å; V12-V15 HydrophobicContact CG1-CG2 3.6Å; V15-G22 PolarHBondContact N-O 3.39Å; V15-G22 CarbonylContact O-C 3.59Å; V15-G22 PolarHBondContact O-N 3Å; V15-G22 VanDerWaalsContact O-N 3.08Å; V15-L24 HydrophobicContact CB-CB 4.18Å; V15-L24 HydrophobicContact CG1-CB 4.3Å; V15-L24 HydrophobicContact CG2-CB 3.93Å; V15-W33 PolarHBondContact O-NE1 2.77Å; V15-F77 HydrophobicContact CG1-CB 3.73Å; V15-F77 HydrophobicContact CG1-CD1 4.1Å; V15-F77 HydrophobicContact CG1-CG 4.33Å; V15-H78 CarbonylContact C-O 3.54Å; V15-H78 WeakPolarHBondContact CA-O 3.38Å; V15-F79 HydrophobicContact CG2-CD1 3.88Å; V15-F79 HydrophobicContact CG2-CE1 4.02Å
16	R	85.4	Confident	83.4	Confident	109 Å²	109	72.9 Å²	72.9	41%	0.411	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	132.3	177.8	-74.9	-176.6	-176.3	175.5	0.5	112.7	Q20 D21 H78 A80	R16-Q20 CarbonylContact C-O 3.59Å; R16-Q20 WeakPolarHBondContact CA-O 3.29Å; R16-D21 WeakPolarHBondContact CD-OD1 3.09Å; R16-D21 WeakPolarHBondContact CG-OD1 3.41Å; R16-D21 IonicContact CZ-OD1 2.91Å; R16-D21 IonicContact CZ-OD2 2.87Å; R16-D21 IonicContact NE-OD1 3.18Å; R16-D21 PolarHBondContact NE-OD1 3.28Å; R16-D21 IonicContact NE-OD2 3.54Å; R16-D21 PolarHBondContact NE-OD2 2.95Å; R16-D21 IonicContact NH2-OD1 2.69Å; R16-D21 IonicContact NH2-OD2 3.41Å; R16-D21 PolarHBondContact NH2-OD2 3.39Å; R16-H78 HydrophobicContact CB-CB 4.11Å; R16-H78 PolarHBondContact N-O 3.44Å; R16-H78 PolarHBondContact O-N 3.21Å; R16-A80 HydrophobicContact CG-CB 4.27Å
17	Q	86.1	Confident	84.7	Confident	20 Å²	20	69.6 Å²	69.6	9%	0.093	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.2	169.8	-163.6	-83.5	10.5	0	0	108.3	K19 Q20 W33 V43 T75 F77	Q17-K19 VanDerWaalsContact C-N 3.26Å; Q17-K19 PolarHBondContact O-N 3.47Å; Q17-K19 VanDerWaalsContact O-N 3.07Å; Q17-Q20 PolarHBondContact N-O 3.1Å; Q17-Q20 PolarHBondContact O-N 3.4Å; Q17-W33 HydrophobicContact CB-CD2 3.9Å; Q17-W33 HydrophobicContact CB-CE3 4.15Å; Q17-W33 HydrophobicContact CB-CH2 4.11Å; Q17-W33 HydrophobicContact CB-CZ2 3.82Å; Q17-W33 HydrophobicContact CB-CZ3 4.25Å; Q17-V43 HydrophobicContact CG-CG2 4.24Å; Q17-T75 HydrophobicContact CG-CG2 4.31Å; Q17-F77 HydrophobicContact CB-CD1 4.38Å; Q17-F77 HydrophobicContact CG-CD1 4.25Å; Q17-F77 HydrophobicContact CG-CE1 4.1Å
18	R	80.9	Confident	85	Confident	217 Å²	217	64.7 Å²	64.7	82%	0.819	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.5	46.4	-177.8	-64.7	-178.4	174.9	-163	-0.3	114.7	Q20	R18-Q20 VanDerWaalsContact C-N 3.3Å; R18-Q20 PolarHBondContact O-N 2.92Å
19	K	80.4	Confident	85	Confident	207 Å²	207	67 Å²	67	90%	0.9	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	10.3	-179	-50.2	-179.9	178.5	-179.8	0	116.1	Q17	Q17-K19 VanDerWaalsContact C-N 3.26Å; Q17-K19 PolarHBondContact O-N 3.47Å; Q17-K19 VanDerWaalsContact O-N 3.07Å
20	Q	82.4	Confident	85.1	Confident	104 Å²	104	67 Å²	67	49%	0.486	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.3	172.3	-64.1	-178.5	16.3	0	0	110.1	R16 Q17 R18 W33	R16-Q20 CarbonylContact C-O 3.59Å; R16-Q20 WeakPolarHBondContact CA-O 3.29Å; Q17-Q20 PolarHBondContact N-O 3.1Å; Q17-Q20 PolarHBondContact O-N 3.4Å; R18-Q20 VanDerWaalsContact C-N 3.3Å; R18-Q20 PolarHBondContact O-N 2.92Å; Q20-W33 HydrophobicContact CB-CH2 3.81Å; Q20-W33 HydrophobicContact CB-CZ2 4.34Å; Q20-W33 WeakPolarHBondContact O-CZ2 3.5Å
21	D	85.6	Confident	85.3	Confident	58 Å²	58	64.8 Å²	64.8	31%	0.31	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	138.4	172.3	-77	-59.1	0	0	0	110.2	R16 E36	R16-D21 WeakPolarHBondContact CD-OD1 3.09Å; R16-D21 WeakPolarHBondContact CG-OD1 3.41Å; R16-D21 IonicContact CZ-OD1 2.91Å; R16-D21 IonicContact CZ-OD2 2.87Å; R16-D21 IonicContact NE-OD1 3.18Å; R16-D21 PolarHBondContact NE-OD1 3.28Å; R16-D21 IonicContact NE-OD2 3.54Å; R16-D21 PolarHBondContact NE-OD2 2.95Å; R16-D21 IonicContact NH2-OD1 2.69Å; R16-D21 IonicContact NH2-OD2 3.41Å; R16-D21 PolarHBondContact NH2-OD2 3.39Å; D21-E36 PolarHBondContact O-N 3.11Å; D21-E36 VanDerWaalsContact O-N 3.12Å
22	G	88.3	Confident	85.5	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	-168.8	-177	0	0	0	0	0	113.3	K14 V15 G34	K14-G22 WeakPolarHBondContact CA-O 3.2Å; K14-G22 PolarHBondContact N-O 3.09Å; K14-G22 VanDerWaalsContact N-O 3.12Å; V15-G22 PolarHBondContact N-O 3.39Å; V15-G22 CarbonylContact O-C 3.59Å; V15-G22 PolarHBondContact O-N 3Å; V15-G22 VanDerWaalsContact O-N 3.08Å; G22-G34 CarbonylContact C-O 3.57Å; G22-G34 WeakPolarHBondContact CA-O 3.5Å
23	T	87.9	Confident	85.7	Confident	18 Å²	18	61.5 Å²	61.5	11%	0.11	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132	-179	-58.3	0	0	0	0	109.8	V11 V12 K13 Y25 W33 G34	V11-T23 HydrophobicContact CG1-CG2 3.46Å; V11-T23 VanDerWaalsContact CG1-CG2 3.46Å; V12-T23 WeakPolarHBondContact O-CA 3.48Å; V12-T23 WeakPolarHBondContact O-CG2 3.43Å; K13-T23 HydrophobicContact CG-CG2 4.15Å; T23-Y25 HydrophobicContact CG2-CD2 4.2Å; T23-Y25 HydrophobicContact CG2-CE1 4.01Å; T23-Y25 HydrophobicContact CG2-CE2 3.59Å; T23-Y25 VanDerWaalsContact CG2-CZ 3.48Å; T23-Y25 WeakPolarHBondContact O-CD2 3.44Å; T23-Y25 WeakPolarHBondContact O-CE2 3.25Å; T23-W33 WeakPolarHBondContact O-CA 3.17Å; T23-G34 PolarHBondContact N-O 2.86Å; T23-G34 PolarHBondContact O-N 2.65Å
24	L	88.6	Confident	85.8	Confident	0 Å²	0	55 Å²	55	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	129.8	174.1	-173.3	70.2	0	0	0	109.1	V12 V15 L26 I31 W33 F77 F79	V12-L24 HydrophobicContact CB-CB 4.39Å; V12-L24 PolarHBondContact N-O 2.76Å; V12-L24 PolarHBondContact O-N 2.84Å; V15-L24 HydrophobicContact CB-CB 4.18Å; V15-L24 HydrophobicContact CG1-CB 4.3Å; V15-L24 HydrophobicContact CG2-CB 3.93Å; L24-L26 HydrophobicContact CD2-CD1 4.37Å; L24-L26 HydrophobicContact CG-CD1 4.5Å; L24-I31 HydrophobicContact CD1-CD1 3.98Å; L24-I31 HydrophobicContact CD1-CG1 3.84Å; L24-I31 HydrophobicContact CD2-CD1 4.26Å; L24-I31 HydrophobicContact CG-CD1 4.29Å; L24-I31 HydrophobicContact CG-CG1 4.38Å; L24-W33 HydrophobicContact CD1-CB 3.99Å; L24-F77 HydrophobicContact CD1-CD1 3.93Å; L24-F77 HydrophobicContact CD1-CE1 3.72Å; L24-F77 HydrophobicContact CD1-CE2 4.36Å; L24-F77 HydrophobicContact CD1-CG 4.32Å; L24-F77 HydrophobicContact CD1-CZ 3.94Å; L24-F79 HydrophobicContact CD2-CZ 4.37Å
25	Y	88.9	Confident	86	Confident	66 Å²	66	50.2 Å²	50.2	26%	0.259	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	118.5	179.2	-59.8	-93.6	0	0	0	108.5	V8 V11 T23 I31 A32 F41	V8-Y25 HydrophobicContact CG1-CD1 4.33Å; V11-Y25 HydrophobicContact CG1-CD1 4.05Å; V11-Y25 HydrophobicContact CG1-CE1 3.84Å; V11-Y25 HydrophobicContact CG2-CD1 3.84Å; V11-Y25 HydrophobicContact CG2-CE1 4.16Å; T23-Y25 HydrophobicContact CG2-CD2 4.2Å; T23-Y25 HydrophobicContact CG2-CE1 4.01Å; T23-Y25 HydrophobicContact CG2-CE2 3.59Å; T23-Y25 VanDerWaalsContact CG2-CZ 3.48Å; T23-Y25 WeakPolarHBondContact O-CD2 3.44Å; T23-Y25 WeakPolarHBondContact O-CE2 3.25Å; Y25-I31 WeakPolarHBondContact O-CA 3.45Å; Y25-A32 PolarHBondContact N-O 3.35Å; Y25-A32 PolarHBondContact O-N 2.89Å; Y25-F41 HydrophobicContact CD2-CD1 4.19Å; Y25-F41 AromaticContact CD2-CE1 3.57Å; Y25-F41 HydrophobicContact CD2-CE1 3.57Å; Y25-F41 HydrophobicContact CE2-CD1 4.48Å; Y25-F41 AromaticContact CE2-CE1 3.8Å; Y25-F41 HydrophobicContact CE2-CE1 3.8Å; Y25-F41 HydrophobicContact CG-CE1 4.12Å
26	L	86.2	Confident	85.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	110.1	165.2	-67.7	102.9	0	0	0	107.8	L9 L10 L24 I31 A92 L95 L96	L9-L26 WeakPolarHBondContact CA-O 3.31Å; L9-L26 WeakPolarHBondContact CB-O 3.47Å; L9-L26 PolarHBondContact N-O 3.24Å; L10-L26 HydrophobicContact CB-CB 4.18Å; L10-L26 HydrophobicContact CB-CD1 4.05Å; L10-L26 HydrophobicContact CD2-CD1 4.06Å; L10-L26 HydrophobicContact CG-CD1 4.33Å; L10-L26 PolarHBondContact N-O 2.74Å; L10-L26 VanDerWaalsContact N-O 3.09Å; L10-L26 PolarHBondContact O-N 3.2Å; L24-L26 HydrophobicContact CD2-CD1 4.37Å; L24-L26 HydrophobicContact CG-CD1 4.5Å; L26-I31 HydrophobicContact CD1-CD1 4.46Å; L26-I31 HydrophobicContact CD2-CD1 3.94Å; L26-I31 HydrophobicContact CG-CD1 3.86Å; L26-I31 HydrophobicContact CG-CG1 4.19Å; L26-A92 HydrophobicContact CD1-CB 4.15Å; L26-L95 HydrophobicContact CB-CD2 3.99Å; L26-L95 HydrophobicContact CD2-CD2 4.18Å; L26-L96 HydrophobicContact CD2-CD1 4.12Å; L26-L96 HydrophobicContact CD2-CD2 3.68Å; L26-L96 HydrophobicContact CD2-CG 3.55Å
27	M	87.6	Confident	84.8	Confident	10 Å²	10	55.7 Å²	55.7	5%	0.049	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	176.4	176.8	-61	158.2	169.5	0	0	109.5	E7 V8 E29 R30 A32 F41 Y47	E7-M27 CarbonylContact O-C 3.48Å; E7-M27 WeakPolarHBondContact O-CA 3.02Å; V8-M27 HydrophobicContact CG2-CG 4.29Å; M27-E29 VanDerWaalsContact C-N 3.34Å; M27-E29 PolarHBondContact O-N 3.28Å; M27-R30 WeakPolarHBondContact CA-O 3.21Å; M27-R30 HydrophobicContact CB-CG 4.3Å; M27-R30 WeakPolarHBondContact CB-O 3.45Å; M27-R30 PolarHBondContact N-O 3.47Å; M27-R30 HydrophobicContact SD-CG 3.91Å; M27-A32 HydrophobicContact CE-CB 4.33Å; M27-A32 HydrophobicContact SD-CB 4.28Å; M27-F41 HydrophobicContact CE-CE1 4.13Å; M27-F41 HydrophobicContact CE-CE2 3.78Å; M27-F41 HydrophobicContact CE-CZ 3.44Å; M27-F41 VanDerWaalsContact CE-CZ 3.44Å; M27-Y47 WeakPolarHBondContact O-CE2 3.05Å; M27-Y47 PolarHBondContact O-OH 3.18Å
28	A	80.7	Confident	84.2	Confident	34 Å²	34	62.3 Å²	62.3	28%	0.281	31%	0.306	S	S	.	.	S	Bend	trans	-58.9	-38.6	179.1	0	0	0	0	0	114.2	E7 Y47 F103	E7-A28 HydrophobicContact CB-CB 4.4Å; E7-A28 PolarHBondContact O-N 3.01Å; A28-Y47 WeakPolarHBondContact O-CE2 3.4Å; A28-F103 WeakPolarHBondContact O-CZ 3.4Å
29	E	80.7	Confident	83.5	Confident	118 Å²	118	60.4 Å²	60.4	55%	0.551	31%	0.312	S	S	*	.	S	Bend	trans	-115.3	-15	-173	-60.5	-166.3	146.9	0	0	114.5	M27 Y47	M27-E29 VanDerWaalsContact C-N 3.34Å; M27-E29 PolarHBondContact O-N 3.28Å; E29-Y47 WeakPolarHBondContact O-CD2 3.37Å; E29-Y47 PolarHBondContact O-N 3.15Å
30	R	87.1	Confident	83.1	Confident	69 Å²	69	60.5 Å²	60.5	26%	0.26	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	161	-174.2	65.4	-178.8	-178.9	-178.6	-4.6	112.8	E6 M27 H45 L46 Y47	E6-R30 IonicContact OE1-CZ 3.99Å; E6-R30 IonicContact OE1-NE 3.95Å; E6-R30 PolarHBondContact OE1-NE 2.96Å; E6-R30 IonicContact OE1-NH1 2.64Å; E6-R30 IonicContact OE1-NH2 3.43Å; E6-R30 PolarHBondContact OE1-NH2 2.74Å; E6-R30 IonicContact OE2-CZ 3.08Å; E6-R30 IonicContact OE2-NE 2.76Å; E6-R30 PolarHBondContact OE2-NE 3.41Å; E6-R30 IonicContact OE2-NH2 2.69Å; E6-R30 PolarHBondContact OE2-NH2 2.91Å; M27-R30 WeakPolarHBondContact CA-O 3.21Å; M27-R30 HydrophobicContact CB-CG 4.3Å; M27-R30 WeakPolarHBondContact CB-O 3.45Å; M27-R30 PolarHBondContact N-O 3.47Å; M27-R30 HydrophobicContact SD-CG 3.91Å; R30-H45 WeakPolarHBondContact CA-O 3.31Å; R30-H45 WeakPolarHBondContact CB-O 3.15Å; R30-L46 HydrophobicContact CB-CG 4.49Å; R30-Y47 PolarHBondContact O-OH 3.29Å
31	I	88.8	Confident	83.1	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.6	168.5	-174.3	160.5	0	0	0	109.2	L24 Y25 L26 S44 H45 Y47 I50 L67 L96	L24-I31 HydrophobicContact CD1-CD1 3.98Å; L24-I31 HydrophobicContact CD1-CG1 3.84Å; L24-I31 HydrophobicContact CD2-CD1 4.26Å; L24-I31 HydrophobicContact CG-CD1 4.29Å; L24-I31 HydrophobicContact CG-CG1 4.38Å; Y25-I31 WeakPolarHBondContact O-CA 3.45Å; L26-I31 HydrophobicContact CD1-CD1 4.46Å; L26-I31 HydrophobicContact CD2-CD1 3.94Å; L26-I31 HydrophobicContact CG-CD1 3.86Å; L26-I31 HydrophobicContact CG-CG1 4.19Å; I31-S44 WeakPolarHBondContact O-CA 3.39Å; I31-H45 HydrophobicContact CG2-CB 3.97Å; I31-H45 PolarHBondContact N-O 2.71Å; I31-H45 PolarHBondContact O-N 2.86Å; I31-Y47 HydrophobicContact CB-CE1 4.04Å; I31-Y47 HydrophobicContact CG2-CE1 4.43Å; I31-I50 HydrophobicContact CG2-CD1 3.78Å; I31-L67 HydrophobicContact CD1-CD1 4.13Å; I31-L67 HydrophobicContact CG2-CD1 3.77Å; I31-L96 HydrophobicContact CD1-CD1 4.27Å; I31-L96 HydrophobicContact CD1-CD2 4.37Å
32	A	89.3	Confident	82.9	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.008	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.8	-177.3	0	0	0	0	0	110.9	Y25 M27 F41 V43	Y25-A32 PolarHBondContact N-O 3.35Å; Y25-A32 PolarHBondContact O-N 2.89Å; M27-A32 HydrophobicContact CE-CB 4.33Å; M27-A32 HydrophobicContact SD-CB 4.28Å; A32-F41 HydrophobicContact CB-CB 4.21Å; A32-F41 HydrophobicContact CB-CD1 3.74Å; A32-F41 HydrophobicContact CB-CD2 4.26Å; A32-F41 HydrophobicContact CB-CE1 4.18Å; A32-F41 HydrophobicContact CB-CG 3.79Å; A32-V43 CarbonylContact C-O 3.49Å; A32-V43 VanDerWaalsContact CA-O 3.28Å; A32-V43 WeakPolarHBondContact CA-O 3.34Å
33	W	90.4	Very high	82.7	Confident	1 Å²	1	62 Å²	62	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.8	174.3	177.3	92.7	0	0	0	110	V15 Q17 Q20 T23 L24 P35 F41 T42 V43 F77	V15-W33 PolarHBondContact O-NE1 2.77Å; Q17-W33 HydrophobicContact CB-CD2 3.9Å; Q17-W33 HydrophobicContact CB-CE3 4.15Å; Q17-W33 HydrophobicContact CB-CH2 4.11Å; Q17-W33 HydrophobicContact CB-CZ2 3.82Å; Q17-W33 HydrophobicContact CB-CZ3 4.25Å; Q20-W33 HydrophobicContact CB-CH2 3.81Å; Q20-W33 HydrophobicContact CB-CZ2 4.34Å; Q20-W33 WeakPolarHBondContact O-CZ2 3.5Å; T23-W33 WeakPolarHBondContact O-CA 3.17Å; L24-W33 HydrophobicContact CD1-CB 3.99Å; W33-P35 HydrophobicContact CH2-CB 3.88Å; W33-P35 HydrophobicContact CZ3-CB 4.23Å; W33-P35 HydrophobicContact CZ3-CG 4.46Å; W33-F41 CarbonylContact O-C 3.57Å; W33-F41 WeakPolarHBondContact O-CA 3.31Å; W33-T42 HydrophobicContact CZ3-CG2 4.39Å; W33-T42 PolarHBondContact O-N 3.36Å; W33-V43 HydrophobicContact CB-CB 4.19Å; W33-V43 HydrophobicContact CE3-CG2 4.17Å; W33-V43 PolarHBondContact N-O 3.48Å; W33-V43 PolarHBondContact O-N 2.99Å; W33-F77 HydrophobicContact CB-CE1 3.78Å; W33-F77 HydrophobicContact CG-CD1 4.44Å; W33-F77 AromaticContact CG-CE1 4Å; W33-F77 HydrophobicContact CG-CE1 4Å
34	G	87.8	Confident	82.7	Confident	7 Å²	7	63.8 Å²	63.8	7%	0.072	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135	179	0	0	0	0	0	111.3	G22 T23	G22-G34 CarbonylContact C-O 3.57Å; G22-G34 WeakPolarHBondContact CA-O 3.5Å; T23-G34 PolarHBondContact N-O 2.86Å; T23-G34 PolarHBondContact O-N 2.65Å
35	P	85.8	Confident	82.5	Confident	14 Å²	14	65.4 Å²	65.4	9%	0.091	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	149.3	173.8	26.9	-31.2	0	0	0	110.8	W33 G37 K38 T42	W33-P35 HydrophobicContact CH2-CB 3.88Å; W33-P35 HydrophobicContact CZ3-CB 4.23Å; W33-P35 HydrophobicContact CZ3-CG 4.46Å; P35-G37 PolarHBondContact O-N 3.27Å; P35-K38 HydrophobicContact CG-CB 4.18Å; P35-K38 HydrophobicContact CG-CD 4.1Å; P35-K38 HydrophobicContact CG-CG 4.46Å; P35-K38 PolarHBondContact O-N 2.94Å; P35-T42 VanDerWaalsContact CD-OG1 3.24Å; P35-T42 WeakPolarHBondContact CD-OG1 3.49Å
36	E	79.3	Confident	82.3	Confident	138 Å²	138	66.3 Å²	66.3	65%	0.645	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	127.2	-176.9	-166.4	165	-161	0	0	111.2	D21	D21-E36 PolarHBondContact O-N 3.11Å; D21-E36 VanDerWaalsContact O-N 3.12Å
37	G	68	Low	82.3	Confident	85 Å²	85	66.5 Å²	66.5	88%	0.876	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	6.8	179.4	0	0	0	0	0	116.6	P35	P35-G37 PolarHBondContact O-N 3.27Å
38	K	72.9	Confident	81.9	Confident	159 Å²	159	68.9 Å²	68.9	69%	0.691	37%	0.366	S	S	*	.			trans	-121.5	139.1	172.6	-65.2	-173.9	179.6	177.2	0	112.2	P35 R40	P35-K38 HydrophobicContact CG-CB 4.18Å; P35-K38 HydrophobicContact CG-CD 4.1Å; P35-K38 HydrophobicContact CG-CG 4.46Å; P35-K38 PolarHBondContact O-N 2.94Å; K38-R40 PolarHBondContact O-N 3.42Å
39	D	66.9	Low	82	Confident	177 Å²	177	70.8 Å²	70.8	95%	0.947	37%	0.371	S	S	*	.	S	Bend	trans	-85.5	21	-178.3	-149.3	22.1	0	0	0	113.7
40	R	72.9	Confident	82.1	Confident	210 Å²	210	65.6 Å²	65.6	79%	0.792	35%	0.347	S	S	*	.	S	Bend	trans	-128.1	129.9	-179.4	-84.5	-174	165.4	-171.3	-3.6	111.4	K38 T42	K38-R40 PolarHBondContact O-N 3.42Å; R40-T42 PolarHBondContact O-N 2.9Å
41	F	81.8	Confident	81.8	Confident	90 Å²	90	70.7 Å²	70.7	40%	0.395	37%	0.367	S	S	.	.			trans	-69.4	124.5	171.5	-55	-61.3	0	0	0	110.3	Y25 M27 A32 W33	Y25-F41 HydrophobicContact CD2-CD1 4.19Å; Y25-F41 AromaticContact CD2-CE1 3.57Å; Y25-F41 HydrophobicContact CD2-CE1 3.57Å; Y25-F41 HydrophobicContact CE2-CD1 4.48Å; Y25-F41 AromaticContact CE2-CE1 3.8Å; Y25-F41 HydrophobicContact CE2-CE1 3.8Å; Y25-F41 HydrophobicContact CG-CE1 4.12Å; M27-F41 HydrophobicContact CE-CE1 4.13Å; M27-F41 HydrophobicContact CE-CE2 3.78Å; M27-F41 HydrophobicContact CE-CZ 3.44Å; M27-F41 VanDerWaalsContact CE-CZ 3.44Å; A32-F41 HydrophobicContact CB-CB 4.21Å; A32-F41 HydrophobicContact CB-CD1 3.74Å; A32-F41 HydrophobicContact CB-CD2 4.26Å; A32-F41 HydrophobicContact CB-CE1 4.18Å; A32-F41 HydrophobicContact CB-CG 3.79Å; W33-F41 CarbonylContact O-C 3.57Å; W33-F41 WeakPolarHBondContact O-CA 3.31Å
42	T	80.9	Confident	81.6	Confident	89 Å²	89	72.9 Å²	72.9	55%	0.546	38%	0.381	S	S	.	.	S	Bend	trans	-89.9	-26.2	178	-57.7	0	0	0	0	111.5	W33 P35 R40	W33-T42 HydrophobicContact CZ3-CG2 4.39Å; W33-T42 PolarHBondContact O-N 3.36Å; P35-T42 VanDerWaalsContact CD-OG1 3.24Å; P35-T42 WeakPolarHBondContact CD-OG1 3.49Å; R40-T42 PolarHBondContact O-N 2.9Å
43	V	83.5	Confident	81.5	Confident	16 Å²	16	74.7 Å²	74.7	10%	0.097	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.6	173.4	-177.4	0	0	0	0	107.7	Q17 A32 W33 H45 T75 F77	Q17-V43 HydrophobicContact CG-CG2 4.24Å; A32-V43 CarbonylContact C-O 3.49Å; A32-V43 VanDerWaalsContact CA-O 3.28Å; A32-V43 WeakPolarHBondContact CA-O 3.34Å; W33-V43 HydrophobicContact CB-CB 4.19Å; W33-V43 HydrophobicContact CE3-CG2 4.17Å; W33-V43 PolarHBondContact N-O 3.48Å; W33-V43 PolarHBondContact O-N 2.99Å; V43-H45 WeakPolarHBondContact CG1-NE2 3.06Å; V43-T75 HydrophobicContact CG1-CG2 4.12Å; V43-F77 HydrophobicContact CG1-CZ 4.28Å
44	S	87.8	Confident	81.4	Confident	54 Å²	54	80.1 Å²	80.1	38%	0.378	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	120.4	176.1	-172.7	0	0	0	0	108.5	I31	I31-S44 WeakPolarHBondContact O-CA 3.39Å
45	H	86.3	Confident	81.5	Confident	34 Å²	34	82.4 Å²	82.4	16%	0.157	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.9	-179.7	-64.1	-53.1	0	0	0	109.5	R30 I31 V43 I50 L69 T75	R30-H45 WeakPolarHBondContact CA-O 3.31Å; R30-H45 WeakPolarHBondContact CB-O 3.15Å; I31-H45 HydrophobicContact CG2-CB 3.97Å; I31-H45 PolarHBondContact N-O 2.71Å; I31-H45 PolarHBondContact O-N 2.86Å; V43-H45 WeakPolarHBondContact CG1-NE2 3.06Å; H45-I50 HydrophobicContact CB-CD1 4.47Å; H45-I50 HydrophobicContact CB-CG1 4.48Å; H45-L69 HydrophobicContact CB-CD2 4.27Å; H45-T75 PolarHBondContact NE2-OG1 3.41Å
46	L	84.3	Confident	81.4	Confident	86 Å²	86	82.4 Å²	82.4	45%	0.45	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	148.1	171.2	-77.6	126.5	0	0	0	110.5	R30 S48 D49	R30-L46 HydrophobicContact CB-CG 4.49Å; L46-S48 WeakPolarHBondContact CB-OG 3.27Å; L46-S48 PolarHBondContact O-N 2.79Å; L46-D49 PolarHBondContact O-N 3.49Å
47	Y	85.4	Confident	81.4	Confident	3 Å²	3	79.7 Å²	79.7	1%	0.012	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.5	177.2	-65.1	-47.7	0	0	0	113.3	M27 A28 E29 R30 I31 D49 I50 L96 L99 F103	M27-Y47 WeakPolarHBondContact O-CE2 3.05Å; M27-Y47 PolarHBondContact O-OH 3.18Å; A28-Y47 WeakPolarHBondContact O-CE2 3.4Å; E29-Y47 WeakPolarHBondContact O-CD2 3.37Å; E29-Y47 PolarHBondContact O-N 3.15Å; R30-Y47 PolarHBondContact O-OH 3.29Å; I31-Y47 HydrophobicContact CB-CE1 4.04Å; I31-Y47 HydrophobicContact CG2-CE1 4.43Å; Y47-D49 PolarHBondContact O-N 3.28Å; Y47-I50 HydrophobicContact CD1-CD1 4.07Å; Y47-L96 HydrophobicContact CD1-CD2 3.97Å; Y47-L96 HydrophobicContact CE1-CD2 3.44Å; Y47-L96 VanDerWaalsContact CE1-CD2 3.44Å; Y47-L99 HydrophobicContact CD2-CD1 4.49Å; Y47-L99 HydrophobicContact CE2-CB 4.49Å; Y47-L99 HydrophobicContact CE2-CD1 3.7Å; Y47-F103 AromaticContact CD2-CD2 3.82Å; Y47-F103 HydrophobicContact CD2-CD2 3.82Å; Y47-F103 AromaticContact CD2-CE2 3.44Å; Y47-F103 HydrophobicContact CD2-CE2 3.44Å; Y47-F103 VanDerWaalsContact CD2-CE2 3.44Å; Y47-F103 AromaticContact CD2-CZ 3.99Å; Y47-F103 HydrophobicContact CD2-CZ 3.99Å; Y47-F103 HydrophobicContact CE2-CE2 4.25Å; Y47-F103 HydrophobicContact CG-CD2 4.07Å; Y47-F103 HydrophobicContact CG-CE2 4.17Å
48	S	79.3	Confident	81.6	Confident	61 Å²	61	81.8 Å²	81.8	43%	0.427	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-29.5	172.6	52.1	0	0	0	0	113.5	L46	L46-S48 WeakPolarHBondContact CB-OG 3.27Å; L46-S48 PolarHBondContact O-N 2.79Å
49	D	82.2	Confident	81.3	Confident	74 Å²	74	78.3 Å²	78.3	40%	0.396	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-11.3	-168.7	-55.4	-12.7	0	0	0	111.5	L46 Y47 L69 H70	L46-D49 PolarHBondContact O-N 3.49Å; Y47-D49 PolarHBondContact O-N 3.28Å; D49-L69 HydrophobicContact CB-CD2 4.2Å; D49-L69 CarbonylContact O-C 3.57Å; D49-L69 VanDerWaalsContact O-CA 3.23Å; D49-L69 WeakPolarHBondContact O-CA 3.43Å; D49-L69 WeakPolarHBondContact O-CD2 3.23Å; D49-H70 PolarHBondContact O-CD2 3.11Å; D49-H70 PolarHBondContact O-N 3Å
50	I	84.1	Confident	81.7	Confident	8 Å²	8	76.6 Å²	76.6	4%	0.041	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	112.2	-179.9	-61.1	166.7	0	0	0	109.5	I31 H45 Y47 L67 L69 L100	I31-I50 HydrophobicContact CG2-CD1 3.78Å; H45-I50 HydrophobicContact CB-CD1 4.47Å; H45-I50 HydrophobicContact CB-CG1 4.48Å; Y47-I50 HydrophobicContact CD1-CD1 4.07Å; I50-L67 HydrophobicContact CD1-CD1 3.95Å; I50-L67 HydrophobicContact CG2-CD2 4.33Å; I50-L69 HydrophobicContact CG1-CD2 3.93Å; I50-L100 HydrophobicContact CB-CD2 3.7Å; I50-L100 HydrophobicContact CD1-CD2 4.45Å; I50-L100 HydrophobicContact CG2-CD1 4.32Å; I50-L100 HydrophobicContact CG2-CD2 3.68Å
51	R	81.3	Confident	81.5	Confident	177 Å²	177	71.8 Å²	71.8	67%	0.668	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	-49	176.5	-179.5	-179.2	178.1	-177.6	1.1	111.7	V68	R51-V68 WeakPolarHBondContact CB-O 3.5Å; R51-V68 PolarHBondContact N-O 3.33Å
52	C	83.3	Confident	81.4	Confident	47 Å²	47	74.1 Å²	74.1	32%	0.318	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	160.8	177.4	62.8	0	0	0	0	111.9	V68	C52-V68 PolarHBondContact N-O 2.94Å; C52-V68 PolarHBondContact O-N 3.37Å
53	Q	87.7	Confident	81.7	Confident	38 Å²	38	71.3 Å²	71.3	18%	0.178	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	146.6	170.4	66.5	178	7.3	0	0	110.9	L65 Q66 L67 K93 L100	Q53-L65 HydrophobicContact CB-CD1 4.18Å; Q53-Q66 CarbonylContact C-O 3.6Å; Q53-Q66 WeakPolarHBondContact CA-O 3.38Å; Q53-L67 HydrophobicContact CB-CD2 4.04Å; Q53-K93 PolarHBondContact NE2-O 2.87Å; Q53-L100 HydrophobicContact CG-CD1 4.4Å
54	K	87.4	Confident	81.8	Confident	116 Å²	116	73.9 Å²	73.9	50%	0.504	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138.1	172.6	-61.1	179.8	-179.3	178.1	0	108.9	L65 Q66 V68	K54-L65 CarbonylContact O-C 3.51Å; K54-L65 WeakPolarHBondContact O-CA 3.13Å; K54-Q66 HydrophobicContact CB-CB 4.32Å; K54-Q66 PolarHBondContact N-O 2.7Å; K54-Q66 PolarHBondContact O-N 3.44Å; K54-V68 HydrophobicContact CD-CG2 4.37Å
55	I	89.8	Confident	81.9	Confident	55 Å²	55	71.3 Å²	71.3	28%	0.282	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	154	175.2	53.2	154.8	0	0	0	110.7	Q64 L65 R89 K93	I55-Q64 WeakPolarHBondContact CA-O 3.48Å; I55-L65 HydrophobicContact CG2-CD1 3.53Å; I55-R89 HydrophobicContact CG2-CG 4.36Å; I55-K93 HydrophobicContact CD1-CD 3.9Å; I55-K93 HydrophobicContact CG2-CB 4.29Å; I55-K93 HydrophobicContact CG2-CD 4.36Å; I55-K93 HydrophobicContact CG2-CG 4.12Å
56	S	84.1	Confident	82.1	Confident	13 Å²	13	72.3 Å²	72.3	9%	0.091	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-65.3	134.6	168.5	55.9	0	0	0	0	110.6	K62 I63 Q64 R89	S56-K62 WeakPolarHBondContact CB-O 3.42Å; S56-K62 PolarHBondContact OG-O 3.02Å; S56-I63 WeakPolarHBondContact OG-CA 3.48Å; S56-Q64 PolarHBondContact N-O 2.95Å; S56-Q64 PolarHBondContact OG-N 3.43Å; S56-Q64 PolarHBondContact OG-O 2.94Å; S56-R89 PolarHBondContact O-NH1 3.03Å
57	P	80.7	Confident	82.4	Confident	81 Å²	81	68.2 Å²	68.2	53%	0.526	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-58.6	151.6	174.1	-23.6	32.8	0	0	0	113	G59 K60	P57-G59 PolarHBondContact O-N 3.1Å; P57-K60 PolarHBondContact O-N 3.49Å
58	D	70.3	Confident	82.4	Confident	129 Å²	129	69.1 Å²	69.1	69%	0.69	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	124	179.2	-60.7	-34.9	0	0	0	110.1	R89	D58-R89 IonicContact OD1-CZ 2.67Å; D58-R89 IonicContact OD1-NH1 2.68Å; D58-R89 PolarHBondContact OD1-NH1 3.32Å; D58-R89 IonicContact OD1-NH2 3.93Å; D58-R89 PolarHBondContact OD1-NH2 3.3Å
59	G	67.1	Low	82.8	Confident	87 Å²	87	66.9 Å²	66.9	90%	0.897	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.4	-8.9	-175.4	0	0	0	0	0	115.6	P57	P57-G59 PolarHBondContact O-N 3.1Å
60	K	75.1	Confident	82.5	Confident	141 Å²	141	69.4 Å²	69.4	61%	0.613	37%	0.373	S	S	*	.			trans	-80.9	134.4	171.1	-75.7	-165.4	178.1	-179.7	0	111.6	P57 K62	P57-K60 PolarHBondContact O-N 3.49Å; K60-K62 PolarHBondContact O-N 3Å
61	A	70.3	Confident	82.1	Confident	108 Å²	108	74.1 Å²	74.1	89%	0.893	40%	0.402	S	S	*	.	S	Bend	trans	-59.7	-16.7	176.8	0	0	0	0	0	114.5
62	K	78.8	Confident	81.8	Confident	139 Å²	139	68.5 Å²	68.5	60%	0.604	40%	0.4	S	S	*	.	S	Bend	trans	-110.3	108.2	176.7	-65.7	-177	-177.7	177.3	0	110.3	S56 K60 Q64	S56-K62 WeakPolarHBondContact CB-O 3.42Å; S56-K62 PolarHBondContact OG-O 3.02Å; K60-K62 PolarHBondContact O-N 3Å; K62-Q64 HydrophobicContact CB-CG 4.3Å; K62-Q64 PolarHBondContact O-N 2.71Å
63	I	86.2	Confident	81.8	Confident	31 Å²	31	71.3 Å²	71.3	16%	0.159	41%	0.412	C	S	.	.			trans	-82	113.6	175.8	-57.9	168.6	0	0	0	108.4	S56 H78 F79 A85 L86 R89	S56-I63 WeakPolarHBondContact OG-CA 3.48Å; I63-H78 WeakPolarHBondContact O-CA 3.4Å; I63-H78 PolarHBondContact O-ND1 3.24Å; I63-F79 HydrophobicContact CB-CB 4.43Å; I63-F79 HydrophobicContact CG2-CB 4.06Å; I63-F79 HydrophobicContact CG2-CD2 4.18Å; I63-F79 HydrophobicContact CG2-CG 4.43Å; I63-F79 PolarHBondContact O-N 2.79Å; I63-A85 HydrophobicContact CD1-CB 3.53Å; I63-L86 HydrophobicContact CD1-CD2 3.9Å; I63-L86 HydrophobicContact CD1-CG 3.73Å; I63-L86 HydrophobicContact CG1-CD2 4.13Å; I63-R89 HydrophobicContact CG2-CB 3.8Å; I63-R89 HydrophobicContact CG2-CG 4.06Å
64	Q	87.3	Confident	81.8	Confident	69 Å²	69	72.5 Å²	72.5	32%	0.322	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.5	-172.7	-62.5	-177.1	-19.3	0	0	112.5	I55 S56 K62 T76 F77 H78	I55-Q64 WeakPolarHBondContact CA-O 3.48Å; S56-Q64 PolarHBondContact N-O 2.95Å; S56-Q64 PolarHBondContact OG-N 3.43Å; S56-Q64 PolarHBondContact OG-O 2.94Å; K62-Q64 HydrophobicContact CB-CG 4.3Å; K62-Q64 PolarHBondContact O-N 2.71Å; Q64-T76 HydrophobicContact CB-CG2 4.12Å; Q64-T76 HydrophobicContact CG-CG2 4.42Å; Q64-F77 CarbonylContact C-O 3.54Å; Q64-F77 VanDerWaalsContact CA-O 3.23Å; Q64-F77 WeakPolarHBondContact CA-O 3.39Å; Q64-H78 HydrophobicContact CG-CB 4.09Å
65	L	89.6	Confident	81.9	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.8	168.9	176.7	74.4	0	0	0	108.2	Q53 K54 I55 F77 F79 A92 L96	Q53-L65 HydrophobicContact CB-CD1 4.18Å; K54-L65 CarbonylContact O-C 3.51Å; K54-L65 WeakPolarHBondContact O-CA 3.13Å; I55-L65 HydrophobicContact CG2-CD1 3.53Å; L65-F77 PolarHBondContact N-O 3.43Å; L65-F77 PolarHBondContact O-N 2.9Å; L65-F79 HydrophobicContact CB-CE2 3.58Å; L65-F79 HydrophobicContact CB-CZ 4.12Å; L65-F79 HydrophobicContact CD2-CZ 4.31Å; L65-A92 HydrophobicContact CD2-CB 4.5Å; L65-L96 HydrophobicContact CD2-CD1 3.84Å
66	Q	89.9	Confident	82	Confident	56 Å²	56	67.6 Å²	67.6	26%	0.262	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126	176.6	-175.8	-179	31.1	0	0	109.7	Q53 K54 S74 T75 T76	Q53-Q66 CarbonylContact C-O 3.6Å; Q53-Q66 WeakPolarHBondContact CA-O 3.38Å; K54-Q66 HydrophobicContact CB-CB 4.32Å; K54-Q66 PolarHBondContact N-O 2.7Å; K54-Q66 PolarHBondContact O-N 3.44Å; Q66-S74 PolarHBondContact NE2-OG 2.96Å; Q66-T75 CarbonylContact C-O 3.55Å; Q66-T75 WeakPolarHBondContact CA-O 3.35Å; Q66-T76 HydrophobicContact CB-CG2 4.48Å
67	L	89.8	Confident	82.3	Confident	0 Å²	0	67 Å²	67	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128	170.2	-56.6	179.9	0	0	0	108.7	I31 I50 Q53 S74 T75 F77 L96	I31-L67 HydrophobicContact CD1-CD1 4.13Å; I31-L67 HydrophobicContact CG2-CD1 3.77Å; I50-L67 HydrophobicContact CD1-CD1 3.95Å; I50-L67 HydrophobicContact CG2-CD2 4.33Å; Q53-L67 HydrophobicContact CB-CD2 4.04Å; L67-S74 CarbonylContact O-C 3.54Å; L67-S74 WeakPolarHBondContact O-CA 3.31Å; L67-T75 PolarHBondContact N-O 3.38Å; L67-T75 PolarHBondContact O-N 2.89Å; L67-F77 HydrophobicContact CD1-CD2 4.48Å; L67-F77 HydrophobicContact CD1-CE2 3.67Å; L67-F77 HydrophobicContact CG-CD2 4.46Å; L67-F77 HydrophobicContact CG-CE2 4.02Å; L67-L96 HydrophobicContact CD2-CD1 4.05Å
68	V	87.3	Confident	82.6	Confident	21 Å²	21	65.3 Å²	65.3	13%	0.127	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	121.5	173.5	-177.3	0	0	0	0	107.6	R51 C52 K54	R51-V68 WeakPolarHBondContact CB-O 3.5Å; R51-V68 PolarHBondContact N-O 3.33Å; C52-V68 PolarHBondContact N-O 2.94Å; C52-V68 PolarHBondContact O-N 3.37Å; K54-V68 HydrophobicContact CD-CG2 4.37Å
69	L	85.8	Confident	83.5	Confident	14 Å²	14	59.4 Å²	59.4	7%	0.073	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	162.7	178.4	-61.7	171.9	0	0	0	111.3	H45 D49 I50 T71 G72 D73	H45-L69 HydrophobicContact CB-CD2 4.27Å; D49-L69 HydrophobicContact CB-CD2 4.2Å; D49-L69 CarbonylContact O-C 3.57Å; D49-L69 VanDerWaalsContact O-CA 3.23Å; D49-L69 WeakPolarHBondContact O-CA 3.43Å; D49-L69 WeakPolarHBondContact O-CD2 3.23Å; I50-L69 HydrophobicContact CG1-CD2 3.93Å; L69-T71 PolarHBondContact O-N 3.09Å; L69-G72 PolarHBondContact O-N 3.39Å; L69-D73 HydrophobicContact CD1-CB 4.04Å; L69-D73 PolarHBondContact N-O 2.64Å
70	H	76.1	Confident	84.2	Confident	128 Å²	128	56.8 Å²	56.8	59%	0.593	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.6	172.7	-78.1	-74.2	0	0	0	113.3	D49 G72	D49-H70 PolarHBondContact O-CD2 3.11Å; D49-H70 PolarHBondContact O-N 3Å; H70-G72 PolarHBondContact O-N 2.74Å
71	T	75.8	Confident	84.3	Confident	106 Å²	106	51.8 Å²	51.8	65%	0.65	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-10.9	175.5	60.7	0	0	0	0	113.6	L69 D73	L69-T71 PolarHBondContact O-N 3.09Å; T71-D73 VanDerWaalsContact C-N 3.33Å; T71-D73 PolarHBondContact OG1-N 2.9Å; T71-D73 PolarHBondContact OG1-OD2 3.48Å
72	G	75.1	Confident	84.2	Confident	60 Å²	60	56.2 Å²	56.2	62%	0.619	31%	0.307	S	S	*	.	S	Bend	trans	91.9	-10.9	-172.7	0	0	0	0	0	113.8	L69 H70	L69-G72 PolarHBondContact O-N 3.39Å; H70-G72 PolarHBondContact O-N 2.74Å
73	D	83.9	Confident	83.9	Confident	106 Å²	106	54.6 Å²	54.6	57%	0.567	31%	0.314	S	S	*	.			trans	-68.8	147.4	174.1	-65.8	-46.7	0	0	0	111.3	L69 T71	L69-D73 HydrophobicContact CD1-CB 4.04Å; L69-D73 PolarHBondContact N-O 2.64Å; T71-D73 VanDerWaalsContact C-N 3.33Å; T71-D73 PolarHBondContact OG1-N 2.9Å; T71-D73 PolarHBondContact OG1-OD2 3.48Å
74	S	88.4	Confident	83.7	Confident	62 Å²	62	55.3 Å²	55.3	43%	0.434	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.2	175	69.2	0	0	0	0	112.1	Q66 L67	Q66-S74 PolarHBondContact NE2-OG 2.96Å; L67-S74 CarbonylContact O-C 3.54Å; L67-S74 WeakPolarHBondContact O-CA 3.31Å
75	T	89.2	Confident	83.2	Confident	17 Å²	17	52.4 Å²	52.4	10%	0.104	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.6	177.2	-54.7	0	0	0	0	109.3	Q17 V43 H45 Q66 L67 F77	Q17-T75 HydrophobicContact CG-CG2 4.31Å; V43-T75 HydrophobicContact CG1-CG2 4.12Å; H45-T75 PolarHBondContact NE2-OG1 3.41Å; Q66-T75 CarbonylContact C-O 3.55Å; Q66-T75 WeakPolarHBondContact CA-O 3.35Å; L67-T75 PolarHBondContact N-O 3.38Å; L67-T75 PolarHBondContact O-N 2.89Å; T75-F77 HydrophobicContact CG2-CE1 4.1Å; T75-F77 HydrophobicContact CG2-CE2 3.87Å; T75-F77 HydrophobicContact CG2-CZ 3.6Å
76	T	90.5	Very high	82.8	Confident	51 Å²	51	56.6 Å²	56.6	31%	0.313	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.7	179.8	-52	0	0	0	0	110.6	Q64 Q66	Q64-T76 HydrophobicContact CB-CG2 4.12Å; Q64-T76 HydrophobicContact CG-CG2 4.42Å; Q66-T76 HydrophobicContact CB-CG2 4.48Å
77	F	90.2	Very high	82.5	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.009	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	128.8	174.2	-60.1	-74.7	0	0	0	109.3	V15 Q17 L24 W33 V43 Q64 L65 L67 T75	V15-F77 HydrophobicContact CG1-CB 3.73Å; V15-F77 HydrophobicContact CG1-CD1 4.1Å; V15-F77 HydrophobicContact CG1-CG 4.33Å; Q17-F77 HydrophobicContact CB-CD1 4.38Å; Q17-F77 HydrophobicContact CG-CD1 4.25Å; Q17-F77 HydrophobicContact CG-CE1 4.1Å; L24-F77 HydrophobicContact CD1-CD1 3.93Å; L24-F77 HydrophobicContact CD1-CE1 3.72Å; L24-F77 HydrophobicContact CD1-CE2 4.36Å; L24-F77 HydrophobicContact CD1-CG 4.32Å; L24-F77 HydrophobicContact CD1-CZ 3.94Å; W33-F77 HydrophobicContact CB-CE1 3.78Å; W33-F77 HydrophobicContact CG-CD1 4.44Å; W33-F77 AromaticContact CG-CE1 4Å; W33-F77 HydrophobicContact CG-CE1 4Å; V43-F77 HydrophobicContact CG1-CZ 4.28Å; Q64-F77 CarbonylContact C-O 3.54Å; Q64-F77 VanDerWaalsContact CA-O 3.23Å; Q64-F77 WeakPolarHBondContact CA-O 3.39Å; L65-F77 PolarHBondContact N-O 3.43Å; L65-F77 PolarHBondContact O-N 2.9Å; L67-F77 HydrophobicContact CD1-CD2 4.48Å; L67-F77 HydrophobicContact CD1-CE2 3.67Å; L67-F77 HydrophobicContact CG-CD2 4.46Å; L67-F77 HydrophobicContact CG-CE2 4.02Å; T75-F77 HydrophobicContact CG2-CE1 4.1Å; T75-F77 HydrophobicContact CG2-CE2 3.87Å; T75-F77 HydrophobicContact CG2-CZ 3.6Å
78	H	88.7	Confident	82.2	Confident	44 Å²	44	63.7 Å²	63.7	20%	0.204	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.2	178.2	174.2	51.7	0	0	0	109.9	V15 R16 I63 Q64 A80	V15-H78 CarbonylContact C-O 3.54Å; V15-H78 WeakPolarHBondContact CA-O 3.38Å; R16-H78 HydrophobicContact CB-CB 4.11Å; R16-H78 PolarHBondContact N-O 3.44Å; R16-H78 PolarHBondContact O-N 3.21Å; I63-H78 WeakPolarHBondContact O-CA 3.4Å; I63-H78 PolarHBondContact O-ND1 3.24Å; Q64-H78 HydrophobicContact CG-CB 4.09Å; H78-A80 PolarHBondContact O-N 3.31Å
79	F	87.6	Confident	82.1	Confident	6 Å²	6	62.9 Å²	62.9	3%	0.026	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	113.8	-179.6	-61.4	-98.7	0	0	0	108.4	V12 V15 L24 I63 L65 A85 D88 R89 A92	V12-F79 HydrophobicContact CB-CE1 4.47Å; V12-F79 HydrophobicContact CG1-CD1 3.87Å; V12-F79 HydrophobicContact CG1-CE1 3.87Å; V15-F79 HydrophobicContact CG2-CD1 3.88Å; V15-F79 HydrophobicContact CG2-CE1 4.02Å; L24-F79 HydrophobicContact CD2-CZ 4.37Å; I63-F79 HydrophobicContact CB-CB 4.43Å; I63-F79 HydrophobicContact CG2-CB 4.06Å; I63-F79 HydrophobicContact CG2-CD2 4.18Å; I63-F79 HydrophobicContact CG2-CG 4.43Å; I63-F79 PolarHBondContact O-N 2.79Å; L65-F79 HydrophobicContact CB-CE2 3.58Å; L65-F79 HydrophobicContact CB-CZ 4.12Å; L65-F79 HydrophobicContact CD2-CZ 4.31Å; F79-A85 HydrophobicContact CB-CB 3.87Å; F79-D88 HydrophobicContact CD1-CB 4.26Å; F79-R89 HydrophobicContact CD2-CB 4.07Å; F79-R89 HydrophobicContact CD2-CG 4.35Å; F79-R89 HydrophobicContact CE2-CB 4.11Å; F79-R89 HydrophobicContact CE2-CG 4.15Å; F79-R89 HydrophobicContact CG-CB 4.36Å; F79-R89 HydrophobicContact CZ-CB 4.41Å; F79-A92 HydrophobicContact CZ-CB 4.39Å
80	A	81.8	Confident	82	Confident	32 Å²	32	64.7 Å²	64.7	26%	0.264	37%	0.366	S	S	.	.			trans	-104.3	15.6	-174	0	0	0	0	0	113	K14 R16 H78 E82	K14-A80 PolarHBondContact O-N 2.91Å; K14-A80 VanDerWaalsContact O-N 3.07Å; R16-A80 HydrophobicContact CG-CB 4.27Å; H78-A80 PolarHBondContact O-N 3.31Å; A80-E82 PolarHBondContact O-N 2.84Å
81	N	78.3	Confident	82.5	Confident	35 Å²	35	60.5 Å²	60.5	19%	0.187	35%	0.353	C	S	.	.			trans	-86.6	108.4	-177.6	-158.9	-1.5	0	0	0	111.5	S83 T84 A85	N81-S83 VanDerWaalsContact C-N 3.27Å; N81-S83 PolarHBondContact O-N 2.61Å; N81-S83 VanDerWaalsContact O-N 3.13Å; N81-T84 PolarHBondContact ND2-OG1 3.5Å; N81-A85 HydrophobicContact CB-CB 4.34Å; N81-A85 WeakPolarHBondContact O-CA 3.45Å; N81-A85 WeakPolarHBondContact O-CB 3.36Å; N81-A85 PolarHBondContact O-N 3.34Å
82	E	68.5	Low	82.9	Confident	201 Å²	201	55.5 Å²	55.5	94%	0.939	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.3	-168.1	-67.7	-179.2	164.8	0	0	114.9	A80	A80-E82 PolarHBondContact O-N 2.84Å
83	S	72.5	Confident	83.5	Confident	105 Å²	105	55.7 Å²	55.7	73%	0.734	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-25	-175.6	50.3	0	0	0	0	115.1	N81	N81-S83 VanDerWaalsContact C-N 3.27Å; N81-S83 PolarHBondContact O-N 2.61Å; N81-S83 VanDerWaalsContact O-N 3.13Å
84	T	80.9	Confident	83.7	Confident	47 Å²	47	56.5 Å²	56.5	29%	0.288	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	1	-176.2	64.4	0	0	0	0	115	N81 L86 K87 D88	N81-T84 PolarHBondContact ND2-OG1 3.5Å; T84-L86 VanDerWaalsContact C-N 3.29Å; T84-L86 PolarHBondContact O-N 2.85Å; T84-L86 VanDerWaalsContact O-N 3.12Å; T84-K87 PolarHBondContact O-N 2.74Å; T84-D88 WeakPolarHBondContact CB-OD2 3.48Å; T84-D88 VanDerWaalsContact O-CG 3.32Å; T84-D88 PolarHBondContact O-N 3.2Å; T84-D88 PolarHBondContact OG1-OD2 3.24Å
85	A	77.8	Confident	83.6	Confident	7 Å²	7	55.3 Å²	55.3	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-55.5	-36.3	-172.9	0	0	0	0	0	115	I63 F79 N81 R89	I63-A85 HydrophobicContact CD1-CB 3.53Å; F79-A85 HydrophobicContact CB-CB 3.87Å; N81-A85 HydrophobicContact CB-CB 4.34Å; N81-A85 WeakPolarHBondContact O-CA 3.45Å; N81-A85 WeakPolarHBondContact O-CB 3.36Å; N81-A85 PolarHBondContact O-N 3.34Å; A85-R89 VanDerWaalsContact O-CB 3.28Å; A85-R89 WeakPolarHBondContact O-CB 3.3Å; A85-R89 PolarHBondContact O-N 3.42Å
86	L	80.3	Confident	83.4	Confident	88 Å²	88	54.5 Å²	54.5	46%	0.461	29%	0.29	S	S	.	.	H	α-helix	trans	-67.9	-45.6	176.1	-77.9	169.9	0	0	0	111.6	I63 T84 R89 D90	I63-L86 HydrophobicContact CD1-CD2 3.9Å; I63-L86 HydrophobicContact CD1-CG 3.73Å; I63-L86 HydrophobicContact CG1-CD2 4.13Å; T84-L86 VanDerWaalsContact C-N 3.29Å; T84-L86 PolarHBondContact O-N 2.85Å; T84-L86 VanDerWaalsContact O-N 3.12Å; L86-R89 PolarHBondContact O-N 3.4Å; L86-D90 WeakPolarHBondContact O-CB 3.23Å; L86-D90 VanDerWaalsContact O-CG 3.29Å; L86-D90 PolarHBondContact O-N 3.24Å
87	K	83.1	Confident	83.1	Confident	164 Å²	164	57.5 Å²	57.5	71%	0.713	30%	0.3	S	S	*	.	H	α-helix	trans	-64	-42.7	178	-66.9	-175.2	179	-179	0	111.5	T84 D90 A91	T84-K87 PolarHBondContact O-N 2.74Å; K87-D90 PolarHBondContact O-N 3.32Å; K87-A91 WeakPolarHBondContact O-CB 3.39Å; K87-A91 PolarHBondContact O-N 3.45Å
88	D	84.9	Confident	82.8	Confident	41 Å²	41	63.3 Å²	63.3	22%	0.219	33%	0.328	C	S	.	.	H	α-helix	trans	-68	-38.5	180	-64.8	-22.7	0	0	0	111.8	V12 F79 T84 A92	V12-D88 HydrophobicContact CG1-CB 3.66Å; V12-D88 HydrophobicContact CG2-CB 4.45Å; F79-D88 HydrophobicContact CD1-CB 4.26Å; T84-D88 WeakPolarHBondContact CB-OD2 3.48Å; T84-D88 VanDerWaalsContact O-CG 3.32Å; T84-D88 PolarHBondContact O-N 3.2Å; T84-D88 PolarHBondContact OG1-OD2 3.24Å; D88-A92 WeakPolarHBondContact O-CB 3.4Å; D88-A92 PolarHBondContact O-N 2.98Å; D88-A92 VanDerWaalsContact O-N 3.07Å
89	R	84.1	Confident	82.5	Confident	5 Å²	5	62.2 Å²	62.2	2%	0.019	32%	0.323	C	S	.	.	H	α-helix	trans	-59.8	-49.2	171.2	178.6	-154.4	64.2	-173.2	-8.2	110.5	I55 S56 D58 I63 F79 A85 L86 A92 K93	I55-R89 HydrophobicContact CG2-CG 4.36Å; S56-R89 PolarHBondContact O-NH1 3.03Å; D58-R89 IonicContact OD1-CZ 2.67Å; D58-R89 IonicContact OD1-NH1 2.68Å; D58-R89 PolarHBondContact OD1-NH1 3.32Å; D58-R89 IonicContact OD1-NH2 3.93Å; D58-R89 PolarHBondContact OD1-NH2 3.3Å; I63-R89 HydrophobicContact CG2-CB 3.8Å; I63-R89 HydrophobicContact CG2-CG 4.06Å; F79-R89 HydrophobicContact CD2-CB 4.07Å; F79-R89 HydrophobicContact CD2-CG 4.35Å; F79-R89 HydrophobicContact CE2-CB 4.11Å; F79-R89 HydrophobicContact CE2-CG 4.15Å; F79-R89 HydrophobicContact CG-CB 4.36Å; F79-R89 HydrophobicContact CZ-CB 4.41Å; A85-R89 VanDerWaalsContact O-CB 3.28Å; A85-R89 WeakPolarHBondContact O-CB 3.3Å; A85-R89 PolarHBondContact O-N 3.42Å; L86-R89 PolarHBondContact O-N 3.4Å; R89-A92 PolarHBondContact O-N 2.95Å; R89-K93 WeakPolarHBondContact O-CB 3.39Å; R89-K93 PolarHBondContact O-N 3.23Å
90	D	84.8	Confident	82.2	Confident	52 Å²	52	63.1 Å²	63.1	28%	0.278	33%	0.328	S	S	.	.	H	α-helix	trans	-70.4	-38.7	-174	-70.3	-24.9	0	0	0	112	L86 K87 K93 E94	L86-D90 WeakPolarHBondContact O-CB 3.23Å; L86-D90 VanDerWaalsContact O-CG 3.29Å; L86-D90 PolarHBondContact O-N 3.24Å; K87-D90 PolarHBondContact O-N 3.32Å; D90-K93 WeakPolarHBondContact O-CB 3.13Å; D90-K93 PolarHBondContact O-N 3.44Å; D90-E94 WeakPolarHBondContact O-CB 3.42Å; D90-E94 WeakPolarHBondContact O-CG 3.39Å; D90-E94 PolarHBondContact O-N 3.34Å
91	A	85.6	Confident	82	Confident	40 Å²	40	64.6 Å²	64.6	33%	0.331	34%	0.335	S	S	.	.	H	α-helix	trans	-60.8	-45.1	171.4	0	0	0	0	0	112.1	L10 K87 E94 L95	L10-A91 HydrophobicContact CD2-CB 4.01Å; K87-A91 WeakPolarHBondContact O-CB 3.39Å; K87-A91 PolarHBondContact O-N 3.45Å; A91-E94 PolarHBondContact O-N 2.98Å; A91-L95 WeakPolarHBondContact O-CB 3.24Å; A91-L95 PolarHBondContact O-N 3.04Å
92	A	85.3	Confident	81.9	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-64.2	-40.9	176	0	0	0	0	0	112	L10 L26 L65 F79 D88 R89 L96	L10-A92 HydrophobicContact CD2-CB 4.26Å; L26-A92 HydrophobicContact CD1-CB 4.15Å; L65-A92 HydrophobicContact CD2-CB 4.5Å; F79-A92 HydrophobicContact CZ-CB 4.39Å; D88-A92 WeakPolarHBondContact O-CB 3.4Å; D88-A92 PolarHBondContact O-N 2.98Å; D88-A92 VanDerWaalsContact O-N 3.07Å; R89-A92 PolarHBondContact O-N 2.95Å; A92-L96 WeakPolarHBondContact O-CB 3.42Å; A92-L96 WeakPolarHBondContact O-CD1 3.38Å; A92-L96 VanDerWaalsContact O-CG 3.24Å; A92-L96 WeakPolarHBondContact O-CG 3.26Å; A92-L96 PolarHBondContact O-N 2.96Å
93	K	87.5	Confident	82	Confident	64 Å²	64	62.3 Å²	62.3	28%	0.278	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-48.3	176.1	176.1	-150.2	179.4	-175.9	0	111.5	Q53 I55 R89 D90 L96 Q97	Q53-K93 PolarHBondContact NE2-O 2.87Å; I55-K93 HydrophobicContact CD1-CD 3.9Å; I55-K93 HydrophobicContact CG2-CB 4.29Å; I55-K93 HydrophobicContact CG2-CD 4.36Å; I55-K93 HydrophobicContact CG2-CG 4.12Å; R89-K93 WeakPolarHBondContact O-CB 3.39Å; R89-K93 PolarHBondContact O-N 3.23Å; D90-K93 WeakPolarHBondContact O-CB 3.13Å; D90-K93 PolarHBondContact O-N 3.44Å; K93-L96 PolarHBondContact O-N 3.37Å; K93-Q97 VanDerWaalsContact O-CB 3.24Å; K93-Q97 WeakPolarHBondContact O-CB 3.48Å; K93-Q97 PolarHBondContact O-N 3.34Å
94	E	88.3	Confident	81.9	Confident	123 Å²	123	64 Å²	64	58%	0.575	32%	0.315	S	S	*	.	H	α-helix	trans	-64.1	-44.7	-179.1	-77.4	-170.4	165.9	0	0	111.6	D90 A91 L96 Q97 Q98	D90-E94 WeakPolarHBondContact O-CB 3.42Å; D90-E94 WeakPolarHBondContact O-CG 3.39Å; D90-E94 PolarHBondContact O-N 3.34Å; A91-E94 PolarHBondContact O-N 2.98Å; E94-L96 PolarHBondContact O-N 3.39Å; E94-Q97 WeakPolarHBondContact O-CB 3.4Å; E94-Q97 PolarHBondContact O-N 3.37Å; E94-Q97 VanDerWaalsContact O-N 3.12Å; E94-Q98 WeakPolarHBondContact O-CG 3.49Å; E94-Q98 PolarHBondContact O-N 3.02Å
95	L	85.4	Confident	81.1	Confident	37 Å²	37	69.4 Å²	69.4	19%	0.194	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-46.1	177.8	-174.5	61.5	0	0	0	111.3	L9 L10 L26 A91 Q97 Q98 L99	L9-L95 HydrophobicContact CB-CD2 3.84Å; L9-L95 HydrophobicContact CD1-CD1 4.49Å; L10-L95 HydrophobicContact CB-CD2 3.65Å; L10-L95 HydrophobicContact CD2-CD2 4.41Å; L26-L95 HydrophobicContact CB-CD2 3.99Å; L26-L95 HydrophobicContact CD2-CD2 4.18Å; A91-L95 WeakPolarHBondContact O-CB 3.24Å; A91-L95 PolarHBondContact O-N 3.04Å; L95-Q97 VanDerWaalsContact C-N 3.3Å; L95-Q97 PolarHBondContact O-N 3.22Å; L95-Q98 PolarHBondContact O-N 3.42Å; L95-L99 HydrophobicContact CD1-CD1 4.11Å; L95-L99 HydrophobicContact CD1-CG 4.4Å; L95-L99 HydrophobicContact CG-CD1 3.92Å; L95-L99 VanDerWaalsContact O-CG 3.3Å; L95-L99 WeakPolarHBondContact O-CG 3.43Å; L95-L99 PolarHBondContact O-N 2.9Å
96	L	84.9	Confident	80.6	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.6	-36.6	173.7	-74.7	170.2	0	0	0	112.3	L26 I31 Y47 L65 L67 A92 K93 E94 Q98 L99 L100	L26-L96 HydrophobicContact CD2-CD1 4.12Å; L26-L96 HydrophobicContact CD2-CD2 3.68Å; L26-L96 HydrophobicContact CD2-CG 3.55Å; I31-L96 HydrophobicContact CD1-CD1 4.27Å; I31-L96 HydrophobicContact CD1-CD2 4.37Å; Y47-L96 HydrophobicContact CD1-CD2 3.97Å; Y47-L96 HydrophobicContact CE1-CD2 3.44Å; Y47-L96 VanDerWaalsContact CE1-CD2 3.44Å; L65-L96 HydrophobicContact CD2-CD1 3.84Å; L67-L96 HydrophobicContact CD2-CD1 4.05Å; A92-L96 WeakPolarHBondContact O-CB 3.42Å; A92-L96 WeakPolarHBondContact O-CD1 3.38Å; A92-L96 VanDerWaalsContact O-CG 3.24Å; A92-L96 WeakPolarHBondContact O-CG 3.26Å; A92-L96 PolarHBondContact O-N 2.96Å; K93-L96 PolarHBondContact O-N 3.37Å; E94-L96 PolarHBondContact O-N 3.39Å; L96-Q98 VanDerWaalsContact C-N 3.26Å; L96-Q98 PolarHBondContact O-N 2.93Å; L96-L99 PolarHBondContact O-N 3.44Å; L96-L100 HydrophobicContact CB-CD1 4.24Å; L96-L100 VanDerWaalsContact O-CB 3.26Å; L96-L100 WeakPolarHBondContact O-CB 3.35Å; L96-L100 WeakPolarHBondContact O-CD1 3.1Å; L96-L100 WeakPolarHBondContact O-CG 3.36Å; L96-L100 PolarHBondContact O-N 2.85Å
97	Q	85	Confident	79.6	Confident	114 Å²	114	72.9 Å²	72.9	53%	0.533	35%	0.353	S	S	.	.	H	α-helix	trans	-67.3	-26.9	177.3	-171.4	168	-3.9	0	0	112.4	K93 E94 L95 P101	K93-Q97 VanDerWaalsContact O-CB 3.24Å; K93-Q97 WeakPolarHBondContact O-CB 3.48Å; K93-Q97 PolarHBondContact O-N 3.34Å; E94-Q97 WeakPolarHBondContact O-CB 3.4Å; E94-Q97 PolarHBondContact O-N 3.37Å; E94-Q97 VanDerWaalsContact O-N 3.12Å; L95-Q97 VanDerWaalsContact C-N 3.3Å; L95-Q97 PolarHBondContact O-N 3.22Å; Q97-P101 WeakPolarHBondContact O-CD 3.48Å; Q97-P101 WeakPolarHBondContact O-CG 3.35Å
98	Q	83.8	Confident	78.8	Confident	124 Å²	124	69 Å²	69	58%	0.579	34%	0.34	S	S	*	.	H	α-helix	trans	-81.5	-37.9	171.9	-68.4	-179.3	5	0	0	112.9	E94 L95 L96 K102	E94-Q98 WeakPolarHBondContact O-CG 3.49Å; E94-Q98 PolarHBondContact O-N 3.02Å; L95-Q98 PolarHBondContact O-N 3.42Å; L96-Q98 VanDerWaalsContact C-N 3.26Å; L96-Q98 PolarHBondContact O-N 2.93Å; Q98-K102 WeakPolarHBondContact O-CG 3.32Å
99	L	82.3	Confident	78.2	Confident	21 Å²	21	74.3 Å²	74.3	11%	0.11	36%	0.362	C	S	.	.	H	α-helix	trans	-78.9	-46.5	-176.1	-65.9	173.9	0	0	0	112.4	L9 Y47 L95 L96 K102 F103	L9-L99 HydrophobicContact CD1-CD1 3.76Å; L9-L99 HydrophobicContact CD1-CD2 4.36Å; Y47-L99 HydrophobicContact CD2-CD1 4.49Å; Y47-L99 HydrophobicContact CE2-CB 4.49Å; Y47-L99 HydrophobicContact CE2-CD1 3.7Å; L95-L99 HydrophobicContact CD1-CD1 4.11Å; L95-L99 HydrophobicContact CD1-CG 4.4Å; L95-L99 HydrophobicContact CG-CD1 3.92Å; L95-L99 VanDerWaalsContact O-CG 3.3Å; L95-L99 WeakPolarHBondContact O-CG 3.43Å; L95-L99 PolarHBondContact O-N 2.9Å; L96-L99 PolarHBondContact O-N 3.44Å; L99-K102 WeakPolarHBondContact O-CB 3.36Å; L99-K102 PolarHBondContact O-N 3.39Å; L99-F103 HydrophobicContact CB-CD2 4.32Å; L99-F103 HydrophobicContact CB-CE2 4.29Å; L99-F103 HydrophobicContact CD2-CE2 4.34Å; L99-F103 VanDerWaalsContact O-CD2 3.24Å; L99-F103 WeakPolarHBondContact O-CD2 3.34Å; L99-F103 PolarHBondContact O-N 3.42Å; L99-F103 VanDerWaalsContact O-N 3.08Å
100	L	80.6	Confident	77.5	Confident	25 Å²	25	78.8 Å²	78.8	13%	0.131	38%	0.383	C	S	.	.	H	α-helix	trans	-54.7	-44.1	-176.1	-70.1	167.1	0	0	0	113.4	I50 Q53 L96 K102 F103 K104	I50-L100 HydrophobicContact CB-CD2 3.7Å; I50-L100 HydrophobicContact CD1-CD2 4.45Å; I50-L100 HydrophobicContact CG2-CD1 4.32Å; I50-L100 HydrophobicContact CG2-CD2 3.68Å; Q53-L100 HydrophobicContact CG-CD1 4.4Å; L96-L100 HydrophobicContact CB-CD1 4.24Å; L96-L100 VanDerWaalsContact O-CB 3.26Å; L96-L100 WeakPolarHBondContact O-CB 3.35Å; L96-L100 WeakPolarHBondContact O-CD1 3.1Å; L96-L100 WeakPolarHBondContact O-CG 3.36Å; L96-L100 PolarHBondContact O-N 2.85Å; L100-K102 PolarHBondContact O-N 3.4Å; L100-F103 PolarHBondContact O-N 3.01Å; L100-K104 VanDerWaalsContact O-CB 3.26Å; L100-K104 WeakPolarHBondContact O-CB 3.48Å; L100-K104 PolarHBondContact O-N 3.01Å
101	P	79.1	Confident	76.9	Confident	63 Å²	63	80.9 Å²	80.9	41%	0.409	39%	0.393	S	S	.	.	H	α-helix	trans	-66.2	-34.4	176.2	-21.9	34.8	0	0	0	113.5	Q97 K104 K105	Q97-P101 WeakPolarHBondContact O-CD 3.48Å; Q97-P101 WeakPolarHBondContact O-CG 3.35Å; P101-K104 PolarHBondContact O-N 3.23Å; P101-K105 WeakPolarHBondContact O-CB 3.37Å; P101-K105 WeakPolarHBondContact O-CG 3.41Å; P101-K105 PolarHBondContact O-N 2.84Å
102	K	75.6	Confident	76.3	Confident	142 Å²	142	85.5 Å²	85.5	62%	0.617	41%	0.408	S	S	*	.	H	α-helix	trans	-65.5	-45.8	177.9	-70.3	-179.3	179.6	-179.9	0	110.7	Q98 L99 L100 K105 K106	Q98-K102 WeakPolarHBondContact O-CG 3.32Å; L99-K102 WeakPolarHBondContact O-CB 3.36Å; L99-K102 PolarHBondContact O-N 3.39Å; L100-K102 PolarHBondContact O-N 3.4Å; K102-K105 PolarHBondContact O-N 3.11Å; K102-K106 PolarHBondContact O-N 3.34Å
103	F	71.4	Confident	75.7	Confident	47 Å²	47	88.2 Å²	88.2	21%	0.206	42%	0.421	C	S	.	.	H	α-helix	trans	-69.4	-37.4	176.5	-73	-78	0	0	0	112.3	A28 Y47 L99 L100 K105 K106 A107	A28-F103 WeakPolarHBondContact O-CZ 3.4Å; Y47-F103 AromaticContact CD2-CD2 3.82Å; Y47-F103 HydrophobicContact CD2-CD2 3.82Å; Y47-F103 AromaticContact CD2-CE2 3.44Å; Y47-F103 HydrophobicContact CD2-CE2 3.44Å; Y47-F103 VanDerWaalsContact CD2-CE2 3.44Å; Y47-F103 AromaticContact CD2-CZ 3.99Å; Y47-F103 HydrophobicContact CD2-CZ 3.99Å; Y47-F103 HydrophobicContact CE2-CE2 4.25Å; Y47-F103 HydrophobicContact CG-CD2 4.07Å; Y47-F103 HydrophobicContact CG-CE2 4.17Å; L99-F103 HydrophobicContact CB-CD2 4.32Å; L99-F103 HydrophobicContact CB-CE2 4.29Å; L99-F103 HydrophobicContact CD2-CE2 4.34Å; L99-F103 VanDerWaalsContact O-CD2 3.24Å; L99-F103 WeakPolarHBondContact O-CD2 3.34Å; L99-F103 PolarHBondContact O-N 3.42Å; L99-F103 VanDerWaalsContact O-N 3.08Å; L100-F103 PolarHBondContact O-N 3.01Å; F103-K105 PolarHBondContact O-N 3.09Å; F103-K106 PolarHBondContact O-N 3.14Å; F103-A107 WeakPolarHBondContact O-CB 3.5Å; F103-A107 PolarHBondContact O-N 3.38Å
104	K	69.4	Low	75.3	Confident	141 Å²	141	87.7 Å²	87.7	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-62.8	-40.8	172.5	-171	176.7	-179.4	-179.1	0	112.5	L100 P101 N108	L100-K104 VanDerWaalsContact O-CB 3.26Å; L100-K104 WeakPolarHBondContact O-CB 3.48Å; L100-K104 PolarHBondContact O-N 3.01Å; P101-K104 PolarHBondContact O-N 3.23Å; K104-N108 WeakPolarHBondContact O-CB 3.17Å; K104-N108 PolarHBondContact O-N 3.04Å
105	K	65.1	Low	74.7	Confident	160 Å²	160	85.6 Å²	85.6	70%	0.696	41%	0.411	S	S	*	.	H	α-helix	trans	-63.9	-42.1	173.4	-79.9	-177.2	-179.9	-175	0	111.7	P101 K102 F103 N108 K109	P101-K105 WeakPolarHBondContact O-CB 3.37Å; P101-K105 WeakPolarHBondContact O-CG 3.41Å; P101-K105 PolarHBondContact O-N 2.84Å; K102-K105 PolarHBondContact O-N 3.11Å; F103-K105 PolarHBondContact O-N 3.09Å; K105-N108 PolarHBondContact O-N 3.48Å; K105-K109 VanDerWaalsContact O-CB 3.3Å; K105-K109 WeakPolarHBondContact O-CB 3.38Å; K105-K109 PolarHBondContact O-N 2.85Å
106	K	65.6	Low	74.4	Confident	120 Å²	120	88.7 Å²	88.7	52%	0.522	42%	0.42	S	S	.	.	H	α-helix	trans	-62.7	-47.8	176.6	-173.4	178.6	176.7	-175.5	0	111.4	K102 F103 N108 K109 E110	K102-K106 PolarHBondContact O-N 3.34Å; F103-K106 PolarHBondContact O-N 3.14Å; K106-N108 PolarHBondContact O-N 3.06Å; K106-K109 PolarHBondContact O-N 3.14Å; K106-E110 PolarHBondContact O-N 2.95Å
107	A	60.7	Low	74.1	Confident	48 Å²	48	91.5 Å²	91.5	40%	0.397	43%	0.434	S	S	.	.	H	α-helix	trans	-61.9	-42.5	176.6	0	0	0	0	0	112.4	F103 E110 L111	F103-A107 WeakPolarHBondContact O-CB 3.5Å; F103-A107 PolarHBondContact O-N 3.38Å; A107-E110 PolarHBondContact O-N 3.2Å; A107-L111 WeakPolarHBondContact O-CB 3.29Å; A107-L111 PolarHBondContact O-N 3.42Å
108	N	65.7	Low	74	Confident	83 Å²	83	86.7 Å²	86.7	44%	0.444	41%	0.412	S	S	.	.	H	α-helix	trans	-64.8	-39.4	175.1	-79.4	-1.7	0	0	0	112.3	K104 K105 K106 L111 E112	K104-N108 WeakPolarHBondContact O-CB 3.17Å; K104-N108 PolarHBondContact O-N 3.04Å; K105-N108 PolarHBondContact O-N 3.48Å; K106-N108 PolarHBondContact O-N 3.06Å; N108-L111 PolarHBondContact O-N 3.08Å; N108-E112 WeakPolarHBondContact O-CB 3.27Å; N108-E112 PolarHBondContact O-N 2.52Å
109	K	72.2	Confident	73.9	Confident	152 Å²	152	88.5 Å²	88.5	66%	0.661	42%	0.42	S	S	*	.	H	α-helix	trans	-63.7	-41.7	176.8	-172.5	-179.9	-179.1	-177.1	0	111.7	K105 K106 L111 E113	K105-K109 VanDerWaalsContact O-CB 3.3Å; K105-K109 WeakPolarHBondContact O-CB 3.38Å; K105-K109 PolarHBondContact O-N 2.85Å; K106-K109 PolarHBondContact O-N 3.14Å; K109-L111 VanDerWaalsContact C-N 3.33Å; K109-E113 WeakPolarHBondContact O-CB 3.37Å; K109-E113 PolarHBondContact O-N 3.29Å
110	E	70.1	Confident	73.9	Confident	99 Å²	99	92.3 Å²	92.3	46%	0.463	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-36.9	174.4	-73.1	179.6	-164.8	0	0	112.3	K106 A107 K114	K106-E110 PolarHBondContact O-N 2.95Å; A107-E110 PolarHBondContact O-N 3.2Å; E110-K114 VanDerWaalsContact O-CG 3.28Å; E110-K114 WeakPolarHBondContact O-CG 3.37Å; E110-K114 PolarHBondContact O-N 2.85Å
111	L	71.1	Confident	74	Confident	96 Å²	96	93.9 Å²	93.9	50%	0.503	45%	0.446	S	S	.	.	H	α-helix	trans	-70.4	-42.2	176.8	-172.8	65.5	0	0	0	112.1	A107 N108 K109 E113 K114 N115	A107-L111 WeakPolarHBondContact O-CB 3.29Å; A107-L111 PolarHBondContact O-N 3.42Å; N108-L111 PolarHBondContact O-N 3.08Å; K109-L111 VanDerWaalsContact C-N 3.33Å; L111-E113 VanDerWaalsContact C-N 3.32Å; L111-K114 PolarHBondContact O-N 3.49Å; L111-N115 WeakPolarHBondContact O-CB 3.22Å; L111-N115 PolarHBondContact O-N 2.92Å
112	E	73.7	Confident	74.3	Confident	136 Å²	136	95.4 Å²	95.4	64%	0.636	46%	0.456	S	S	*	.	H	α-helix	trans	-60.8	-41.8	173	-83.7	178.7	160.8	0	0	111.4	N108 N115 R116	N108-E112 WeakPolarHBondContact O-CB 3.27Å; N108-E112 PolarHBondContact O-N 2.52Å; E112-N115 PolarHBondContact O-N 3Å; E112-R116 WeakPolarHBondContact O-CB 3.32Å; E112-R116 PolarHBondContact O-N 2.92Å
113	E	72.9	Confident	74.6	Confident	58 Å²	58	91.9 Å²	91.9	27%	0.271	45%	0.447	S	S	.	.	H	α-helix	trans	-62.6	-46.8	176.6	-176.2	61.3	-139.5	0	0	111.6	K109 L111 N115 R116 M117	K109-E113 WeakPolarHBondContact O-CB 3.37Å; K109-E113 PolarHBondContact O-N 3.29Å; L111-E113 VanDerWaalsContact C-N 3.32Å; E113-N115 VanDerWaalsContact C-N 3.3Å; E113-N115 PolarHBondContact O-N 3.39Å; E113-R116 PolarHBondContact O-N 3.28Å; E113-R116 IonicContact OE1-CZ 2.74Å; E113-R116 IonicContact OE1-NE 3.04Å; E113-R116 IonicContact OE1-NH2 3.47Å; E113-R116 PolarHBondContact OE1-NH2 3.35Å; E113-R116 IonicContact OE2-CZ 3.37Å; E113-R116 IonicContact OE2-NE 3.29Å; E113-R116 IonicContact OE2-NH1 3.95Å; E113-R116 IonicContact OE2-NH2 3.16Å; E113-R116 PolarHBondContact OE2-NH2 2.83Å; E113-M117 HydrophobicContact CG-CE 4.04Å; E113-M117 WeakPolarHBondContact O-CG 3.4Å; E113-M117 PolarHBondContact O-N 3.2Å; E113-M117 WeakPolarHBondContact OE1-CE 3.45Å
114	K	78.6	Confident	75.2	Confident	52 Å²	52	90 Å²	90	23%	0.226	44%	0.438	C	S	.	.	H	α-helix	trans	-58.3	-43.5	174.4	-74.7	169.2	-179.9	170.3	0	111.3	E110 L111 M117 L118 W143	E110-K114 VanDerWaalsContact O-CG 3.28Å; E110-K114 WeakPolarHBondContact O-CG 3.37Å; E110-K114 PolarHBondContact O-N 2.85Å; L111-K114 PolarHBondContact O-N 3.49Å; K114-M117 PolarHBondContact O-N 2.88Å; K114-L118 WeakPolarHBondContact O-CG 3.33Å; K114-L118 PolarHBondContact O-N 3.37Å; K114-L118 VanDerWaalsContact O-N 3.12Å; K114-W143 HydrophobicContact CB-CD2 4.42Å; K114-W143 HydrophobicContact CB-CH2 3.97Å; K114-W143 HydrophobicContact CB-CZ2 3.65Å; K114-W143 HydrophobicContact CB-CZ3 4.48Å; K114-W143 HydrophobicContact CD-CD2 3.88Å; K114-W143 HydrophobicContact CD-CG 3.88Å; K114-W143 HydrophobicContact CG-CD2 3.79Å; K114-W143 HydrophobicContact CG-CE3 3.99Å; K114-W143 HydrophobicContact CG-CG 4.33Å; K114-W143 HydrophobicContact CG-CH2 4.12Å; K114-W143 HydrophobicContact CG-CZ2 3.94Å; K114-W143 HydrophobicContact CG-CZ3 4.14Å
115	N	76.1	Confident	76	Confident	79 Å²	79	88.2 Å²	88.2	42%	0.422	43%	0.431	S	S	.	.	H	α-helix	trans	-66.5	-37.6	176.9	-74.9	-18.2	0	0	0	112.5	L111 E112 E113 L118 Q119	L111-N115 WeakPolarHBondContact O-CB 3.22Å; L111-N115 PolarHBondContact O-N 2.92Å; E112-N115 PolarHBondContact O-N 3Å; E113-N115 VanDerWaalsContact C-N 3.3Å; E113-N115 PolarHBondContact O-N 3.39Å; N115-L118 PolarHBondContact O-N 2.91Å; N115-Q119 WeakPolarHBondContact O-CG 3.33Å; N115-Q119 PolarHBondContact O-N 3.33Å
116	R	79.6	Confident	76.9	Confident	102 Å²	102	82.9 Å²	82.9	39%	0.385	41%	0.408	S	S	.	.	H	α-helix	trans	-63.6	-46	174.7	-172	-177.9	70.5	-162.5	-0.8	111.3	E112 E113 L118 Q119 E120	E112-R116 WeakPolarHBondContact O-CB 3.32Å; E112-R116 PolarHBondContact O-N 2.92Å; E113-R116 PolarHBondContact O-N 3.28Å; E113-R116 IonicContact OE1-CZ 2.74Å; E113-R116 IonicContact OE1-NE 3.04Å; E113-R116 IonicContact OE1-NH2 3.47Å; E113-R116 PolarHBondContact OE1-NH2 3.35Å; E113-R116 IonicContact OE2-CZ 3.37Å; E113-R116 IonicContact OE2-NE 3.29Å; E113-R116 IonicContact OE2-NH1 3.95Å; E113-R116 IonicContact OE2-NH2 3.16Å; E113-R116 PolarHBondContact OE2-NH2 2.83Å; R116-L118 VanDerWaalsContact C-N 3.25Å; R116-L118 PolarHBondContact O-N 2.91Å; R116-Q119 WeakPolarHBondContact O-CB 3.2Å; R116-Q119 PolarHBondContact O-N 3.48Å; R116-E120 WeakPolarHBondContact CD-OE1 3.18Å; R116-E120 HydrophobicContact CG-CG 4.28Å; R116-E120 WeakPolarHBondContact CG-OE1 3.5Å; R116-E120 IonicContact NE-OE1 2.66Å; R116-E120 WeakPolarHBondContact O-CG 3.4Å; R116-E120 PolarHBondContact O-N 3.22Å
117	M	77.2	Confident	77.9	Confident	59 Å²	59	77.8 Å²	77.8	29%	0.291	39%	0.387	S	S	.	.	H	α-helix	trans	-58.7	-38.1	176.1	-71.1	-176	-178.7	0	0	112.3	E113 K114 Q119 D121 L124 W143	E113-M117 HydrophobicContact CG-CE 4.04Å; E113-M117 WeakPolarHBondContact O-CG 3.4Å; E113-M117 PolarHBondContact O-N 3.2Å; E113-M117 WeakPolarHBondContact OE1-CE 3.45Å; K114-M117 PolarHBondContact O-N 2.88Å; M117-Q119 VanDerWaalsContact C-N 3.35Å; M117-D121 PolarHBondContact O-N 2.99Å; M117-L124 HydrophobicContact CB-CD2 4.39Å; M117-W143 HydrophobicContact CB-CH2 4.42Å; M117-W143 HydrophobicContact SD-CZ3 4.27Å
118	L	83.3	Confident	79.1	Confident	14 Å²	14	78 Å²	78	7%	0.073	38%	0.378	C	S	.	.	H	α-helix	trans	-69.8	-30.1	174.6	-67.8	178.9	0	0	0	112.8	K114 N115 R116 L124 F125 Y128 W143	K114-L118 WeakPolarHBondContact O-CG 3.33Å; K114-L118 PolarHBondContact O-N 3.37Å; K114-L118 VanDerWaalsContact O-N 3.12Å; N115-L118 PolarHBondContact O-N 2.91Å; R116-L118 VanDerWaalsContact C-N 3.25Å; R116-L118 PolarHBondContact O-N 2.91Å; L118-L124 HydrophobicContact CD2-CD2 4.11Å; L118-L124 HydrophobicContact CD2-CG 3.9Å; L118-F125 HydrophobicContact CB-CD2 4.12Å; L118-F125 WeakPolarHBondContact O-CB 3.12Å; L118-Y128 HydrophobicContact CD1-CD1 4.21Å; L118-Y128 HydrophobicContact CD1-CE1 4.49Å; L118-Y128 HydrophobicContact CD1-CG 4.25Å; L118-Y128 HydrophobicContact CD2-CG 4.16Å; L118-W143 HydrophobicContact CD1-CZ2 3.95Å; L118-W143 HydrophobicContact CD2-CH2 4.04Å; L118-W143 HydrophobicContact CD2-CZ2 4.03Å; L118-W143 HydrophobicContact CG-CH2 4Å; L118-W143 HydrophobicContact CG-CZ2 3.87Å
119	Q	81.1	Confident	80.1	Confident	161 Å²	161	78.9 Å²	78.9	75%	0.752	38%	0.378	S	S	*	.	H	α-helix	trans	-77.5	-36.9	176.6	-75.6	176.7	-11.4	0	0	112.8	N115 R116 M117	N115-Q119 WeakPolarHBondContact O-CG 3.33Å; N115-Q119 PolarHBondContact O-N 3.33Å; R116-Q119 WeakPolarHBondContact O-CB 3.2Å; R116-Q119 PolarHBondContact O-N 3.48Å; M117-Q119 VanDerWaalsContact C-N 3.35Å
120	E	83.4	Confident	80.6	Confident	101 Å²	101	72.4 Å²	72.4	47%	0.472	35%	0.35	S	S	.	.	H	α-helix	trans	-72.7	-32.9	-179.4	-72.7	176.8	-174.4	0	0	112.7	R116 P122 Y158	R116-E120 WeakPolarHBondContact CD-OE1 3.18Å; R116-E120 HydrophobicContact CG-CG 4.28Å; R116-E120 WeakPolarHBondContact CG-OE1 3.5Å; R116-E120 IonicContact NE-OE1 2.66Å; R116-E120 WeakPolarHBondContact O-CG 3.4Å; R116-E120 PolarHBondContact O-N 3.22Å; E120-P122 WeakPolarHBondContact O-CD 3.43Å; E120-Y158 PolarHBondContact OE2-OH 3.15Å
121	D	82.1	Confident	81.3	Confident	58 Å²	58	67.8 Å²	67.8	31%	0.31	33%	0.329	S	S	.	.			trans	-116.2	99	-179.4	-176.1	-8.5	0	0	0	111.8	M117 V123 L124 F125	M117-D121 PolarHBondContact O-N 2.99Å; D121-V123 VanDerWaalsContact C-N 3.25Å; D121-V123 PolarHBondContact O-N 3.39Å; D121-V123 WeakPolarHBondContact OD1-CB 3.38Å; D121-V123 PolarHBondContact OD1-N 2.92Å; D121-L124 HydrophobicContact CB-CB 3.73Å; D121-L124 HydrophobicContact CB-CD2 4.44Å; D121-L124 VanDerWaalsContact CG-CB 3.44Å; D121-L124 WeakPolarHBondContact O-CB 3.22Å; D121-L124 PolarHBondContact O-N 3.38Å; D121-L124 PolarHBondContact OD1-N 3.39Å; D121-L124 VanDerWaalsContact OD1-N 3.07Å; D121-L124 WeakPolarHBondContact OD2-CB 3.38Å; D121-F125 PolarHBondContact O-N 2.97Å
122	P	84.8	Confident	82	Confident	95 Å²	95	64.2 Å²	64.2	62%	0.617	31%	0.311	S	S	*	.	H	α-helix	trans	-61	-30.3	177.8	-24.3	33.9	0	0	0	114	E120 F125 Q126	E120-P122 WeakPolarHBondContact O-CD 3.43Å; P122-F125 PolarHBondContact O-N 2.89Å; P122-Q126 PolarHBondContact O-N 3.28Å; P122-Q126 VanDerWaalsContact O-N 3.13Å
123	V	82.8	Confident	82.6	Confident	69 Å²	69	62.3 Å²	62.3	42%	0.418	31%	0.308	S	S	.	.	H	α-helix	trans	-71.8	-40.4	179.1	-179.8	0	0	0	0	109.6	D121 Q126 L127 I468	D121-V123 VanDerWaalsContact C-N 3.25Å; D121-V123 PolarHBondContact O-N 3.39Å; D121-V123 WeakPolarHBondContact OD1-CB 3.38Å; D121-V123 PolarHBondContact OD1-N 2.92Å; V123-Q126 PolarHBondContact O-N 3.06Å; V123-L127 PolarHBondContact O-N 3.42Å; V123-I468 HydrophobicContact CG1-CD1 3.76Å
124	L	83.9	Confident	82.9	Confident	6 Å²	6	60.9 Å²	60.9	3%	0.031	30%	0.304	C	S	.	.	H	α-helix	trans	-64.1	-40.4	174.1	179.9	62.4	0	0	0	112.4	M117 L118 D121 Q126 L127 Y128 F142	M117-L124 HydrophobicContact CB-CD2 4.39Å; L118-L124 HydrophobicContact CD2-CD2 4.11Å; L118-L124 HydrophobicContact CD2-CG 3.9Å; D121-L124 HydrophobicContact CB-CB 3.73Å; D121-L124 HydrophobicContact CB-CD2 4.44Å; D121-L124 VanDerWaalsContact CG-CB 3.44Å; D121-L124 WeakPolarHBondContact O-CB 3.22Å; D121-L124 PolarHBondContact O-N 3.38Å; D121-L124 PolarHBondContact OD1-N 3.39Å; D121-L124 VanDerWaalsContact OD1-N 3.07Å; D121-L124 WeakPolarHBondContact OD2-CB 3.38Å; L124-Q126 VanDerWaalsContact C-N 3.31Å; L124-Q126 PolarHBondContact O-N 3.29Å; L124-L127 HydrophobicContact CD1-CD2 4.33Å; L124-L127 WeakPolarHBondContact O-CB 3.29Å; L124-L127 PolarHBondContact O-N 3.2Å; L124-Y128 PolarHBondContact O-N 3.26Å; L124-F142 HydrophobicContact CD1-CE1 4.45Å; L124-F142 HydrophobicContact CD1-CZ 3.73Å
125	F	85.8	Confident	83	Confident	105 Å²	105	65.5 Å²	65.5	46%	0.461	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-43.8	175.5	-177.4	-112.7	0	0	0	112	L118 D121 P122 L127 Y128 K129	L118-F125 HydrophobicContact CB-CD2 4.12Å; L118-F125 WeakPolarHBondContact O-CB 3.12Å; D121-F125 PolarHBondContact O-N 2.97Å; P122-F125 PolarHBondContact O-N 2.89Å; F125-L127 VanDerWaalsContact C-N 3.34Å; F125-L127 PolarHBondContact O-N 3.05Å; F125-Y128 PolarHBondContact O-N 2.69Å; F125-K129 PolarHBondContact O-N 3.33Å
126	Q	84.6	Confident	83.3	Confident	47 Å²	47	61.7 Å²	61.7	22%	0.22	31%	0.307	C	S	.	.	H	α-helix	trans	-64.1	-40.1	176.2	-171.5	55.1	44	0	0	111.6	P122 V123 L124 K129 D130 H465	P122-Q126 PolarHBondContact O-N 3.28Å; P122-Q126 VanDerWaalsContact O-N 3.13Å; V123-Q126 PolarHBondContact O-N 3.06Å; L124-Q126 VanDerWaalsContact C-N 3.31Å; L124-Q126 PolarHBondContact O-N 3.29Å; Q126-K129 WeakPolarHBondContact O-CB 3.46Å; Q126-K129 PolarHBondContact O-N 2.95Å; Q126-D130 PolarHBondContact NE2-OD1 3.24Å; Q126-D130 PolarHBondContact NE2-OD2 2.76Å; Q126-D130 WeakPolarHBondContact O-CB 3.49Å; Q126-D130 PolarHBondContact O-N 3.37Å; Q126-H465 HydrophobicContact CG-CB 4.35Å
127	L	86.1	Confident	83.6	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.073	29%	0.292	C	S	.	.	H	α-helix	trans	-60.8	-44.4	173.2	-179.7	62.7	0	0	0	112.4	V123 L124 F125 K129 D130 L131 F142 I468 A469 E472	V123-L127 PolarHBondContact O-N 3.42Å; L124-L127 HydrophobicContact CD1-CD2 4.33Å; L124-L127 WeakPolarHBondContact O-CB 3.29Å; L124-L127 PolarHBondContact O-N 3.2Å; F125-L127 VanDerWaalsContact C-N 3.34Å; F125-L127 PolarHBondContact O-N 3.05Å; L127-K129 VanDerWaalsContact C-N 3.32Å; L127-K129 PolarHBondContact O-N 3.2Å; L127-D130 PolarHBondContact O-N 2.94Å; L127-L131 HydrophobicContact CD1-CD1 3.53Å; L127-L131 HydrophobicContact CD1-CG 3.92Å; L127-L131 HydrophobicContact CG-CD1 4.03Å; L127-L131 WeakPolarHBondContact O-CB 3.35Å; L127-L131 PolarHBondContact O-N 3.28Å; L127-F142 HydrophobicContact CD2-CE2 4.25Å; L127-F142 HydrophobicContact CG-CE2 4.12Å; L127-I468 HydrophobicContact CD1-CG2 4.18Å; L127-I468 HydrophobicContact CD2-CG2 4.41Å; L127-A469 VanDerWaalsContact CD1-CA 3.47Å; L127-A469 HydrophobicContact CD1-CB 3.86Å; L127-E472 HydrophobicContact CD2-CG 4.49Å
128	Y	86.8	Confident	83.8	Confident	53 Å²	53	56.8 Å²	56.8	21%	0.208	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-42.5	175.9	-179.4	-97	0	0	0	111.2	L118 L124 F125 V132 V133 F142 W143	L118-Y128 HydrophobicContact CD1-CD1 4.21Å; L118-Y128 HydrophobicContact CD1-CE1 4.49Å; L118-Y128 HydrophobicContact CD1-CG 4.25Å; L118-Y128 HydrophobicContact CD2-CG 4.16Å; L124-Y128 PolarHBondContact O-N 3.26Å; F125-Y128 PolarHBondContact O-N 2.69Å; Y128-V132 HydrophobicContact CD2-CB 4.09Å; Y128-V132 HydrophobicContact CD2-CG2 3.66Å; Y128-V132 HydrophobicContact CE1-CB 4.38Å; Y128-V132 HydrophobicContact CE1-CG1 4.43Å; Y128-V132 HydrophobicContact CE2-CB 3.87Å; Y128-V132 HydrophobicContact CE2-CG1 3.95Å; Y128-V132 HydrophobicContact CE2-CG2 3.6Å; Y128-V132 HydrophobicContact CG-CB 4.46Å; Y128-V132 HydrophobicContact CG-CG2 4.38Å; Y128-V132 WeakPolarHBondContact O-CA 3.35Å; Y128-V132 VanDerWaalsContact O-CB 3.27Å; Y128-V132 WeakPolarHBondContact O-CB 3.49Å; Y128-V132 PolarHBondContact O-N 3.42Å; Y128-V133 PolarHBondContact O-N 2.94Å; Y128-F142 AromaticContact CD2-CD1 3.6Å; Y128-F142 HydrophobicContact CD2-CD1 3.6Å; Y128-F142 AromaticContact CD2-CE1 3.59Å; Y128-F142 HydrophobicContact CD2-CE1 3.59Å; Y128-F142 HydrophobicContact CD2-CG 4.1Å; Y128-F142 HydrophobicContact CD2-CZ 4.08Å; Y128-F142 HydrophobicContact CE2-CD1 4.08Å; Y128-F142 HydrophobicContact CE2-CE1 4.43Å; Y128-F142 HydrophobicContact CG-CE1 4.44Å; Y128-W143 AromaticContact CE2-NE1 3.82Å
129	K	85.4	Confident	83.8	Confident	101 Å²	101	57.3 Å²	57.3	44%	0.439	30%	0.299	S	S	.	.	I	π-helix	trans	-63.6	-42.8	175.2	-171.3	179.3	176.6	-177.4	0	111.9	F125 Q126 L127 L131 V133 S134	F125-K129 PolarHBondContact O-N 3.33Å; Q126-K129 WeakPolarHBondContact O-CB 3.46Å; Q126-K129 PolarHBondContact O-N 2.95Å; L127-K129 VanDerWaalsContact C-N 3.32Å; L127-K129 PolarHBondContact O-N 3.2Å; K129-L131 PolarHBondContact O-N 2.96Å; K129-V133 HydrophobicContact CG-CB 4.27Å; K129-V133 HydrophobicContact CG-CG2 4.29Å; K129-V133 VanDerWaalsContact O-CB 3.3Å; K129-V133 WeakPolarHBondContact O-CB 3.46Å; K129-V133 PolarHBondContact O-N 3.21Å; K129-S134 PolarHBondContact O-N 2.93Å; K129-S134 PolarHBondContact O-OG 3.47Å
130	D	83.1	Confident	83.7	Confident	16 Å²	16	56.2 Å²	56.2	9%	0.086	29%	0.294	C	S	.	.	I	π-helix	trans	-75.2	-24.6	-176.6	-72.8	-30.1	0	0	0	114.1	Q126 L127 S134 A469 K506	Q126-D130 PolarHBondContact NE2-OD1 3.24Å; Q126-D130 PolarHBondContact NE2-OD2 2.76Å; Q126-D130 WeakPolarHBondContact O-CB 3.49Å; Q126-D130 PolarHBondContact O-N 3.37Å; L127-D130 PolarHBondContact O-N 2.94Å; D130-S134 WeakPolarHBondContact O-CB 3.29Å; D130-S134 PolarHBondContact O-OG 3.5Å; D130-A469 HydrophobicContact CB-CB 4.48Å; D130-K506 IonicContact OD1-NZ 3.63Å; D130-K506 PolarHBondContact OD1-NZ 3.43Å
131	L	84.3	Confident	83.4	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.01	29%	0.286	C	S	.	.	I	π-helix	trans	-99.7	-48	178.6	-66.2	-177.8	0	0	0	113.3	L127 K129 V136 I137 F142 A469 L473 F502	L127-L131 HydrophobicContact CD1-CD1 3.53Å; L127-L131 HydrophobicContact CD1-CG 3.92Å; L127-L131 HydrophobicContact CG-CD1 4.03Å; L127-L131 WeakPolarHBondContact O-CB 3.35Å; L127-L131 PolarHBondContact O-N 3.28Å; K129-L131 PolarHBondContact O-N 2.96Å; L131-V136 HydrophobicContact CD2-CG1 4.41Å; L131-V136 WeakPolarHBondContact O-CB 3.35Å; L131-V136 PolarHBondContact O-N 3.07Å; L131-I137 HydrophobicContact CB-CD1 3.88Å; L131-I137 HydrophobicContact CB-CG1 3.95Å; L131-I137 HydrophobicContact CD1-CD1 4.09Å; L131-I137 PolarHBondContact O-N 3.49Å; L131-F142 HydrophobicContact CD1-CD2 4.41Å; L131-F142 HydrophobicContact CD1-CE2 4.46Å; L131-A469 HydrophobicContact CD2-CB 3.96Å; L131-A469 HydrophobicContact CG-CB 4.28Å; L131-L473 HydrophobicContact CD2-CD1 3.93Å; L131-L473 HydrophobicContact CD2-CD2 4.27Å; L131-L473 HydrophobicContact CD2-CG 4.05Å; L131-F502 HydrophobicContact CD2-CD2 4.04Å; L131-F502 HydrophobicContact CD2-CE2 4.15Å
132	V	87	Confident	83.5	Confident	21 Å²	21	52.2 Å²	52.2	13%	0.127	27%	0.273	C	S	.	.	I	π-helix	trans	-88.5	-49.5	-172.7	-178.2	0	0	0	0	111.7	Y128 S134 Q135 I137 A139 F142	Y128-V132 HydrophobicContact CD2-CB 4.09Å; Y128-V132 HydrophobicContact CD2-CG2 3.66Å; Y128-V132 HydrophobicContact CE1-CB 4.38Å; Y128-V132 HydrophobicContact CE1-CG1 4.43Å; Y128-V132 HydrophobicContact CE2-CB 3.87Å; Y128-V132 HydrophobicContact CE2-CG1 3.95Å; Y128-V132 HydrophobicContact CE2-CG2 3.6Å; Y128-V132 HydrophobicContact CG-CB 4.46Å; Y128-V132 HydrophobicContact CG-CG2 4.38Å; Y128-V132 WeakPolarHBondContact O-CA 3.35Å; Y128-V132 VanDerWaalsContact O-CB 3.27Å; Y128-V132 WeakPolarHBondContact O-CB 3.49Å; Y128-V132 PolarHBondContact O-N 3.42Å; V132-S134 PolarHBondContact O-N 3.45Å; V132-Q135 PolarHBondContact O-N 3.47Å; V132-I137 HydrophobicContact CG2-CG1 4.23Å; V132-A139 HydrophobicContact CG1-CB 3.83Å; V132-F142 HydrophobicContact CG2-CB 3.62Å; V132-F142 HydrophobicContact CG2-CD2 4.17Å; V132-F142 HydrophobicContact CG2-CG 3.88Å
133	V	84.9	Confident	83.4	Confident	96 Å²	96	48.4 Å²	48.4	58%	0.582	25%	0.246	S	C	*	.	I	π-helix	trans	-66.6	-31.3	179.3	179.4	0	0	0	0	111	Y128 K129 Q135	Y128-V133 PolarHBondContact O-N 2.94Å; K129-V133 HydrophobicContact CG-CB 4.27Å; K129-V133 HydrophobicContact CG-CG2 4.29Å; K129-V133 VanDerWaalsContact O-CB 3.3Å; K129-V133 WeakPolarHBondContact O-CB 3.46Å; K129-V133 PolarHBondContact O-N 3.21Å; V133-Q135 PolarHBondContact O-N 3.43Å
134	S	79.8	Confident	83	Confident	27 Å²	27	48.2 Å²	48.2	19%	0.189	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	5.7	175.5	-50.3	0	0	0	0	113.4	K129 D130 V132 V136 K506	K129-S134 PolarHBondContact O-N 2.93Å; K129-S134 PolarHBondContact O-OG 3.47Å; D130-S134 WeakPolarHBondContact O-CB 3.29Å; D130-S134 PolarHBondContact O-OG 3.5Å; V132-S134 PolarHBondContact O-N 3.45Å; S134-V136 PolarHBondContact O-N 3.36Å; S134-V136 VanDerWaalsContact O-N 3.15Å; S134-K506 WeakPolarHBondContact OG-CE 3.04Å; S134-K506 PolarHBondContact OG-NZ 3.05Å
135	Q	81.9	Confident	82.3	Confident	149 Å²	149	49.4 Å²	49.4	70%	0.696	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	23.8	177.2	-54.8	-174.4	13.1	0	0	115.2	V132 V133 R501	V132-Q135 PolarHBondContact O-N 3.47Å; V133-Q135 PolarHBondContact O-N 3.43Å; Q135-R501 WeakPolarHBondContact O-CD 3.18Å; Q135-R501 PolarHBondContact O-NH1 3.47Å
136	V	82.2	Confident	81.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-70.5	-41.7	176	179.4	0	0	0	0	109.9	L131 S134 L473 F502	L131-V136 HydrophobicContact CD2-CG1 4.41Å; L131-V136 WeakPolarHBondContact O-CB 3.35Å; L131-V136 PolarHBondContact O-N 3.07Å; S134-V136 PolarHBondContact O-N 3.36Å; S134-V136 VanDerWaalsContact O-N 3.15Å; V136-L473 HydrophobicContact CG1-CD1 4.14Å; V136-F502 HydrophobicContact CG1-CB 3.74Å; V136-F502 HydrophobicContact CG1-CD2 4.21Å; V136-F502 HydrophobicContact CG1-CG 4.48Å; V136-F502 HydrophobicContact CG2-CB 4.45Å; V136-F502 HydrophobicContact CG2-CD2 4.16Å
137	I	84.5	Confident	80.5	Confident	15 Å²	15	48.8 Å²	48.8	8%	0.077	26%	0.255	C	S	.	.	S	Bend	trans	-137.4	163.6	175.6	64.8	179.7	0	0	0	110.6	L131 V132 F142 L473 N498	L131-I137 HydrophobicContact CB-CD1 3.88Å; L131-I137 HydrophobicContact CB-CG1 3.95Å; L131-I137 HydrophobicContact CD1-CD1 4.09Å; L131-I137 PolarHBondContact O-N 3.49Å; V132-I137 HydrophobicContact CG2-CG1 4.23Å; I137-F142 HydrophobicContact CD1-CB 3.84Å; I137-F142 HydrophobicContact CD1-CD2 4.02Å; I137-F142 HydrophobicContact CD1-CG 4.45Å; I137-F142 HydrophobicContact CG1-CB 4.45Å; I137-L473 HydrophobicContact CG2-CD2 4.09Å; I137-N498 HydrophobicContact CG2-CB 4.13Å; I137-N498 WeakPolarHBondContact CG2-ND2 3.46Å
138	S	83	Confident	78.9	Confident	43 Å²	43	50.2 Å²	50.2	30%	0.301	27%	0.273	S	S	.	.			trans	-78.4	160.7	174.8	99.8	0	0	0	0	112.5	E140 E141 F142	S138-E140 VanDerWaalsContact C-N 3.29Å; S138-E140 WeakPolarHBondContact CB-OE2 3.37Å; S138-E140 PolarHBondContact O-N 2.86Å; S138-E140 PolarHBondContact OG-N 3.35Å; S138-E140 PolarHBondContact OG-OE2 3.38Å; S138-E141 PolarHBondContact N-OE2 3.34Å; S138-E141 PolarHBondContact O-N 3.06Å; S138-E141 WeakPolarHBondContact OG-CG 3.39Å; S138-E141 PolarHBondContact OG-N 3.09Å; S138-E141 VanDerWaalsContact OG-N 3.1Å; S138-F142 PolarHBondContact O-N 3.16Å
139	A	81.6	Confident	77	Confident	25 Å²	25	49.6 Å²	49.6	21%	0.207	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-38.4	176.4	0	0	0	0	0	111.4	V132 F142 W143	V132-A139 HydrophobicContact CG1-CB 3.83Å; A139-F142 PolarHBondContact O-N 3.44Å; A139-W143 PolarHBondContact O-N 2.79Å; A139-W143 VanDerWaalsContact O-N 3.15Å
140	E	79	Confident	75.1	Confident	138 Å²	138	47.8 Å²	47.8	65%	0.645	28%	0.28	S	S	*	.	H	α-helix	trans	-64.4	-44.3	176.9	-56.7	71.8	-154.1	0	0	110.6	S138 W143 A144	S138-E140 VanDerWaalsContact C-N 3.29Å; S138-E140 WeakPolarHBondContact CB-OE2 3.37Å; S138-E140 PolarHBondContact O-N 2.86Å; S138-E140 PolarHBondContact OG-N 3.35Å; S138-E140 PolarHBondContact OG-OE2 3.38Å; E140-W143 PolarHBondContact O-N 3.46Å; E140-A144 WeakPolarHBondContact O-CB 3.48Å; E140-A144 PolarHBondContact O-N 2.74Å
141	E	78.3	Confident	73.1	Confident	66 Å²	66	53.3 Å²	53.3	31%	0.308	31%	0.31	S	S	.	.	H	α-helix	trans	-63.8	-42.8	177.3	-71.4	-178.3	152.8	0	0	111.9	S138 W143 A144 N145	S138-E141 PolarHBondContact N-OE2 3.34Å; S138-E141 PolarHBondContact O-N 3.06Å; S138-E141 WeakPolarHBondContact OG-CG 3.39Å; S138-E141 PolarHBondContact OG-N 3.09Å; S138-E141 VanDerWaalsContact OG-N 3.1Å; E141-W143 PolarHBondContact O-N 3.05Å; E141-A144 PolarHBondContact O-N 2.97Å; E141-N145 WeakPolarHBondContact O-CB 3.35Å; E141-N145 PolarHBondContact O-N 3.37Å; E141-N145 PolarHBondContact O-ND2 3.25Å
142	F	83.7	Confident	71	Confident	9 Å²	9	60.6 Å²	60.6	4%	0.039	35%	0.349	C	S	.	.	H	α-helix	trans	-56.5	-51.3	176.2	176.4	-94.3	0	0	0	111.5	L124 L127 Y128 L131 V132 I137 S138 A139 R146	L124-F142 HydrophobicContact CD1-CE1 4.45Å; L124-F142 HydrophobicContact CD1-CZ 3.73Å; L127-F142 HydrophobicContact CD2-CE2 4.25Å; L127-F142 HydrophobicContact CG-CE2 4.12Å; Y128-F142 AromaticContact CD2-CD1 3.6Å; Y128-F142 HydrophobicContact CD2-CD1 3.6Å; Y128-F142 AromaticContact CD2-CE1 3.59Å; Y128-F142 HydrophobicContact CD2-CE1 3.59Å; Y128-F142 HydrophobicContact CD2-CG 4.1Å; Y128-F142 HydrophobicContact CD2-CZ 4.08Å; Y128-F142 HydrophobicContact CE2-CD1 4.08Å; Y128-F142 HydrophobicContact CE2-CE1 4.43Å; Y128-F142 HydrophobicContact CG-CE1 4.44Å; L131-F142 HydrophobicContact CD1-CD2 4.41Å; L131-F142 HydrophobicContact CD1-CE2 4.46Å; V132-F142 HydrophobicContact CG2-CB 3.62Å; V132-F142 HydrophobicContact CG2-CD2 4.17Å; V132-F142 HydrophobicContact CG2-CG 3.88Å; I137-F142 HydrophobicContact CD1-CB 3.84Å; I137-F142 HydrophobicContact CD1-CD2 4.02Å; I137-F142 HydrophobicContact CD1-CG 4.45Å; I137-F142 HydrophobicContact CG1-CB 4.45Å; S138-F142 PolarHBondContact O-N 3.16Å; A139-F142 PolarHBondContact O-N 3.44Å; F142-R146 PolarHBondContact O-N 3.2Å; F142-R146 VanDerWaalsContact O-N 3.14Å
143	W	82.1	Confident	68.6	Low	15 Å²	15	62.6 Å²	62.6	6%	0.057	37%	0.374	C	S	.	.	H	α-helix	trans	-72.7	-37.8	-178.8	-70.2	114.9	0	0	0	112.8	K114 M117 L118 Y128 A139 E140 E141 N145 R146 L147	K114-W143 HydrophobicContact CB-CD2 4.42Å; K114-W143 HydrophobicContact CB-CH2 3.97Å; K114-W143 HydrophobicContact CB-CZ2 3.65Å; K114-W143 HydrophobicContact CB-CZ3 4.48Å; K114-W143 HydrophobicContact CD-CD2 3.88Å; K114-W143 HydrophobicContact CD-CG 3.88Å; K114-W143 HydrophobicContact CG-CD2 3.79Å; K114-W143 HydrophobicContact CG-CE3 3.99Å; K114-W143 HydrophobicContact CG-CG 4.33Å; K114-W143 HydrophobicContact CG-CH2 4.12Å; K114-W143 HydrophobicContact CG-CZ2 3.94Å; K114-W143 HydrophobicContact CG-CZ3 4.14Å; M117-W143 HydrophobicContact CB-CH2 4.42Å; M117-W143 HydrophobicContact SD-CZ3 4.27Å; L118-W143 HydrophobicContact CD1-CZ2 3.95Å; L118-W143 HydrophobicContact CD2-CH2 4.04Å; L118-W143 HydrophobicContact CD2-CZ2 4.03Å; L118-W143 HydrophobicContact CG-CH2 4Å; L118-W143 HydrophobicContact CG-CZ2 3.87Å; Y128-W143 AromaticContact CE2-NE1 3.82Å; A139-W143 PolarHBondContact O-N 2.79Å; A139-W143 VanDerWaalsContact O-N 3.15Å; E140-W143 PolarHBondContact O-N 3.46Å; E141-W143 PolarHBondContact O-N 3.05Å; W143-N145 VanDerWaalsContact C-N 3.31Å; W143-N145 PolarHBondContact O-N 3.18Å; W143-R146 PolarHBondContact O-N 2.96Å; W143-L147 HydrophobicContact CB-CD1 4.23Å; W143-L147 WeakPolarHBondContact O-CB 2.99Å; W143-L147 VanDerWaalsContact O-CG 3.24Å; W143-L147 WeakPolarHBondContact O-CG 3.16Å; W143-L147 PolarHBondContact O-N 2.9Å
144	A	75.1	Confident	66.1	Low	65 Å²	65	64.8 Å²	64.8	54%	0.537	38%	0.378	S	S	.	.	H	α-helix	trans	-62.4	-40	176.6	0	0	0	0	0	111.7	E140 E141 G148	E140-A144 WeakPolarHBondContact O-CB 3.48Å; E140-A144 PolarHBondContact O-N 2.74Å; E141-A144 PolarHBondContact O-N 2.97Å; A144-G148 PolarHBondContact O-N 3.42Å; A144-G148 VanDerWaalsContact O-N 3.09Å
145	N	70.3	Confident	64.1	Low	31 Å²	31	68.2 Å²	68.2	17%	0.166	40%	0.399	C	S	.	.	H	α-helix	trans	-72.7	-32.5	179.2	-73.4	-41.2	0	0	0	112.9	E141 W143 K491	E141-N145 WeakPolarHBondContact O-CB 3.35Å; E141-N145 PolarHBondContact O-N 3.37Å; E141-N145 PolarHBondContact O-ND2 3.25Å; W143-N145 VanDerWaalsContact C-N 3.31Å; W143-N145 PolarHBondContact O-N 3.18Å; N145-K491 WeakPolarHBondContact OD1-CE 3.49Å; N145-K491 PolarHBondContact OD1-NZ 2.83Å
146	R	68.6	Low	62.3	Low	78 Å²	78	63 Å²	63	29%	0.294	38%	0.382	S	S	.	.	H	α-helix	trans	-81.4	-46.2	178.1	-163.3	131.6	-176.9	-85.2	7.6	112.7	F142 W143 G148 G149 V150	F142-R146 PolarHBondContact O-N 3.2Å; F142-R146 VanDerWaalsContact O-N 3.14Å; W143-R146 PolarHBondContact O-N 2.96Å; R146-G148 VanDerWaalsContact C-N 3.3Å; R146-G148 PolarHBondContact O-N 3.44Å; R146-G149 PolarHBondContact O-N 3.03Å; R146-G149 VanDerWaalsContact O-N 3.14Å; R146-V150 PolarHBondContact O-N 2.86Å
147	L	62.6	Low	60.5	Low	60 Å²	60	67.6 Å²	67.6	31%	0.314	41%	0.412	S	S	.	.	H	α-helix	trans	-67.7	-30	178.6	-66.2	168.5	0	0	0	112.3	W143 G149 V150 N151	W143-L147 HydrophobicContact CB-CD1 4.23Å; W143-L147 WeakPolarHBondContact O-CB 2.99Å; W143-L147 VanDerWaalsContact O-CG 3.24Å; W143-L147 WeakPolarHBondContact O-CG 3.16Å; W143-L147 PolarHBondContact O-N 2.9Å; L147-G149 PolarHBondContact O-N 2.85Å; L147-V150 PolarHBondContact O-N 2.97Å; L147-N151 PolarHBondContact O-N 2.96Å; L147-N151 PolarHBondContact O-ND2 3.46Å
148	G	53.9	Low	58.7	Low	44 Å²	44	73.5 Å²	73.5	45%	0.454	43%	0.434	S	S	.	.	H	α-helix	trans	-62.1	-26.3	172.4	0	0	0	0	0	113.8	A144 R146	A144-G148 PolarHBondContact O-N 3.42Å; A144-G148 VanDerWaalsContact O-N 3.09Å; R146-G148 VanDerWaalsContact C-N 3.3Å; R146-G148 PolarHBondContact O-N 3.44Å
149	G	45.7	Very low	56.8	Low	41 Å²	41	78.6 Å²	78.6	42%	0.423	46%	0.458	S	S	.	.	H	α-helix	trans	-81.8	-33.8	173	0	0	0	0	0	113.5	R146 L147	R146-G149 PolarHBondContact O-N 3.03Å; R146-G149 VanDerWaalsContact O-N 3.14Å; L147-G149 PolarHBondContact O-N 2.85Å
150	V	45.3	Very low	55	Low	62 Å²	62	83 Å²	83	38%	0.376	48%	0.478	S	S	.	.	H	α-helix	trans	-71.2	-36.2	177.7	-177.2	0	0	0	0	111	R146 L147 N152	R146-V150 PolarHBondContact O-N 2.86Å; L147-V150 PolarHBondContact O-N 2.97Å; V150-N152 VanDerWaalsContact C-N 3.28Å; V150-N152 PolarHBondContact O-N 3.13Å
151	N	40.5	Very low	53.6	Low	132 Å²	132	84.6 Å²	84.6	71%	0.706	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-15.3	-179.3	-70.6	-22.4	0	0	0	114.8	L147	L147-N151 PolarHBondContact O-N 2.96Å; L147-N151 PolarHBondContact O-ND2 3.46Å
152	N	40.2	Very low	52.4	Low	155 Å²	155	90.3 Å²	90.3	83%	0.829	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	1.2	-170.1	-111	27	0	0	0	115.4	V150	V150-N152 VanDerWaalsContact C-N 3.28Å; V150-N152 PolarHBondContact O-N 3.13Å
153	G	37.1	Very low	51.1	Low	64 Å²	64	93.7 Å²	93.7	66%	0.66	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-152.5	-21	-173.7	0	0	0	0	0	117.1
154	E	33.9	Very low	50.3	Low	142 Å²	142	99.1 Å²	99.1	66%	0.664	56%	0.56	S	S	*	*			trans	-142.5	115.4	175.7	-70.9	-167.8	154	0	0	109.2	A156	E154-A156 PolarHBondContact O-N 2.89Å; E154-A156 VanDerWaalsContact O-N 3.09Å
155	P	37.2	Very low	49.7	Very low	98 Å²	98	99.1 Å²	99.1	64%	0.636	57%	0.566	S	S	*	*			trans	-55	124.8	166.5	24.1	-30.2	0	0	0	106.8	P157	P155-P157 VanDerWaalsContact O-N 3.15Å
156	A	42.9	Very low	49.7	Very low	41 Å²	41	98.9 Å²	98.9	34%	0.339	57%	0.565	S	S	.	*			trans	-36.8	123.8	-177.5	0	0	0	0	0	110.5	E154 Y158 N159	E154-A156 PolarHBondContact O-N 2.89Å; E154-A156 VanDerWaalsContact O-N 3.09Å; A156-Y158 PolarHBondContact O-N 2.93Å; A156-N159 PolarHBondContact O-N 3.25Å; A156-N159 VanDerWaalsContact O-N 3.11Å
157	P	45	Very low	49.8	Very low	96 Å²	96	98.4 Å²	98.4	62%	0.623	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-9.4	-173.7	21	-31.4	0	0	0	113.2	P155	P155-P157 VanDerWaalsContact O-N 3.15Å
158	Y	46.3	Very low	49.8	Very low	139 Å²	139	98 Å²	98	55%	0.545	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.3	-12.9	-177.3	-63.6	-68	0	0	0	115.6	E120 A156	E120-Y158 PolarHBondContact OE2-OH 3.15Å; A156-Y158 PolarHBondContact O-N 2.93Å
159	N	42.7	Very low	50.4	Low	149 Å²	149	98.3 Å²	98.3	80%	0.797	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-15.9	174.8	-93.9	-7.6	0	0	0	113.5	A156 K161	A156-N159 PolarHBondContact O-N 3.25Å; A156-N159 VanDerWaalsContact O-N 3.11Å; N159-K161 VanDerWaalsContact C-N 3.28Å; N159-K161 PolarHBondContact O-N 3.37Å
160	N	45.8	Very low	51.6	Low	117 Å²	117	97.8 Å²	97.8	63%	0.626	57%	0.568	S	S	*	*			trans	-93.6	52.5	171.4	-73.1	-28.6	0	0	0	110.8	Q162	N160-Q162 VanDerWaalsContact C-N 3.34Å; N160-Q162 PolarHBondContact O-N 3.14Å
161	K	49.5	Very low	52.6	Low	172 Å²	172	96.3 Å²	96.3	75%	0.748	56%	0.558	S	S	*	*			trans	-65.2	108.1	153.7	-73	-174.9	179.9	-177.4	0	105.2	N159 E163	N159-K161 VanDerWaalsContact C-N 3.28Å; N159-K161 PolarHBondContact O-N 3.37Å; K161-E163 PolarHBondContact O-N 3.43Å
162	Q	51.2	Low	53.8	Low	187 Å²	187	93 Å²	93	87%	0.874	55%	0.549	S	S	*	.			trans	-47.8	115.9	164.1	-179.2	176.7	-2	0	0	106.1	N160 V164	N160-Q162 VanDerWaalsContact C-N 3.34Å; N160-Q162 PolarHBondContact O-N 3.14Å; Q162-V164 PolarHBondContact O-N 3.17Å
163	E	57.3	Low	55	Low	80 Å²	80	91.4 Å²	91.4	37%	0.374	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-65.1	135.1	-178.9	-74.5	-170.2	162.7	0	0	108.4	K161 G165 R198 K323	K161-E163 PolarHBondContact O-N 3.43Å; E163-G165 PolarHBondContact O-N 3.28Å; E163-G165 VanDerWaalsContact O-N 3.15Å; E163-R198 IonicContact OE1-CZ 2.96Å; E163-R198 IonicContact OE1-NH1 3.72Å; E163-R198 IonicContact OE1-NH2 3.49Å; E163-R198 PolarHBondContact OE1-NH2 3.38Å; E163-R198 IonicContact OE2-CZ 2.71Å; E163-R198 IonicContact OE2-NH1 3.7Å; E163-R198 PolarHBondContact OE2-NH1 2.74Å; E163-R198 IonicContact OE2-NH2 2.85Å; E163-R198 PolarHBondContact OE2-NH2 3.03Å; E163-K323 WeakPolarHBondContact OE1-CE 3.24Å; E163-K323 IonicContact OE1-NZ 3.21Å; E163-K323 PolarHBondContact OE1-NZ 3.39Å; E163-K323 WeakPolarHBondContact OE2-CE 3.47Å; E163-K323 IonicContact OE2-NZ 2.78Å; E163-K323 PolarHBondContact OE2-NZ 2.93Å; E163-K323 VanDerWaalsContact OE2-NZ 3.08Å
164	V	64.6	Low	56.4	Low	128 Å²	128	89.2 Å²	89.2	78%	0.776	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-61.3	120.3	175.2	-177.5	0	0	0	0	107.5	Q162	Q162-V164 PolarHBondContact O-N 3.17Å
165	G	63.2	Low	57.7	Low	65 Å²	65	91.7 Å²	91.7	67%	0.67	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-64	148.1	176	0	0	0	0	0	111	E163 S167	E163-G165 PolarHBondContact O-N 3.28Å; E163-G165 VanDerWaalsContact O-N 3.15Å; G165-S167 PolarHBondContact O-N 3.09Å
166	I	71.3	Confident	59.2	Low	27 Å²	27	89.8 Å²	89.8	14%	0.138	50%	0.504	C	S	.	.			trans	-81.2	114.6	176.8	-55	169.5	0	0	0	107.9	R198 V316 A319	I166-R198 HydrophobicContact CD1-CB 3.36Å; I166-R198 HydrophobicContact CD1-CG 4.29Å; I166-R198 HydrophobicContact CG1-CB 4.48Å; I166-V316 HydrophobicContact CG2-CG2 4.44Å; I166-A319 HydrophobicContact CD1-CB 3.57Å
167	S	69.4	Low	59.9	Low	68 Å²	68	93.3 Å²	93.3	48%	0.476	51%	0.514	S	S	.	.			trans	-67.1	136.7	173.7	175.4	0	0	0	0	110.6	G165 A169 F170	G165-S167 PolarHBondContact O-N 3.09Å; S167-A169 PolarHBondContact O-N 3.04Å; S167-A169 VanDerWaalsContact O-N 3.14Å; S167-A169 PolarHBondContact OG-N 3.36Å; S167-F170 WeakPolarHBondContact O-CB 3.48Å; S167-F170 PolarHBondContact O-N 3.16Å
168	G	62.7	Low	60.2	Low	51 Å²	51	94.5 Å²	94.5	53%	0.526	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.8	175.2	0	0	0	0	0	113.5	H312	G168-H312 PolarHBondContact O-NE2 3.27Å; G168-H312 VanDerWaalsContact O-NE2 3.14Å
169	A	67.1	Low	60.2	Low	51 Å²	51	92.2 Å²	92.2	42%	0.421	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-2	178.6	0	0	0	0	0	114.3	S167 L171 A172 D173	S167-A169 PolarHBondContact O-N 3.04Å; S167-A169 VanDerWaalsContact O-N 3.14Å; S167-A169 PolarHBondContact OG-N 3.36Å; A169-L171 VanDerWaalsContact C-N 3.27Å; A169-L171 PolarHBondContact O-N 2.74Å; A169-L171 VanDerWaalsContact O-N 3.09Å; A169-A172 WeakPolarHBondContact O-CA 3.47Å; A169-A172 WeakPolarHBondContact O-CB 3.43Å; A169-A172 PolarHBondContact O-N 3.04Å; A169-D173 PolarHBondContact O-N 2.76Å
170	F	69.9	Low	60.4	Low	30 Å²	30	89 Å²	89	13%	0.132	52%	0.519	C	S	.	.	H	α-helix	trans	-52.6	-38.8	-171.6	163.6	-99.4	0	0	0	114.3	S167 A172 D173 I174 I192 S195 I196	S167-F170 WeakPolarHBondContact O-CB 3.48Å; S167-F170 PolarHBondContact O-N 3.16Å; F170-A172 VanDerWaalsContact C-N 3.31Å; F170-A172 PolarHBondContact O-N 3.29Å; F170-D173 PolarHBondContact O-N 3.08Å; F170-I174 HydrophobicContact CE1-CD1 3.92Å; F170-I174 HydrophobicContact CZ-CD1 3.86Å; F170-I192 HydrophobicContact CE2-CB 4.12Å; F170-I192 HydrophobicContact CE2-CG1 4.02Å; F170-I192 HydrophobicContact CE2-CG2 3.99Å; F170-I192 HydrophobicContact CZ-CB 3.9Å; F170-I192 HydrophobicContact CZ-CG1 4.31Å; F170-I192 HydrophobicContact CZ-CG2 3.47Å; F170-I192 VanDerWaalsContact CZ-CG2 3.47Å; F170-I192 WeakPolarHBondContact CZ-O 3.44Å; F170-S195 VanDerWaalsContact CE1-CB 3.44Å; F170-I196 HydrophobicContact CE1-CG1 3.93Å; F170-I196 HydrophobicContact CZ-CG1 4.36Å
171	L	66.9	Low	60.4	Low	30 Å²	30	89.1 Å²	89.1	16%	0.157	53%	0.528	C	S	.	.	H	α-helix	trans	-71.4	-22.7	178.1	-66.3	171.1	0	0	0	113.6	A169 I174 I196 Y200 F230	A169-L171 VanDerWaalsContact C-N 3.27Å; A169-L171 PolarHBondContact O-N 2.74Å; A169-L171 VanDerWaalsContact O-N 3.09Å; L171-I174 HydrophobicContact CD2-CD1 4.2Å; L171-I196 HydrophobicContact CD2-CG1 4.4Å; L171-Y200 HydrophobicContact CD1-CE2 3.55Å; L171-Y200 VanDerWaalsContact CD1-OH 3.23Å; L171-Y200 WeakPolarHBondContact CD1-OH 3.45Å; L171-Y200 HydrophobicContact CD2-CE2 4.23Å; L171-F230 HydrophobicContact CD2-CE2 4.43Å
172	A	64.9	Low	60.6	Low	64 Å²	64	89.9 Å²	89.9	53%	0.529	54%	0.54	S	S	.	.	H	α-helix	trans	-80.4	-24	177.5	0	0	0	0	0	112.5	A169 F170 I174	A169-A172 WeakPolarHBondContact O-CA 3.47Å; A169-A172 WeakPolarHBondContact O-CB 3.43Å; A169-A172 PolarHBondContact O-N 3.04Å; F170-A172 VanDerWaalsContact C-N 3.31Å; F170-A172 PolarHBondContact O-N 3.29Å; A172-I174 VanDerWaalsContact C-N 3.3Å
173	D	65.6	Low	60.8	Low	121 Å²	121	82.6 Å²	82.6	65%	0.647	52%	0.515	S	S	*	.	H	α-helix	trans	-77.4	-18	176.1	-67.7	-26.6	0	0	0	112.4	A169 F170 R175	A169-D173 PolarHBondContact O-N 2.76Å; F170-D173 PolarHBondContact O-N 3.08Å; D173-R175 PolarHBondContact O-N 2.69Å
174	I	67.4	Low	61	Low	18 Å²	18	84.2 Å²	84.2	9%	0.092	53%	0.526	C	S	.	.			trans	-76.9	75.8	172.3	-52.3	171.3	0	0	0	109.1	F170 L171 A172 Y186 I192 I196 F225	F170-I174 HydrophobicContact CE1-CD1 3.92Å; F170-I174 HydrophobicContact CZ-CD1 3.86Å; L171-I174 HydrophobicContact CD2-CD1 4.2Å; A172-I174 VanDerWaalsContact C-N 3.3Å; I174-Y186 HydrophobicContact CG2-CD1 3.96Å; I174-I192 HydrophobicContact CD1-CG2 3.71Å; I174-I192 HydrophobicContact CG1-CG2 4.2Å; I174-I196 HydrophobicContact CD1-CD1 4.32Å; I174-F225 HydrophobicContact CG2-CE1 3.8Å; I174-F225 HydrophobicContact CG2-CZ 4.03Å
175	R	61.8	Low	60.9	Low	194 Å²	194	85.1 Å²	85.1	73%	0.732	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-87.8	139.8	175.9	-65.3	-167.9	-176.2	-119.7	1.5	111.5	D173 Q177	D173-R175 PolarHBondContact O-N 2.69Å; R175-Q177 PolarHBondContact O-N 2.91Å
176	P	67.3	Low	61.3	Low	57 Å²	57	84.2 Å²	84.2	37%	0.37	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-67.2	131.2	172.5	28.5	-32.7	0	0	0	109.9	L184 Y186	P176-L184 HydrophobicContact CB-CB 4.12Å; P176-L184 HydrophobicContact CB-CD2 3.55Å; P176-L184 HydrophobicContact CB-CG 4.35Å; P176-L184 HydrophobicContact CG-CD2 3.95Å; P176-Y186 HydrophobicContact CB-CE1 3.88Å
177	Q	57.4	Low	61.4	Low	115 Å²	115	87.1 Å²	87.1	54%	0.537	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.3	170	-68.1	-178.6	-3.4	0	0	108.6	R175 D179 R185 N187	R175-Q177 PolarHBondContact O-N 2.91Å; Q177-D179 PolarHBondContact O-N 3.14Å; Q177-R185 PolarHBondContact N-O 3.06Å; Q177-R185 PolarHBondContact O-N 2.73Å; Q177-N187 VanDerWaalsContact CD-ND2 3.29Å; Q177-N187 PolarHBondContact NE2-ND2 2.99Å; Q177-N187 PolarHBondContact OE1-ND2 2.76Å
178	T	51.4	Low	61.8	Low	122 Å²	122	86.3 Å²	86.3	75%	0.748	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	106.6	176.4	54.6	0	0	0	0	108.9	L184	T178-L184 HydrophobicContact CG2-CD2 4.42Å
179	D	47.3	Very low	62.5	Low	90 Å²	90	87.8 Å²	87.8	48%	0.481	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	127.7	165.2	-155.5	-6	0	0	0	105.9	Q177 C181 G183 R185	Q177-D179 PolarHBondContact O-N 3.14Å; D179-C181 CarbonylContact O-C 3.57Å; D179-C181 PolarHBondContact O-N 2.94Å; D179-G183 PolarHBondContact N-O 3.45Å; D179-R185 IonicContact OD2-CZ 2.72Å; D179-R185 IonicContact OD2-NH2 3.24Å
180	G	47.4	Very low	63	Low	82 Å²	82	88.7 Å²	88.7	85%	0.845	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	7.9	-162.8	0	0	0	0	0	118.1
181	C	45.4	Very low	63.3	Low	120 Å²	120	92.6 Å²	92.6	81%	0.811	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	72.1	173.9	-69.5	0	0	0	0	110.8	D179 G183	D179-C181 CarbonylContact O-C 3.57Å; D179-C181 PolarHBondContact O-N 2.94Å; C181-G183 PolarHBondContact O-N 3.24Å
182	N	53.4	Low	63.9	Low	187 Å²	187	92.8 Å²	92.8	100%	1	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	19.7	166.4	-120.6	10.8	0	0	0	117.3
183	G	55.4	Low	64.7	Low	35 Å²	35	90.8 Å²	90.8	36%	0.361	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	133.2	-174.1	0	0	0	0	0	111.9	D179 C181	D179-G183 PolarHBondContact N-O 3.45Å; C181-G183 PolarHBondContact O-N 3.24Å
184	L	60.7	Low	65.4	Low	114 Å²	114	89.2 Å²	89.2	60%	0.597	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	122.2	174.7	-64	158.2	0	0	0	108.5	P176 T178	P176-L184 HydrophobicContact CB-CB 4.12Å; P176-L184 HydrophobicContact CB-CD2 3.55Å; P176-L184 HydrophobicContact CB-CG 4.35Å; P176-L184 HydrophobicContact CG-CD2 3.95Å; T178-L184 HydrophobicContact CG2-CD2 4.42Å
185	R	63.8	Low	65.9	Low	147 Å²	147	89.4 Å²	89.4	56%	0.555	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109	134.3	173.7	-173.4	-176.3	-84.5	173.2	0.5	110.2	Q177 D179	Q177-R185 PolarHBondContact N-O 3.06Å; Q177-R185 PolarHBondContact O-N 2.73Å; D179-R185 IonicContact OD2-CZ 2.72Å; D179-R185 IonicContact OD2-NH2 3.24Å
186	Y	71.1	Confident	66.9	Low	46 Å²	46	80.2 Å²	80.2	18%	0.18	47%	0.465	C	S	.	.			trans	-107.6	130.3	171.4	-64.1	-86.3	0	0	0	109.3	I174 P176 F225	I174-Y186 HydrophobicContact CG2-CD1 3.96Å; P176-Y186 HydrophobicContact CB-CE1 3.88Å; Y186-F225 HydrophobicContact CD1-CD1 4.06Å; Y186-F225 HydrophobicContact CD1-CD2 4.48Å; Y186-F225 HydrophobicContact CD1-CE1 4.26Å; Y186-F225 HydrophobicContact CD1-CG 4.21Å; Y186-F225 HydrophobicContact CD2-CB 4.07Å; Y186-F225 HydrophobicContact CD2-CD2 4.09Å; Y186-F225 AromaticContact CD2-CG 3.99Å; Y186-F225 HydrophobicContact CD2-CG 3.99Å; Y186-F225 HydrophobicContact CE1-CB 4.47Å; Y186-F225 AromaticContact CE1-CD1 3.85Å; Y186-F225 HydrophobicContact CE1-CD1 3.85Å; Y186-F225 HydrophobicContact CE1-CE1 4.36Å; Y186-F225 HydrophobicContact CE1-CG 4.13Å; Y186-F225 HydrophobicContact CE2-CB 3.62Å; Y186-F225 HydrophobicContact CE2-CD1 4.45Å; Y186-F225 HydrophobicContact CE2-CD2 4.47Å; Y186-F225 AromaticContact CE2-CG 3.93Å; Y186-F225 HydrophobicContact CE2-CG 3.93Å; Y186-F225 HydrophobicContact CG-CD1 4.44Å; Y186-F225 HydrophobicContact CG-CD2 4.09Å; Y186-F225 HydrophobicContact CG-CE2 4.46Å; Y186-F225 HydrophobicContact CG-CG 4.13Å; Y186-F225 AromaticContact CZ-CG 3.99Å
187	N	73.5	Confident	67.7	Low	88 Å²	88	79 Å²	79	47%	0.471	45%	0.454	S	S	.	.			trans	-96.1	113.6	172.3	-66	-49.5	0	0	0	108.7	Q177	Q177-N187 VanDerWaalsContact CD-ND2 3.29Å; Q177-N187 PolarHBondContact NE2-ND2 2.99Å; Q177-N187 PolarHBondContact OE1-ND2 2.76Å
188	L	77.1	Confident	68.8	Low	51 Å²	51	76.7 Å²	76.7	27%	0.267	44%	0.44	S	S	.	.			trans	-110.4	109.5	-177.6	-72.3	134.8	0	0	0	109.6	I192 I193 I196 W221 F225	L188-I192 HydrophobicContact CD2-CG2 4.06Å; L188-I193 HydrophobicContact CB-CD1 4.23Å; L188-I193 HydrophobicContact CB-CG1 4.21Å; L188-I193 HydrophobicContact CD2-CG1 4.11Å; L188-I196 HydrophobicContact CD2-CD1 4.15Å; L188-W221 HydrophobicContact CD1-CB 3.96Å; L188-W221 HydrophobicContact CD1-CG 4.05Å; L188-W221 HydrophobicContact CD2-CD2 4.47Å; L188-W221 HydrophobicContact CD2-CE3 4.47Å; L188-F225 HydrophobicContact CD1-CE2 3.8Å; L188-F225 HydrophobicContact CD2-CE2 3.72Å; L188-F225 HydrophobicContact CD2-CZ 3.82Å; L188-F225 HydrophobicContact CG-CE2 4.18Å
189	T	78.2	Confident	69.9	Low	81 Å²	81	70.9 Å²	70.9	50%	0.497	41%	0.405	S	S	.	.			trans	-82.5	156.3	169.3	-49.2	0	0	0	0	109.7	D191 I192 I193	T189-D191 PolarHBondContact O-N 3.01Å; T189-I192 WeakPolarHBondContact O-CA 3.45Å; T189-I192 WeakPolarHBondContact O-CB 3.37Å; T189-I192 PolarHBondContact O-N 3.3Å; T189-I193 PolarHBondContact O-N 3.21Å
190	A	77.1	Confident	71.5	Confident	71 Å²	71	67 Å²	67	59%	0.587	38%	0.383	S	S	*	.	H	α-helix	trans	-52.2	-39.6	176	0	0	0	0	0	112.7	I192 I193 E194	A190-I192 VanDerWaalsContact C-N 3.32Å; A190-I192 PolarHBondContact O-N 3.1Å; A190-I193 PolarHBondContact O-N 2.94Å; A190-E194 WeakPolarHBondContact O-CB 3.47Å; A190-E194 PolarHBondContact O-N 3.37Å
191	D	76.3	Confident	73.1	Confident	111 Å²	111	65 Å²	65	59%	0.594	36%	0.356	S	S	*	.	H	α-helix	trans	-66.2	-33.2	177.5	-56.7	-25.7	0	0	0	112.8	T189 S195	T189-D191 PolarHBondContact O-N 3.01Å; D191-S195 WeakPolarHBondContact O-CB 3.38Å; D191-S195 PolarHBondContact O-N 3Å; D191-S195 PolarHBondContact O-OG 3.14Å
192	I	78.7	Confident	74.8	Confident	34 Å²	34	59.5 Å²	59.5	17%	0.174	32%	0.318	C	S	.	.	H	α-helix	trans	-68.3	-46.5	176.4	-61.4	-178.8	0	0	0	109	F170 I174 L188 T189 A190 E194 S195 I196	F170-I192 HydrophobicContact CE2-CB 4.12Å; F170-I192 HydrophobicContact CE2-CG1 4.02Å; F170-I192 HydrophobicContact CE2-CG2 3.99Å; F170-I192 HydrophobicContact CZ-CB 3.9Å; F170-I192 HydrophobicContact CZ-CG1 4.31Å; F170-I192 HydrophobicContact CZ-CG2 3.47Å; F170-I192 VanDerWaalsContact CZ-CG2 3.47Å; F170-I192 WeakPolarHBondContact CZ-O 3.44Å; I174-I192 HydrophobicContact CD1-CG2 3.71Å; I174-I192 HydrophobicContact CG1-CG2 4.2Å; L188-I192 HydrophobicContact CD2-CG2 4.06Å; T189-I192 WeakPolarHBondContact O-CA 3.45Å; T189-I192 WeakPolarHBondContact O-CB 3.37Å; T189-I192 PolarHBondContact O-N 3.3Å; A190-I192 VanDerWaalsContact C-N 3.32Å; A190-I192 PolarHBondContact O-N 3.1Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 2.95Å; I192-S195 WeakPolarHBondContact O-CB 3.45Å; I192-S195 PolarHBondContact O-N 2.84Å; I192-I196 HydrophobicContact CG2-CD1 4.19Å; I192-I196 VanDerWaalsContact O-CG1 3.3Å; I192-I196 WeakPolarHBondContact O-CG1 3.47Å; I192-I196 PolarHBondContact O-N 3.03Å
193	I	81.7	Confident	76.2	Confident	22 Å²	22	50.6 Å²	50.6	11%	0.113	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-44.7	177.4	-68.2	169.8	0	0	0	110.8	L188 T189 A190 S195 I196 F197 W221	L188-I193 HydrophobicContact CB-CD1 4.23Å; L188-I193 HydrophobicContact CB-CG1 4.21Å; L188-I193 HydrophobicContact CD2-CG1 4.11Å; T189-I193 PolarHBondContact O-N 3.21Å; A190-I193 PolarHBondContact O-N 2.94Å; I193-S195 VanDerWaalsContact C-N 3.33Å; I193-S195 PolarHBondContact O-N 3.44Å; I193-I196 PolarHBondContact O-N 2.96Å; I193-F197 HydrophobicContact CG2-CD2 3.88Å; I193-F197 HydrophobicContact CG2-CE1 4.38Å; I193-F197 HydrophobicContact CG2-CE2 3.36Å; I193-F197 HydrophobicContact CG2-CZ 3.64Å; I193-F197 WeakPolarHBondContact O-CG 3.35Å; I193-F197 PolarHBondContact O-N 2.96Å; I193-W221 HydrophobicContact CB-CZ2 4.16Å; I193-W221 HydrophobicContact CD1-CZ2 4.3Å; I193-W221 HydrophobicContact CG1-CH2 4.43Å; I193-W221 HydrophobicContact CG1-CZ2 3.82Å; I193-W221 HydrophobicContact CG2-CH2 4.08Å; I193-W221 HydrophobicContact CG2-CZ2 3.52Å
194	E	80.3	Confident	77.6	Confident	89 Å²	89	54.8 Å²	54.8	42%	0.416	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-40.6	178	-170.3	175.8	167.6	0	0	111.8	A190 I192 I196 F197 R198	A190-E194 WeakPolarHBondContact O-CB 3.47Å; A190-E194 PolarHBondContact O-N 3.37Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 2.95Å; E194-I196 PolarHBondContact O-N 3.33Å; E194-F197 PolarHBondContact O-N 3.18Å; E194-R198 WeakPolarHBondContact O-CG 3.5Å; E194-R198 PolarHBondContact O-N 3.45Å; E194-R198 IonicContact OE1-CZ 3.59Å; E194-R198 IonicContact OE1-NE 3.2Å; E194-R198 PolarHBondContact OE1-NE 3.48Å; E194-R198 VanDerWaalsContact OE1-NE 3.16Å; E194-R198 IonicContact OE1-NH2 3.71Å; E194-R198 PolarHBondContact OE1-NH2 2.98Å
195	S	79.6	Confident	78.7	Confident	22 Å²	22	53.6 Å²	53.6	15%	0.154	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-43.7	174.6	-61.6	0	0	0	0	111.5	F170 D191 I192 I193 F197 R198 T199	F170-S195 VanDerWaalsContact CE1-CB 3.44Å; D191-S195 WeakPolarHBondContact O-CB 3.38Å; D191-S195 PolarHBondContact O-N 3Å; D191-S195 PolarHBondContact O-OG 3.14Å; I192-S195 WeakPolarHBondContact O-CB 3.45Å; I192-S195 PolarHBondContact O-N 2.84Å; I193-S195 VanDerWaalsContact C-N 3.33Å; I193-S195 PolarHBondContact O-N 3.44Å; S195-F197 VanDerWaalsContact C-N 3.33Å; S195-F197 PolarHBondContact O-N 3.42Å; S195-R198 PolarHBondContact O-N 3.27Å; S195-T199 PolarHBondContact O-N 3.41Å; S195-T199 PolarHBondContact O-OG1 2.87Å; S195-T199 VanDerWaalsContact O-OG1 3.09Å
196	I	81.8	Confident	79.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-43.8	174.2	-65.9	167.1	0	0	0	110.8	F170 L171 I174 L188 I192 I193 E194 R198 T199 Y200 V203 W221 F224 F225	F170-I196 HydrophobicContact CE1-CG1 3.93Å; F170-I196 HydrophobicContact CZ-CG1 4.36Å; L171-I196 HydrophobicContact CD2-CG1 4.4Å; I174-I196 HydrophobicContact CD1-CD1 4.32Å; L188-I196 HydrophobicContact CD2-CD1 4.15Å; I192-I196 HydrophobicContact CG2-CD1 4.19Å; I192-I196 VanDerWaalsContact O-CG1 3.3Å; I192-I196 WeakPolarHBondContact O-CG1 3.47Å; I192-I196 PolarHBondContact O-N 3.03Å; I193-I196 PolarHBondContact O-N 2.96Å; E194-I196 PolarHBondContact O-N 3.33Å; I196-R198 VanDerWaalsContact C-N 3.33Å; I196-R198 PolarHBondContact O-N 3.37Å; I196-T199 PolarHBondContact O-N 2.72Å; I196-Y200 HydrophobicContact CG2-CD2 4.32Å; I196-Y200 PolarHBondContact O-N 2.91Å; I196-V203 HydrophobicContact CG2-CG1 4.36Å; I196-W221 HydrophobicContact CB-CH2 4.47Å; I196-W221 HydrophobicContact CD1-CH2 4.32Å; I196-W221 HydrophobicContact CD1-CZ3 3.92Å; I196-W221 HydrophobicContact CG2-CH2 4.14Å; I196-W221 HydrophobicContact CG2-CZ3 4.01Å; I196-F224 HydrophobicContact CD1-CE1 4.44Å; I196-F224 HydrophobicContact CG2-CE1 4.23Å; I196-F224 HydrophobicContact CG2-CZ 3.98Å; I196-F225 HydrophobicContact CD1-CZ 4.31Å
197	F	84.8	Confident	80.2	Confident	32 Å²	32	49.5 Å²	49.5	14%	0.14	26%	0.256	C	S	.	.	H	α-helix	trans	-66.5	-33.1	178.6	-70.7	-24.6	0	0	0	113.9	I193 E194 S195 V203 K204 Y207 W221	I193-F197 HydrophobicContact CG2-CD2 3.88Å; I193-F197 HydrophobicContact CG2-CE1 4.38Å; I193-F197 HydrophobicContact CG2-CE2 3.36Å; I193-F197 HydrophobicContact CG2-CZ 3.64Å; I193-F197 WeakPolarHBondContact O-CG 3.35Å; I193-F197 PolarHBondContact O-N 2.96Å; E194-F197 PolarHBondContact O-N 3.18Å; S195-F197 VanDerWaalsContact C-N 3.33Å; S195-F197 PolarHBondContact O-N 3.42Å; F197-V203 HydrophobicContact CE1-CG1 4.41Å; F197-K204 HydrophobicContact CB-CB 3.94Å; F197-K204 HydrophobicContact CB-CD 4.09Å; F197-K204 HydrophobicContact CB-CG 4.04Å; F197-K204 VanDerWaalsContact CD1-CA 3.49Å; F197-K204 HydrophobicContact CD1-CB 3.6Å; F197-K204 HydrophobicContact CD1-CG 4.01Å; F197-K204 HydrophobicContact CD2-CG 4.18Å; F197-K204 HydrophobicContact CE1-CB 4.25Å; F197-K204 HydrophobicContact CG-CB 3.82Å; F197-K204 HydrophobicContact CG-CD 4.37Å; F197-K204 HydrophobicContact CG-CG 3.83Å; F197-Y207 HydrophobicContact CE1-CD1 4.43Å; F197-Y207 HydrophobicContact CE1-CG 4.05Å; F197-Y207 HydrophobicContact CE2-CD1 4.27Å; F197-Y207 AromaticContact CZ-CD1 3.6Å; F197-Y207 HydrophobicContact CZ-CD1 3.6Å; F197-Y207 HydrophobicContact CZ-CD2 4.09Å; F197-Y207 HydrophobicContact CZ-CE1 4.12Å; F197-Y207 AromaticContact CZ-CG 3.58Å; F197-Y207 HydrophobicContact CZ-CG 3.58Å; F197-W221 HydrophobicContact CD1-CH2 4.45Å; F197-W221 AromaticContact CE1-CH2 3.78Å; F197-W221 HydrophobicContact CE1-CH2 3.78Å; F197-W221 HydrophobicContact CE1-CZ2 4Å; F197-W221 HydrophobicContact CZ-CH2 4.16Å; F197-W221 AromaticContact CZ-CZ2 3.92Å; F197-W221 HydrophobicContact CZ-CZ2 3.92Å
198	R	78.8	Confident	80.7	Confident	67 Å²	67	49.2 Å²	49.2	25%	0.253	26%	0.262	S	S	.	.	H	α-helix	trans	-72.8	-38.2	175.7	-69.6	175.3	-179.1	-128.9	-3.5	111.5	E163 I166 E194 S195 I196 A319	E163-R198 IonicContact OE1-CZ 2.96Å; E163-R198 IonicContact OE1-NH1 3.72Å; E163-R198 IonicContact OE1-NH2 3.49Å; E163-R198 PolarHBondContact OE1-NH2 3.38Å; E163-R198 IonicContact OE2-CZ 2.71Å; E163-R198 IonicContact OE2-NH1 3.7Å; E163-R198 PolarHBondContact OE2-NH1 2.74Å; E163-R198 IonicContact OE2-NH2 2.85Å; E163-R198 PolarHBondContact OE2-NH2 3.03Å; I166-R198 HydrophobicContact CD1-CB 3.36Å; I166-R198 HydrophobicContact CD1-CG 4.29Å; I166-R198 HydrophobicContact CG1-CB 4.48Å; E194-R198 WeakPolarHBondContact O-CG 3.5Å; E194-R198 PolarHBondContact O-N 3.45Å; E194-R198 IonicContact OE1-CZ 3.59Å; E194-R198 IonicContact OE1-NE 3.2Å; E194-R198 PolarHBondContact OE1-NE 3.48Å; E194-R198 VanDerWaalsContact OE1-NE 3.16Å; E194-R198 IonicContact OE1-NH2 3.71Å; E194-R198 PolarHBondContact OE1-NH2 2.98Å; S195-R198 PolarHBondContact O-N 3.27Å; I196-R198 VanDerWaalsContact C-N 3.33Å; I196-R198 PolarHBondContact O-N 3.37Å; R198-A319 HydrophobicContact CB-CB 4.48Å
199	T	75.8	Confident	81	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-76.6	-38.1	177.5	-54.4	0	0	0	0	113	S195 I196 P201 M315	S195-T199 PolarHBondContact O-N 3.41Å; S195-T199 PolarHBondContact O-OG1 2.87Å; S195-T199 VanDerWaalsContact O-OG1 3.09Å; I196-T199 PolarHBondContact O-N 2.72Å; T199-P201 WeakPolarHBondContact O-CD 3.47Å; T199-M315 WeakPolarHBondContact O-CB 3.49Å
200	Y	80.5	Confident	81.1	Confident	8 Å²	8	48 Å²	48	3%	0.031	25%	0.25	C	C	.	.			trans	-124.3	83.3	-178.3	-59.5	-64.4	0	0	0	111.6	L171 I196 A202 V203 K204 Y229	L171-Y200 HydrophobicContact CD1-CE2 3.55Å; L171-Y200 VanDerWaalsContact CD1-OH 3.23Å; L171-Y200 WeakPolarHBondContact CD1-OH 3.45Å; L171-Y200 HydrophobicContact CD2-CE2 4.23Å; I196-Y200 HydrophobicContact CG2-CD2 4.32Å; I196-Y200 PolarHBondContact O-N 2.91Å; Y200-A202 PolarHBondContact O-N 2.69Å; Y200-V203 HydrophobicContact CG-CG2 4.42Å; Y200-V203 WeakPolarHBondContact O-CB 3.44Å; Y200-V203 PolarHBondContact O-N 3.49Å; Y200-K204 PolarHBondContact O-N 2.64Å; Y200-Y229 HydrophobicContact CD1-CE1 4.15Å; Y200-Y229 AromaticContact CD1-CZ 3.91Å; Y200-Y229 WeakPolarHBondContact CD1-OH 3.49Å; Y200-Y229 HydrophobicContact CG-CE1 4.13Å
201	P	80.2	Confident	81.3	Confident	41 Å²	41	45.5 Å²	45.5	27%	0.266	23%	0.227	S	C	.	.	H	α-helix	trans	-59.4	-31.1	-179.2	-24.4	34.1	0	0	0	113.8	T199 V203 K204 Q205	T199-P201 WeakPolarHBondContact O-CD 3.47Å; P201-V203 VanDerWaalsContact C-N 3.26Å; P201-V203 PolarHBondContact O-N 2.87Å; P201-K204 WeakPolarHBondContact O-CB 3.32Å; P201-K204 PolarHBondContact O-N 2.98Å; P201-Q205 PolarHBondContact O-N 3.47Å
202	A	81.1	Confident	81.3	Confident	4 Å²	4	45 Å²	45	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-34	176.8	0	0	0	0	0	112.2	Y200 Q205 K206 C246	Y200-A202 PolarHBondContact O-N 2.69Å; A202-Q205 PolarHBondContact O-N 3.47Å; A202-K206 PolarHBondContact O-N 3Å; A202-K206 VanDerWaalsContact O-N 3.08Å; A202-C246 HydrophobicContact CB-CB 3.8Å
203	V	83.5	Confident	81	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.6	-39.9	175.8	-178.7	0	0	0	0	110.5	I196 F197 Y200 P201 Q205 K206 Y207 F220 W221 F224 Y229	I196-V203 HydrophobicContact CG2-CG1 4.36Å; F197-V203 HydrophobicContact CE1-CG1 4.41Å; Y200-V203 HydrophobicContact CG-CG2 4.42Å; Y200-V203 WeakPolarHBondContact O-CB 3.44Å; Y200-V203 PolarHBondContact O-N 3.49Å; P201-V203 VanDerWaalsContact C-N 3.26Å; P201-V203 PolarHBondContact O-N 2.87Å; V203-Q205 PolarHBondContact O-N 2.82Å; V203-K206 PolarHBondContact O-N 2.97Å; V203-Y207 WeakPolarHBondContact O-CB 3.43Å; V203-Y207 PolarHBondContact O-N 3.19Å; V203-F220 HydrophobicContact CG1-CE1 4.09Å; V203-F220 HydrophobicContact CG1-CZ 4.08Å; V203-W221 HydrophobicContact CG1-CH2 4.48Å; V203-W221 HydrophobicContact CG1-CZ3 4.4Å; V203-F224 HydrophobicContact CB-CE2 4.37Å; V203-F224 HydrophobicContact CG1-CD2 4Å; V203-F224 HydrophobicContact CG1-CE2 3.91Å; V203-F224 HydrophobicContact CG2-CD2 4.14Å; V203-F224 HydrophobicContact CG2-CE2 3.49Å; V203-F224 VanDerWaalsContact CG2-CE2 3.49Å; V203-F224 HydrophobicContact CG2-CZ 4.32Å; V203-Y229 HydrophobicContact CG2-CD1 4.32Å; V203-Y229 HydrophobicContact CG2-CE1 3.53Å
204	K	84.8	Confident	80.6	Confident	122 Å²	122	55.8 Å²	55.8	53%	0.53	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-44.4	175.1	-171.3	-174	-175.6	173	0	111.7	F197 Y200 P201 Y207 S208	F197-K204 HydrophobicContact CB-CB 3.94Å; F197-K204 HydrophobicContact CB-CD 4.09Å; F197-K204 HydrophobicContact CB-CG 4.04Å; F197-K204 VanDerWaalsContact CD1-CA 3.49Å; F197-K204 HydrophobicContact CD1-CB 3.6Å; F197-K204 HydrophobicContact CD1-CG 4.01Å; F197-K204 HydrophobicContact CD2-CG 4.18Å; F197-K204 HydrophobicContact CE1-CB 4.25Å; F197-K204 HydrophobicContact CG-CB 3.82Å; F197-K204 HydrophobicContact CG-CD 4.37Å; F197-K204 HydrophobicContact CG-CG 3.83Å; Y200-K204 PolarHBondContact O-N 2.64Å; P201-K204 WeakPolarHBondContact O-CB 3.32Å; P201-K204 PolarHBondContact O-N 2.98Å; K204-Y207 WeakPolarHBondContact O-CB 3.33Å; K204-Y207 PolarHBondContact O-N 3.04Å; K204-S208 PolarHBondContact O-N 3.48Å; K204-S208 VanDerWaalsContact O-N 3.07Å; K204-S208 PolarHBondContact O-OG 2.84Å
205	Q	84.3	Confident	80.6	Confident	90 Å²	90	52.5 Å²	52.5	42%	0.421	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-48.8	176.8	-176.9	177.4	-3.9	0	0	110.9	P201 A202 V203 Y207 S208 E209	P201-Q205 PolarHBondContact O-N 3.47Å; A202-Q205 PolarHBondContact O-N 3.47Å; V203-Q205 PolarHBondContact O-N 2.82Å; Q205-Y207 VanDerWaalsContact C-N 3.29Å; Q205-Y207 PolarHBondContact O-N 2.89Å; Q205-S208 PolarHBondContact O-N 2.93Å; Q205-S208 VanDerWaalsContact O-N 3.16Å; Q205-S208 PolarHBondContact O-OG 2.87Å; Q205-E209 VanDerWaalsContact CG-OE1 3.29Å; Q205-E209 WeakPolarHBondContact CG-OE1 3.45Å; Q205-E209 PolarHBondContact NE2-OE1 3.29Å; Q205-E209 WeakPolarHBondContact O-CG 3.41Å; Q205-E209 PolarHBondContact O-N 3.31Å
206	K	82.6	Confident	80.7	Confident	52 Å²	52	55 Å²	55	23%	0.226	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-31.1	178.1	-77.7	-68.1	171.2	-147.7	0	114	A202 V203 E209 N210 F220 I242	A202-K206 PolarHBondContact O-N 3Å; A202-K206 VanDerWaalsContact O-N 3.08Å; V203-K206 PolarHBondContact O-N 2.97Å; K206-E209 IonicContact NZ-OE2 3.87Å; K206-E209 PolarHBondContact NZ-OE2 3.14Å; K206-N210 WeakPolarHBondContact O-CB 3.3Å; K206-N210 PolarHBondContact O-N 3.11Å; K206-N210 VanDerWaalsContact O-N 3.11Å; K206-N210 PolarHBondContact O-ND2 2.99Å; K206-F220 HydrophobicContact CB-CE2 4.27Å; K206-F220 HydrophobicContact CB-CZ 4.44Å; K206-I242 HydrophobicContact CD-CG2 3.98Å
207	Y	84.6	Confident	80.6	Confident	54 Å²	54	59.3 Å²	59.3	21%	0.212	30%	0.302	C	S	.	.	H	α-helix	trans	-63	-48.4	171.9	-176.8	-98.6	0	0	0	110.9	F197 V203 K204 Q205 E209 N210 V211 E217 F220 W221	F197-Y207 HydrophobicContact CE1-CD1 4.43Å; F197-Y207 HydrophobicContact CE1-CG 4.05Å; F197-Y207 HydrophobicContact CE2-CD1 4.27Å; F197-Y207 AromaticContact CZ-CD1 3.6Å; F197-Y207 HydrophobicContact CZ-CD1 3.6Å; F197-Y207 HydrophobicContact CZ-CD2 4.09Å; F197-Y207 HydrophobicContact CZ-CE1 4.12Å; F197-Y207 AromaticContact CZ-CG 3.58Å; F197-Y207 HydrophobicContact CZ-CG 3.58Å; V203-Y207 WeakPolarHBondContact O-CB 3.43Å; V203-Y207 PolarHBondContact O-N 3.19Å; K204-Y207 WeakPolarHBondContact O-CB 3.33Å; K204-Y207 PolarHBondContact O-N 3.04Å; Q205-Y207 VanDerWaalsContact C-N 3.29Å; Q205-Y207 PolarHBondContact O-N 2.89Å; Y207-E209 VanDerWaalsContact C-N 3.32Å; Y207-E209 PolarHBondContact O-N 2.89Å; Y207-N210 PolarHBondContact O-N 3.43Å; Y207-V211 HydrophobicContact CD2-CB 4.14Å; Y207-V211 HydrophobicContact CD2-CG2 3.82Å; Y207-V211 HydrophobicContact CE2-CB 3.99Å; Y207-V211 HydrophobicContact CE2-CG1 3.99Å; Y207-V211 HydrophobicContact CE2-CG2 3.91Å; Y207-V211 WeakPolarHBondContact O-CB 3.43Å; Y207-V211 PolarHBondContact O-N 3.19Å; Y207-E217 HydrophobicContact CE2-CG 4.16Å; Y207-F220 AromaticContact CD2-CD1 3.75Å; Y207-F220 HydrophobicContact CD2-CD1 3.75Å; Y207-F220 AromaticContact CD2-CE1 3.77Å; Y207-F220 HydrophobicContact CD2-CE1 3.77Å; Y207-F220 HydrophobicContact CD2-CG 4.28Å; Y207-F220 HydrophobicContact CD2-CZ 4.3Å; Y207-F220 HydrophobicContact CE2-CD1 4.44Å; Y207-F220 HydrophobicContact CG-CE1 4.44Å; Y207-W221 HydrophobicContact CD2-CZ2 4.45Å
208	S	83.5	Confident	80.3	Confident	83 Å²	83	65.9 Å²	65.9	58%	0.58	33%	0.331	S	S	*	.	H	α-helix	trans	-66.5	-29	179.3	62.7	0	0	0	0	114.6	K204 Q205	K204-S208 PolarHBondContact O-N 3.48Å; K204-S208 VanDerWaalsContact O-N 3.07Å; K204-S208 PolarHBondContact O-OG 2.84Å; Q205-S208 PolarHBondContact O-N 2.93Å; Q205-S208 VanDerWaalsContact O-N 3.16Å; Q205-S208 PolarHBondContact O-OG 2.87Å
209	E	84.1	Confident	80.3	Confident	83 Å²	83	67.3 Å²	67.3	39%	0.388	34%	0.34	S	S	.	.	H	α-helix	trans	-80.9	-34.7	179.8	-71.8	171.9	-173.6	0	0	112.5	Q205 K206 Y207	Q205-E209 VanDerWaalsContact CG-OE1 3.29Å; Q205-E209 WeakPolarHBondContact CG-OE1 3.45Å; Q205-E209 PolarHBondContact NE2-OE1 3.29Å; Q205-E209 WeakPolarHBondContact O-CG 3.41Å; Q205-E209 PolarHBondContact O-N 3.31Å; K206-E209 IonicContact NZ-OE2 3.87Å; K206-E209 PolarHBondContact NZ-OE2 3.14Å; Y207-E209 VanDerWaalsContact C-N 3.32Å; Y207-E209 PolarHBondContact O-N 2.89Å
210	N	78.8	Confident	80.7	Confident	23 Å²	23	67.3 Å²	67.3	12%	0.123	34%	0.34	C	S	.	.	H	α-helix	trans	-109	-22.6	-170	-65.1	-61.2	0	0	0	114.7	K206 Y207 H213 N214 L215	K206-N210 WeakPolarHBondContact O-CB 3.3Å; K206-N210 PolarHBondContact O-N 3.11Å; K206-N210 VanDerWaalsContact O-N 3.11Å; K206-N210 PolarHBondContact O-ND2 2.99Å; Y207-N210 PolarHBondContact O-N 3.43Å; N210-H213 PolarHBondContact O-N 2.81Å; N210-N214 HydrophobicContact CB-CB 4.28Å; N210-N214 WeakPolarHBondContact O-CA 3.26Å; N210-N214 PolarHBondContact O-N 3.34Å; N210-N214 PolarHBondContact OD1-ND2 3Å; N210-L215 PolarHBondContact O-N 3.27Å
211	V	81.9	Confident	80.8	Confident	18 Å²	18	67.3 Å²	67.3	11%	0.109	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	124.8	178.9	-175.4	0	0	0	0	108.2	Y207 E217 F220	Y207-V211 HydrophobicContact CD2-CB 4.14Å; Y207-V211 HydrophobicContact CD2-CG2 3.82Å; Y207-V211 HydrophobicContact CE2-CB 3.99Å; Y207-V211 HydrophobicContact CE2-CG1 3.99Å; Y207-V211 HydrophobicContact CE2-CG2 3.91Å; Y207-V211 WeakPolarHBondContact O-CB 3.43Å; Y207-V211 PolarHBondContact O-N 3.19Å; V211-E217 HydrophobicContact CG1-CB 4.27Å; V211-F220 HydrophobicContact CG2-CB 3.79Å; V211-F220 HydrophobicContact CG2-CD2 4.01Å; V211-F220 HydrophobicContact CG2-CG 3.91Å
212	P	76.6	Confident	80.7	Confident	101 Å²	101	68.2 Å²	68.2	66%	0.656	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	cis	-95.7	-2.3	10.1	0.9	20	0	0	0	114.9
213	H	72.4	Confident	80.4	Confident	166 Å²	166	73.7 Å²	73.7	77%	0.769	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-32.9	-161	-64.7	-69.2	0	0	0	115.1	N210	N210-H213 PolarHBondContact O-N 2.81Å
214	N	73.3	Confident	80.2	Confident	116 Å²	116	73.8 Å²	73.8	62%	0.62	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-30.7	-177.2	-72.3	-31.6	0	0	0	113.3	N210	N210-N214 HydrophobicContact CB-CB 4.28Å; N210-N214 WeakPolarHBondContact O-CA 3.26Å; N210-N214 PolarHBondContact O-N 3.34Å; N210-N214 PolarHBondContact OD1-ND2 3Å
215	L	78.9	Confident	79.7	Confident	21 Å²	21	68 Å²	68	11%	0.11	34%	0.34	C	S	.	.	S	Bend	trans	-142.3	149.1	-179.3	-66.4	170.2	0	0	0	110.2	N210 I242	N210-L215 PolarHBondContact O-N 3.27Å; L215-I242 HydrophobicContact CD1-CD1 3.75Å
216	T	82.4	Confident	79	Confident	74 Å²	74	69.9 Å²	69.9	45%	0.454	35%	0.349	S	S	.	.			trans	-74.7	154.6	169.1	63	0	0	0	0	110.9	K218 E219 F220	T216-K218 PolarHBondContact O-N 3.39Å; T216-E219 PolarHBondContact N-OE2 3Å; T216-E219 VanDerWaalsContact N-OE2 3.11Å; T216-E219 PolarHBondContact O-N 3.45Å; T216-E219 VanDerWaalsContact O-N 3.09Å; T216-E219 WeakPolarHBondContact OG1-CB 3.44Å; T216-E219 VanDerWaalsContact OG1-CG 3.23Å; T216-E219 WeakPolarHBondContact OG1-CG 3.15Å; T216-E219 PolarHBondContact OG1-N 2.96Å; T216-E219 PolarHBondContact OG1-OE2 3.41Å; T216-F220 PolarHBondContact O-N 2.82Å
217	E	80.3	Confident	78.3	Confident	90 Å²	90	67.5 Å²	67.5	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-54.2	-40	177.6	178.6	171.7	-168.8	0	0	111.8	Y207 V211 F220 W221	Y207-E217 HydrophobicContact CE2-CG 4.16Å; V211-E217 HydrophobicContact CG1-CB 4.27Å; E217-F220 PolarHBondContact O-N 3.25Å; E217-W221 VanDerWaalsContact CG-CD1 3.5Å; E217-W221 PolarHBondContact O-N 3.02Å
218	K	78.4	Confident	77.1	Confident	170 Å²	170	69.3 Å²	69.3	74%	0.739	35%	0.349	S	S	*	.	H	α-helix	trans	-62.7	-44.6	177.2	-173	179.8	179.6	-175.7	0	112.3	T216 T222	T216-K218 PolarHBondContact O-N 3.39Å; K218-T222 VanDerWaalsContact O-CB 3.27Å; K218-T222 WeakPolarHBondContact O-CB 3.49Å; K218-T222 PolarHBondContact O-N 3.37Å; K218-T222 PolarHBondContact O-OG1 3Å
219	E	79.6	Confident	76.3	Confident	97 Å²	97	66.3 Å²	66.3	45%	0.453	33%	0.325	S	S	.	.	H	α-helix	trans	-70.5	-38.2	179.1	-71.3	164.4	150.2	0	0	111.8	T216 T222 R223	T216-E219 PolarHBondContact N-OE2 3Å; T216-E219 VanDerWaalsContact N-OE2 3.11Å; T216-E219 PolarHBondContact O-N 3.45Å; T216-E219 VanDerWaalsContact O-N 3.09Å; T216-E219 WeakPolarHBondContact OG1-CB 3.44Å; T216-E219 VanDerWaalsContact OG1-CG 3.23Å; T216-E219 WeakPolarHBondContact OG1-CG 3.15Å; T216-E219 PolarHBondContact OG1-N 2.96Å; T216-E219 PolarHBondContact OG1-OE2 3.41Å; E219-T222 PolarHBondContact O-N 2.91Å; E219-R223 WeakPolarHBondContact O-CG 3.24Å; E219-R223 PolarHBondContact O-N 3.5Å
220	F	83.8	Confident	75.4	Confident	1 Å²	1	63.9 Å²	63.9	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-52.3	175.9	-180	-90	0	0	0	111.3	V203 K206 Y207 V211 T216 E217 T222 R223 F224 F243	V203-F220 HydrophobicContact CG1-CE1 4.09Å; V203-F220 HydrophobicContact CG1-CZ 4.08Å; K206-F220 HydrophobicContact CB-CE2 4.27Å; K206-F220 HydrophobicContact CB-CZ 4.44Å; Y207-F220 AromaticContact CD2-CD1 3.75Å; Y207-F220 HydrophobicContact CD2-CD1 3.75Å; Y207-F220 AromaticContact CD2-CE1 3.77Å; Y207-F220 HydrophobicContact CD2-CE1 3.77Å; Y207-F220 HydrophobicContact CD2-CG 4.28Å; Y207-F220 HydrophobicContact CD2-CZ 4.3Å; Y207-F220 HydrophobicContact CE2-CD1 4.44Å; Y207-F220 HydrophobicContact CG-CE1 4.44Å; V211-F220 HydrophobicContact CG2-CB 3.79Å; V211-F220 HydrophobicContact CG2-CD2 4.01Å; V211-F220 HydrophobicContact CG2-CG 3.91Å; T216-F220 PolarHBondContact O-N 2.82Å; E217-F220 PolarHBondContact O-N 3.25Å; F220-T222 VanDerWaalsContact C-N 3.34Å; F220-T222 PolarHBondContact O-N 2.88Å; F220-R223 PolarHBondContact O-N 3.4Å; F220-F224 WeakPolarHBondContact O-CB 3.26Å; F220-F224 PolarHBondContact O-N 3.24Å; F220-F243 HydrophobicContact CD2-CZ 4.09Å; F220-F243 HydrophobicContact CE1-CE1 4.34Å; F220-F243 HydrophobicContact CE1-CZ 4.27Å; F220-F243 AromaticContact CE2-CE1 3.85Å; F220-F243 HydrophobicContact CE2-CE1 3.85Å; F220-F243 AromaticContact CE2-CZ 3.68Å; F220-F243 HydrophobicContact CE2-CZ 3.68Å; F220-F243 AromaticContact CZ-CE1 3.65Å; F220-F243 HydrophobicContact CZ-CE1 3.65Å; F220-F243 AromaticContact CZ-CZ 3.79Å; F220-F243 HydrophobicContact CZ-CZ 3.79Å
221	W	81.6	Confident	74.7	Confident	8 Å²	8	66 Å²	66	3%	0.03	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-37.6	178.3	-70.1	120.1	0	0	0	112	L188 I193 I196 F197 V203 Y207 E217 R223 F224 F225	L188-W221 HydrophobicContact CD1-CB 3.96Å; L188-W221 HydrophobicContact CD1-CG 4.05Å; L188-W221 HydrophobicContact CD2-CD2 4.47Å; L188-W221 HydrophobicContact CD2-CE3 4.47Å; I193-W221 HydrophobicContact CB-CZ2 4.16Å; I193-W221 HydrophobicContact CD1-CZ2 4.3Å; I193-W221 HydrophobicContact CG1-CH2 4.43Å; I193-W221 HydrophobicContact CG1-CZ2 3.82Å; I193-W221 HydrophobicContact CG2-CH2 4.08Å; I193-W221 HydrophobicContact CG2-CZ2 3.52Å; I196-W221 HydrophobicContact CB-CH2 4.47Å; I196-W221 HydrophobicContact CD1-CH2 4.32Å; I196-W221 HydrophobicContact CD1-CZ3 3.92Å; I196-W221 HydrophobicContact CG2-CH2 4.14Å; I196-W221 HydrophobicContact CG2-CZ3 4.01Å; F197-W221 HydrophobicContact CD1-CH2 4.45Å; F197-W221 AromaticContact CE1-CH2 3.78Å; F197-W221 HydrophobicContact CE1-CH2 3.78Å; F197-W221 HydrophobicContact CE1-CZ2 4Å; F197-W221 HydrophobicContact CZ-CH2 4.16Å; F197-W221 AromaticContact CZ-CZ2 3.92Å; F197-W221 HydrophobicContact CZ-CZ2 3.92Å; V203-W221 HydrophobicContact CG1-CH2 4.48Å; V203-W221 HydrophobicContact CG1-CZ3 4.4Å; Y207-W221 HydrophobicContact CD2-CZ2 4.45Å; E217-W221 VanDerWaalsContact CG-CD1 3.5Å; E217-W221 PolarHBondContact O-N 3.02Å; W221-R223 VanDerWaalsContact C-N 3.34Å; W221-R223 PolarHBondContact O-N 2.88Å; W221-F224 HydrophobicContact CE3-CB 4.21Å; W221-F224 AromaticContact CE3-CD1 3.81Å; W221-F224 HydrophobicContact CE3-CD1 3.81Å; W221-F224 HydrophobicContact CE3-CG 4.14Å; W221-F224 AromaticContact CZ3-CD1 3.9Å; W221-F224 HydrophobicContact CZ3-CD1 3.9Å; W221-F224 HydrophobicContact CZ3-CE1 4.21Å; W221-F224 HydrophobicContact CZ3-CG 4.25Å; W221-F224 WeakPolarHBondContact O-CB 3.32Å; W221-F224 PolarHBondContact O-N 3.49Å; W221-F225 HydrophobicContact CB-CD2 4.48Å; W221-F225 HydrophobicContact CB-CE2 4.44Å; W221-F225 HydrophobicContact CE3-CE2 4.19Å; W221-F225 WeakPolarHBondContact O-CD2 3.3Å; W221-F225 PolarHBondContact O-N 3.46Å
222	T	78.1	Confident	73.5	Confident	60 Å²	60	72 Å²	72	37%	0.368	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-45.4	175.1	-59.3	0	0	0	0	111.2	K218 E219 F220 Q226	K218-T222 VanDerWaalsContact O-CB 3.27Å; K218-T222 WeakPolarHBondContact O-CB 3.49Å; K218-T222 PolarHBondContact O-N 3.37Å; K218-T222 PolarHBondContact O-OG1 3Å; E219-T222 PolarHBondContact O-N 2.91Å; F220-T222 VanDerWaalsContact C-N 3.34Å; F220-T222 PolarHBondContact O-N 2.88Å; T222-Q226 VanDerWaalsContact CG2-NE2 3.28Å; T222-Q226 VanDerWaalsContact O-CB 3.31Å; T222-Q226 WeakPolarHBondContact O-CB 3.24Å; T222-Q226 WeakPolarHBondContact O-CG 3.35Å; T222-Q226 PolarHBondContact O-N 3.26Å
223	R	76	Confident	72.1	Confident	119 Å²	119	72.2 Å²	72.2	45%	0.449	34%	0.339	S	S	.	.	H	α-helix	trans	-68.6	-36.6	174.9	-71.8	-161.4	-176.8	152.6	4.5	112.5	E219 F220 W221 Q226 S227 F243	E219-R223 WeakPolarHBondContact O-CG 3.24Å; E219-R223 PolarHBondContact O-N 3.5Å; F220-R223 PolarHBondContact O-N 3.4Å; W221-R223 VanDerWaalsContact C-N 3.34Å; W221-R223 PolarHBondContact O-N 2.88Å; R223-Q226 CarbonylContact O-C 3.52Å; R223-Q226 PolarHBondContact O-N 2.88Å; R223-S227 WeakPolarHBondContact O-CA 3.37Å; R223-S227 WeakPolarHBondContact O-CB 3.49Å; R223-S227 PolarHBondContact O-N 2.86Å; R223-F243 HydrophobicContact CB-CE2 3.98Å
224	F	77.8	Confident	71.3	Confident	1 Å²	1	72.9 Å²	72.9	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-59.9	-49.3	175	175.8	-101.8	0	0	0	111.7	I196 V203 F220 W221 Q226 S227 Y229 F230 F243	I196-F224 HydrophobicContact CD1-CE1 4.44Å; I196-F224 HydrophobicContact CG2-CE1 4.23Å; I196-F224 HydrophobicContact CG2-CZ 3.98Å; V203-F224 HydrophobicContact CB-CE2 4.37Å; V203-F224 HydrophobicContact CG1-CD2 4Å; V203-F224 HydrophobicContact CG1-CE2 3.91Å; V203-F224 HydrophobicContact CG2-CD2 4.14Å; V203-F224 HydrophobicContact CG2-CE2 3.49Å; V203-F224 VanDerWaalsContact CG2-CE2 3.49Å; V203-F224 HydrophobicContact CG2-CZ 4.32Å; F220-F224 WeakPolarHBondContact O-CB 3.26Å; F220-F224 PolarHBondContact O-N 3.24Å; W221-F224 HydrophobicContact CE3-CB 4.21Å; W221-F224 AromaticContact CE3-CD1 3.81Å; W221-F224 HydrophobicContact CE3-CD1 3.81Å; W221-F224 HydrophobicContact CE3-CG 4.14Å; W221-F224 AromaticContact CZ3-CD1 3.9Å; W221-F224 HydrophobicContact CZ3-CD1 3.9Å; W221-F224 HydrophobicContact CZ3-CE1 4.21Å; W221-F224 HydrophobicContact CZ3-CG 4.25Å; W221-F224 WeakPolarHBondContact O-CB 3.32Å; W221-F224 PolarHBondContact O-N 3.49Å; F224-Q226 PolarHBondContact O-N 3.48Å; F224-S227 WeakPolarHBondContact O-CB 3.37Å; F224-S227 PolarHBondContact O-N 3.33Å; F224-S227 PolarHBondContact O-OG 3.12Å; F224-Y229 HydrophobicContact CD2-CD1 4.31Å; F224-Y229 AromaticContact CE2-CD1 3.61Å; F224-Y229 HydrophobicContact CE2-CD1 3.61Å; F224-Y229 AromaticContact CE2-CE1 3.82Å; F224-Y229 HydrophobicContact CE2-CE1 3.82Å; F224-Y229 HydrophobicContact CZ-CD1 4.41Å; F224-F230 HydrophobicContact CE1-CD2 4.08Å; F224-F230 HydrophobicContact CZ-CD2 4.43Å; F224-F230 WeakPolarHBondContact O-CB 3.36Å; F224-F243 HydrophobicContact CB-CE1 4.23Å; F224-F243 HydrophobicContact CB-CE2 4.15Å; F224-F243 HydrophobicContact CB-CZ 3.78Å; F224-F243 HydrophobicContact CD2-CD1 4.07Å; F224-F243 AromaticContact CD2-CE1 3.83Å; F224-F243 HydrophobicContact CD2-CE1 3.83Å; F224-F243 HydrophobicContact CD2-CZ 4.24Å
225	F	74.1	Confident	69.9	Low	1 Å²	1	74.1 Å²	74.1	0%	0.004	34%	0.339	C	S	.	.	H	α-helix	trans	-69.4	-32.4	177.6	-73.8	-70.1	0	0	0	112.3	I174 Y186 L188 I196 W221 S227 F230 H231	I174-F225 HydrophobicContact CG2-CE1 3.8Å; I174-F225 HydrophobicContact CG2-CZ 4.03Å; Y186-F225 HydrophobicContact CD1-CD1 4.06Å; Y186-F225 HydrophobicContact CD1-CD2 4.48Å; Y186-F225 HydrophobicContact CD1-CE1 4.26Å; Y186-F225 HydrophobicContact CD1-CG 4.21Å; Y186-F225 HydrophobicContact CD2-CB 4.07Å; Y186-F225 HydrophobicContact CD2-CD2 4.09Å; Y186-F225 AromaticContact CD2-CG 3.99Å; Y186-F225 HydrophobicContact CD2-CG 3.99Å; Y186-F225 HydrophobicContact CE1-CB 4.47Å; Y186-F225 AromaticContact CE1-CD1 3.85Å; Y186-F225 HydrophobicContact CE1-CD1 3.85Å; Y186-F225 HydrophobicContact CE1-CE1 4.36Å; Y186-F225 HydrophobicContact CE1-CG 4.13Å; Y186-F225 HydrophobicContact CE2-CB 3.62Å; Y186-F225 HydrophobicContact CE2-CD1 4.45Å; Y186-F225 HydrophobicContact CE2-CD2 4.47Å; Y186-F225 AromaticContact CE2-CG 3.93Å; Y186-F225 HydrophobicContact CE2-CG 3.93Å; Y186-F225 HydrophobicContact CG-CD1 4.44Å; Y186-F225 HydrophobicContact CG-CD2 4.09Å; Y186-F225 HydrophobicContact CG-CE2 4.46Å; Y186-F225 HydrophobicContact CG-CG 4.13Å; Y186-F225 AromaticContact CZ-CG 3.99Å; L188-F225 HydrophobicContact CD1-CE2 3.8Å; L188-F225 HydrophobicContact CD2-CE2 3.72Å; L188-F225 HydrophobicContact CD2-CZ 3.82Å; L188-F225 HydrophobicContact CG-CE2 4.18Å; I196-F225 HydrophobicContact CD1-CZ 4.31Å; W221-F225 HydrophobicContact CB-CD2 4.48Å; W221-F225 HydrophobicContact CB-CE2 4.44Å; W221-F225 HydrophobicContact CE3-CE2 4.19Å; W221-F225 WeakPolarHBondContact O-CD2 3.3Å; W221-F225 PolarHBondContact O-N 3.46Å; F225-S227 VanDerWaalsContact C-N 3.33Å; F225-F230 AromaticContact CD1-CD1 3.83Å; F225-F230 HydrophobicContact CD1-CD1 3.83Å; F225-F230 HydrophobicContact CD1-CD2 4.06Å; F225-F230 AromaticContact CD1-CE1 3.66Å; F225-F230 HydrophobicContact CD1-CE1 3.66Å; F225-F230 AromaticContact CD1-CE2 3.89Å; F225-F230 HydrophobicContact CD1-CE2 3.89Å; F225-F230 HydrophobicContact CD1-CG 4.04Å; F225-F230 AromaticContact CD1-CZ 3.69Å; F225-F230 HydrophobicContact CD1-CZ 3.69Å; F225-F230 HydrophobicContact CE1-CD2 4.14Å; F225-F230 HydrophobicContact CE1-CE1 4.18Å; F225-F230 AromaticContact CE1-CE2 3.68Å; F225-F230 HydrophobicContact CE1-CE2 3.68Å; F225-F230 AromaticContact CE1-CZ 3.7Å; F225-F230 HydrophobicContact CE1-CZ 3.7Å; F225-H231 PolarHBondContact O-CE1 3.38Å; F225-H231 PolarHBondContact O-ND1 2.87Å
226	Q	70.3	Confident	68.2	Low	129 Å²	129	80.8 Å²	80.8	60%	0.603	38%	0.375	S	S	*	.	H	α-helix	trans	-77.2	-19.3	175.3	-70.5	171.5	3.6	0	0	113.7	T222 R223 F224	T222-Q226 VanDerWaalsContact CG2-NE2 3.28Å; T222-Q226 VanDerWaalsContact O-CB 3.31Å; T222-Q226 WeakPolarHBondContact O-CB 3.24Å; T222-Q226 WeakPolarHBondContact O-CG 3.35Å; T222-Q226 PolarHBondContact O-N 3.26Å; R223-Q226 CarbonylContact O-C 3.52Å; R223-Q226 PolarHBondContact O-N 2.88Å; F224-Q226 PolarHBondContact O-N 3.48Å
227	S	67.9	Low	66.3	Low	2 Å²	2	81.5 Å²	81.5	1%	0.014	38%	0.38	C	S	.	.	S	Bend	trans	-65.2	153	-175.5	72	0	0	0	0	112.5	R223 F224 F225 Y229 F230 H231 D241	R223-S227 WeakPolarHBondContact O-CA 3.37Å; R223-S227 WeakPolarHBondContact O-CB 3.49Å; R223-S227 PolarHBondContact O-N 2.86Å; F224-S227 WeakPolarHBondContact O-CB 3.37Å; F224-S227 PolarHBondContact O-N 3.33Å; F224-S227 PolarHBondContact O-OG 3.12Å; F225-S227 VanDerWaalsContact C-N 3.33Å; S227-Y229 PolarHBondContact O-N 3.39Å; S227-Y229 WeakPolarHBondContact OG-CB 3.28Å; S227-Y229 PolarHBondContact OG-N 2.87Å; S227-F230 PolarHBondContact O-N 2.85Å; S227-F230 VanDerWaalsContact O-N 3.15Å; S227-F230 PolarHBondContact OG-N 3.47Å; S227-H231 PolarHBondContact O-N 3.41Å; S227-D241 WeakPolarHBondContact CA-OD2 3.48Å; S227-D241 WeakPolarHBondContact CB-OD2 3.39Å
228	H	60.2	Low	64.5	Low	93 Å²	93	80 Å²	80	43%	0.431	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.5	168.3	-179.2	-101.3	0	0	0	112	F230 R234	H228-F230 VanDerWaalsContact C-N 3.27Å; H228-F230 PolarHBondContact O-N 3.08Å; H228-R234 PolarHBondContact CD2-O 3.3Å; H228-R234 VanDerWaalsContact CD2-O 3.24Å
229	Y	65.9	Low	62.9	Low	19 Å²	19	77.9 Å²	77.9	8%	0.075	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-29.1	178.9	-172.8	-100.7	0	0	0	112.4	Y200 V203 F224 S227 F243 C246 A247 D250 R308	Y200-Y229 HydrophobicContact CD1-CE1 4.15Å; Y200-Y229 AromaticContact CD1-CZ 3.91Å; Y200-Y229 WeakPolarHBondContact CD1-OH 3.49Å; Y200-Y229 HydrophobicContact CG-CE1 4.13Å; V203-Y229 HydrophobicContact CG2-CD1 4.32Å; V203-Y229 HydrophobicContact CG2-CE1 3.53Å; F224-Y229 HydrophobicContact CD2-CD1 4.31Å; F224-Y229 AromaticContact CE2-CD1 3.61Å; F224-Y229 HydrophobicContact CE2-CD1 3.61Å; F224-Y229 AromaticContact CE2-CE1 3.82Å; F224-Y229 HydrophobicContact CE2-CE1 3.82Å; F224-Y229 HydrophobicContact CZ-CD1 4.41Å; S227-Y229 PolarHBondContact O-N 3.39Å; S227-Y229 WeakPolarHBondContact OG-CB 3.28Å; S227-Y229 PolarHBondContact OG-N 2.87Å; Y229-F243 HydrophobicContact CG-CB 4.33Å; Y229-C246 HydrophobicContact CD2-CB 4.14Å; Y229-C246 HydrophobicContact CE2-CB 3.74Å; Y229-A247 HydrophobicContact CD2-CB 3.97Å; Y229-A247 HydrophobicContact CE2-CB 4.42Å; Y229-D250 VanDerWaalsContact CE2-OD2 3.31Å; Y229-D250 WeakPolarHBondContact CE2-OD2 3.35Å; Y229-D250 VanDerWaalsContact CZ-OD2 3.29Å; Y229-D250 PolarHBondContact OH-OD2 3.26Å; Y229-R308 PolarHBondContact O-NH2 2.83Å
230	F	65.5	Low	61.6	Low	32 Å²	32	82.2 Å²	82.2	14%	0.14	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-47.6	175.8	-173.6	-100.8	0	0	0	113.2	L171 F224 F225 S227 H228 R308	L171-F230 HydrophobicContact CD2-CE2 4.43Å; F224-F230 HydrophobicContact CE1-CD2 4.08Å; F224-F230 HydrophobicContact CZ-CD2 4.43Å; F224-F230 WeakPolarHBondContact O-CB 3.36Å; F225-F230 AromaticContact CD1-CD1 3.83Å; F225-F230 HydrophobicContact CD1-CD1 3.83Å; F225-F230 HydrophobicContact CD1-CD2 4.06Å; F225-F230 AromaticContact CD1-CE1 3.66Å; F225-F230 HydrophobicContact CD1-CE1 3.66Å; F225-F230 AromaticContact CD1-CE2 3.89Å; F225-F230 HydrophobicContact CD1-CE2 3.89Å; F225-F230 HydrophobicContact CD1-CG 4.04Å; F225-F230 AromaticContact CD1-CZ 3.69Å; F225-F230 HydrophobicContact CD1-CZ 3.69Å; F225-F230 HydrophobicContact CE1-CD2 4.14Å; F225-F230 HydrophobicContact CE1-CE1 4.18Å; F225-F230 AromaticContact CE1-CE2 3.68Å; F225-F230 HydrophobicContact CE1-CE2 3.68Å; F225-F230 AromaticContact CE1-CZ 3.7Å; F225-F230 HydrophobicContact CE1-CZ 3.7Å; S227-F230 PolarHBondContact O-N 2.85Å; S227-F230 VanDerWaalsContact O-N 3.15Å; S227-F230 PolarHBondContact OG-N 3.47Å; H228-F230 VanDerWaalsContact C-N 3.27Å; H228-F230 PolarHBondContact O-N 3.08Å; F230-R308 PolarHBondContact O-NH2 3.04Å
231	H	64.1	Low	60.6	Low	67 Å²	67	83.9 Å²	83.9	31%	0.31	42%	0.424	S	S	.	.			trans	-92.2	111.5	-174.4	-73	96.5	0	0	0	114	F225 S227 D233	F225-H231 PolarHBondContact O-CE1 3.38Å; F225-H231 PolarHBondContact O-ND1 2.87Å; S227-H231 PolarHBondContact O-N 3.41Å; H231-D233 PolarHBondContact O-N 3.07Å
232	R	55.8	Low	59.9	Low	145 Å²	145	86 Å²	86	55%	0.547	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-30.3	-173.2	-166.4	-175.4	73.6	-165.5	-7.8	117.2	I305	R232-I305 HydrophobicContact CG-CG1 4.15Å
233	D	48.6	Very low	59.5	Low	106 Å²	106	83.3 Å²	83.3	57%	0.567	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	6	-161.9	-61.4	-25	0	0	0	114.1	H231	H231-D233 PolarHBondContact O-N 3.07Å
234	R	53.9	Low	59.3	Low	180 Å²	180	80.2 Å²	80.2	68%	0.679	42%	0.415	S	S	*	.			trans	-102.7	83.8	-176.9	-75.1	-171.7	177.5	-135.7	0.9	112.5	H228 N236	H228-R234 PolarHBondContact CD2-O 3.3Å; H228-R234 VanDerWaalsContact CD2-O 3.24Å; R234-N236 PolarHBondContact O-N 2.98Å
235	I	44.9	Very low	58.9	Low	141 Å²	141	85.2 Å²	85.2	72%	0.723	44%	0.439	S	S	*	.			trans	-67.9	1.7	-173.9	-66.5	174.1	0	0	0	115
236	N	42.7	Very low	59	Low	161 Å²	161	85.3 Å²	85.3	86%	0.861	44%	0.439	S	S	*	.			trans	-142.1	55.6	-168.5	-121.9	11.1	0	0	0	116.2	R234	R234-N236 PolarHBondContact O-N 2.98Å
237	T	42.8	Very low	59	Low	90 Å²	90	81 Å²	81	55%	0.552	43%	0.426	S	S	*	.	S	Bend	trans	-108.2	120.4	160.3	-36.8	0	0	0	0	107.9
238	G	42.8	Very low	59.3	Low	58 Å²	58	87 Å²	87	60%	0.598	45%	0.451	S	S	*	.			trans	-45.5	152.9	-162.4	0	0	0	0	0	116.9	Q240	G238-Q240 PolarHBondContact O-N 3.41Å
239	S	44.9	Very low	60.1	Low	125 Å²	125	87 Å²	87	87%	0.874	45%	0.452	S	S	*	.	S	Bend	trans	-62.1	29.2	-174.1	57.7	0	0	0	0	116.9
240	Q	51.8	Low	60.4	Low	189 Å²	189	87.1 Å²	87.1	88%	0.883	45%	0.453	S	S	*	.			trans	-132.6	43.2	176.9	-71.5	-148.5	-14.1	0	0	112.3	G238	G238-Q240 PolarHBondContact O-N 3.41Å
241	D	63.1	Low	60.8	Low	35 Å²	35	89.9 Å²	89.9	19%	0.187	47%	0.467	C	S	.	.			trans	-95.4	131.3	174.7	-161.3	-4.8	0	0	0	110.8	S227 F243 S244	S227-D241 WeakPolarHBondContact CA-OD2 3.48Å; S227-D241 WeakPolarHBondContact CB-OD2 3.39Å; D241-F243 PolarHBondContact O-N 3Å; D241-F243 WeakPolarHBondContact OD1-CD2 3.46Å; D241-S244 WeakPolarHBondContact O-CB 3.33Å; D241-S244 PolarHBondContact O-N 2.87Å; D241-S244 PolarHBondContact O-OG 3.09Å
242	I	66.8	Low	61.5	Low	53 Å²	53	94.4 Å²	94.4	27%	0.272	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.7	-179.3	-60.1	168.5	0	0	0	110.7	K206 L215	K206-I242 HydrophobicContact CD-CG2 3.98Å; L215-I242 HydrophobicContact CD1-CD1 3.75Å
243	F	70.2	Confident	62.4	Low	4 Å²	4	89 Å²	89	2%	0.018	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-4.8	-179.7	-57	-75.1	0	0	0	114.8	F220 R223 F224 Y229 D241 E245 C246 A247	F220-F243 HydrophobicContact CD2-CZ 4.09Å; F220-F243 HydrophobicContact CE1-CE1 4.34Å; F220-F243 HydrophobicContact CE1-CZ 4.27Å; F220-F243 AromaticContact CE2-CE1 3.85Å; F220-F243 HydrophobicContact CE2-CE1 3.85Å; F220-F243 AromaticContact CE2-CZ 3.68Å; F220-F243 HydrophobicContact CE2-CZ 3.68Å; F220-F243 AromaticContact CZ-CE1 3.65Å; F220-F243 HydrophobicContact CZ-CE1 3.65Å; F220-F243 AromaticContact CZ-CZ 3.79Å; F220-F243 HydrophobicContact CZ-CZ 3.79Å; R223-F243 HydrophobicContact CB-CE2 3.98Å; F224-F243 HydrophobicContact CB-CE1 4.23Å; F224-F243 HydrophobicContact CB-CE2 4.15Å; F224-F243 HydrophobicContact CB-CZ 3.78Å; F224-F243 HydrophobicContact CD2-CD1 4.07Å; F224-F243 AromaticContact CD2-CE1 3.83Å; F224-F243 HydrophobicContact CD2-CE1 3.83Å; F224-F243 HydrophobicContact CD2-CZ 4.24Å; Y229-F243 HydrophobicContact CG-CB 4.33Å; D241-F243 PolarHBondContact O-N 3Å; D241-F243 WeakPolarHBondContact OD1-CD2 3.46Å; F243-E245 VanDerWaalsContact C-N 3.27Å; F243-E245 PolarHBondContact O-N 3.01Å; F243-C246 WeakPolarHBondContact O-CB 3.44Å; F243-C246 PolarHBondContact O-N 3.12Å; F243-A247 PolarHBondContact O-N 2.97Å
244	S	70.5	Confident	63.6	Low	53 Å²	53	85.1 Å²	85.1	37%	0.371	45%	0.454	S	S	.	.	H	α-helix	trans	-66	-31	174.7	-70	0	0	0	0	112.5	D241 A247 K248	D241-S244 WeakPolarHBondContact O-CB 3.33Å; D241-S244 PolarHBondContact O-N 2.87Å; D241-S244 PolarHBondContact O-OG 3.09Å; S244-A247 PolarHBondContact O-N 2.8Å; S244-K248 PolarHBondContact O-N 2.95Å
245	E	70.3	Confident	64.6	Low	107 Å²	107	82.2 Å²	82.2	50%	0.5	45%	0.447	S	S	.	.	H	α-helix	trans	-71.2	-35.4	174.6	-167.3	57.6	-150.8	0	0	111.7	F243 A247 K248 Q249	F243-E245 VanDerWaalsContact C-N 3.27Å; F243-E245 PolarHBondContact O-N 3.01Å; E245-A247 VanDerWaalsContact C-N 3.32Å; E245-A247 PolarHBondContact O-N 2.93Å; E245-K248 PolarHBondContact O-N 3.29Å; E245-Q249 PolarHBondContact O-N 2.66Å
246	C	75.3	Confident	66.2	Low	2 Å²	2	79 Å²	79	1%	0.014	44%	0.437	C	S	.	.	H	α-helix	trans	-60.4	-42.8	173.2	-56.3	0	0	0	0	111.1	A202 Y229 F243 K248 Q249 D250	A202-C246 HydrophobicContact CB-CB 3.8Å; Y229-C246 HydrophobicContact CD2-CB 4.14Å; Y229-C246 HydrophobicContact CE2-CB 3.74Å; F243-C246 WeakPolarHBondContact O-CB 3.44Å; F243-C246 PolarHBondContact O-N 3.12Å; C246-K248 VanDerWaalsContact C-N 3.33Å; C246-K248 PolarHBondContact O-N 3.07Å; C246-Q249 PolarHBondContact O-N 2.8Å; C246-D250 PolarHBondContact O-N 2.8Å
247	A	70.2	Confident	67.6	Low	39 Å²	39	74.8 Å²	74.8	32%	0.322	41%	0.414	S	S	.	.	H	α-helix	trans	-59.7	-41.5	176.7	0	0	0	0	0	112.6	Y229 F243 S244 E245 E251	Y229-A247 HydrophobicContact CD2-CB 3.97Å; Y229-A247 HydrophobicContact CE2-CB 4.42Å; F243-A247 PolarHBondContact O-N 2.97Å; S244-A247 PolarHBondContact O-N 2.8Å; E245-A247 VanDerWaalsContact C-N 3.32Å; E245-A247 PolarHBondContact O-N 2.93Å; A247-E251 PolarHBondContact O-N 3.12Å
248	K	75.1	Confident	68.9	Low	128 Å²	128	75.6 Å²	75.6	56%	0.557	42%	0.419	S	S	*	.	H	α-helix	trans	-68.8	-40.5	177.9	-69.6	177.3	-176.5	172.3	0	112.2	S244 E245 C246 D250 E251 K252	S244-K248 PolarHBondContact O-N 2.95Å; E245-K248 PolarHBondContact O-N 3.29Å; C246-K248 VanDerWaalsContact C-N 3.33Å; C246-K248 PolarHBondContact O-N 3.07Å; K248-D250 VanDerWaalsContact C-N 3.34Å; K248-E251 PolarHBondContact O-N 2.93Å; K248-K252 WeakPolarHBondContact O-CB 3.49Å; K248-K252 PolarHBondContact O-N 3.03Å
249	Q	76.2	Confident	70.1	Confident	94 Å²	94	78.6 Å²	78.6	44%	0.439	43%	0.425	S	S	.	.	H	α-helix	trans	-64.1	-41.3	178.1	-171.2	173.6	2	0	0	111.4	E245 C246 K252 G253	E245-Q249 PolarHBondContact O-N 2.66Å; C246-Q249 PolarHBondContact O-N 2.8Å; Q249-K252 PolarHBondContact O-N 2.8Å; Q249-G253 PolarHBondContact O-N 2.92Å
250	D	73.6	Confident	71.2	Confident	20 Å²	20	78 Å²	78	11%	0.107	41%	0.409	C	S	.	.	H	α-helix	trans	-67	-40.3	175.6	-74.5	-9.9	0	0	0	112.4	Y229 C246 K248 K252 G253 L254 H311	Y229-D250 VanDerWaalsContact CE2-OD2 3.31Å; Y229-D250 WeakPolarHBondContact CE2-OD2 3.35Å; Y229-D250 VanDerWaalsContact CZ-OD2 3.29Å; Y229-D250 PolarHBondContact OH-OD2 3.26Å; C246-D250 PolarHBondContact O-N 2.8Å; K248-D250 VanDerWaalsContact C-N 3.34Å; D250-K252 VanDerWaalsContact C-N 3.32Å; D250-K252 PolarHBondContact O-N 2.8Å; D250-G253 PolarHBondContact O-N 2.77Å; D250-L254 WeakPolarHBondContact O-CB 3.41Å; D250-L254 PolarHBondContact O-N 3.2Å; D250-H311 VanDerWaalsContact CB-CE1 3.42Å; D250-H311 WeakPolarHBondContact CB-CE1 3.37Å; D250-H311 VanDerWaalsContact CG-NE2 3.31Å; D250-H311 IonicContact OD1-CE1 3.3Å; D250-H311 IonicContact OD1-NE2 3.77Å; D250-H311 IonicContact OD2-NE2 3.93Å; D250-H311 PolarHBondContact OD2-NE2 2.72Å
251	E	74.1	Confident	71.8	Confident	90 Å²	90	71 Å²	71	42%	0.421	39%	0.387	S	S	.	.	H	α-helix	trans	-63	-40	174.2	-166.7	-168.3	155.5	0	0	111.4	A247 K248 L254 K255	A247-E251 PolarHBondContact O-N 3.12Å; K248-E251 PolarHBondContact O-N 2.93Å; E251-L254 PolarHBondContact O-N 3.41Å; E251-K255 WeakPolarHBondContact O-CG 3.47Å; E251-K255 PolarHBondContact O-N 3.39Å; E251-K255 WeakPolarHBondContact OE1-CE 3.47Å; E251-K255 IonicContact OE1-NZ 3.24Å; E251-K255 PolarHBondContact OE1-NZ 3.34Å
252	K	78.6	Confident	71.7	Confident	162 Å²	162	76 Å²	76	70%	0.704	42%	0.419	S	S	*	.	H	α-helix	trans	-64.5	-43.5	174.6	-173.6	-178.6	179.6	-177.5	0	111.4	K248 Q249 D250 K255 S256	K248-K252 WeakPolarHBondContact O-CB 3.49Å; K248-K252 PolarHBondContact O-N 3.03Å; Q249-K252 PolarHBondContact O-N 2.8Å; D250-K252 VanDerWaalsContact C-N 3.32Å; D250-K252 PolarHBondContact O-N 2.8Å; K252-K255 PolarHBondContact O-N 3.5Å; K252-S256 PolarHBondContact O-N 3.03Å
253	G	73.9	Confident	71.3	Confident	33 Å²	33	82.5 Å²	82.5	34%	0.34	45%	0.445	S	S	.	.	H	α-helix	trans	-61.7	-43.8	175	0	0	0	0	0	112.3	Q249 D250 S256 L257	Q249-G253 PolarHBondContact O-N 2.92Å; D250-G253 PolarHBondContact O-N 2.77Å; G253-S256 WeakPolarHBondContact O-CB 3.49Å; G253-S256 PolarHBondContact O-N 3.03Å; G253-L257 WeakPolarHBondContact O-CG 3.4Å; G253-L257 PolarHBondContact O-N 3.5Å
254	L	74.1	Confident	70.8	Confident	23 Å²	23	85.2 Å²	85.2	12%	0.12	46%	0.46	C	S	.	.	H	α-helix	trans	-62.5	-45.2	175.6	-176.7	66.5	0	0	0	111.5	D250 E251 S256 L257 V258 K307 H311	D250-L254 WeakPolarHBondContact O-CB 3.41Å; D250-L254 PolarHBondContact O-N 3.2Å; E251-L254 PolarHBondContact O-N 3.41Å; L254-S256 VanDerWaalsContact C-N 3.27Å; L254-S256 PolarHBondContact O-N 3Å; L254-L257 PolarHBondContact O-N 3.38Å; L254-V258 HydrophobicContact CD1-CG2 4.4Å; L254-V258 HydrophobicContact CG-CG2 4.38Å; L254-V258 WeakPolarHBondContact O-CB 3.28Å; L254-V258 VanDerWaalsContact O-CG2 3.26Å; L254-V258 WeakPolarHBondContact O-CG2 3.23Å; L254-V258 PolarHBondContact O-N 2.94Å; L254-K307 HydrophobicContact CD2-CB 4.11Å; L254-K307 WeakPolarHBondContact CD2-O 3.42Å; L254-H311 HydrophobicContact CD1-CB 4.19Å; L254-H311 HydrophobicContact CD2-CB 4.27Å
255	K	75.5	Confident	70.3	Confident	119 Å²	119	86.3 Å²	86.3	52%	0.517	47%	0.466	S	S	.	.	H	α-helix	trans	-57.7	-41.9	174.6	-76.3	173.9	-175.1	166.9	0	111.3	E251 K252 V258 T259	E251-K255 WeakPolarHBondContact O-CG 3.47Å; E251-K255 PolarHBondContact O-N 3.39Å; E251-K255 WeakPolarHBondContact OE1-CE 3.47Å; E251-K255 IonicContact OE1-NZ 3.24Å; E251-K255 PolarHBondContact OE1-NZ 3.34Å; K252-K255 PolarHBondContact O-N 3.5Å; K255-V258 PolarHBondContact O-N 3.02Å; K255-T259 WeakPolarHBondContact O-CB 3.38Å; K255-T259 PolarHBondContact O-N 2.85Å; K255-T259 PolarHBondContact O-OG1 2.86Å
256	S	77.6	Confident	69.7	Low	75 Å²	75	84.7 Å²	84.7	52%	0.524	46%	0.46	S	S	.	.	H	α-helix	trans	-62.2	-44.4	176.1	-166.9	0	0	0	0	112.5	K252 G253 L254 T259 Q260	K252-S256 PolarHBondContact O-N 3.03Å; G253-S256 WeakPolarHBondContact O-CB 3.49Å; G253-S256 PolarHBondContact O-N 3.03Å; L254-S256 VanDerWaalsContact C-N 3.27Å; L254-S256 PolarHBondContact O-N 3Å; S256-T259 PolarHBondContact O-N 2.99Å; S256-Q260 WeakPolarHBondContact O-CB 2.95Å; S256-Q260 PolarHBondContact O-N 3.21Å
257	L	72.4	Confident	69	Low	72 Å²	72	88.1 Å²	88.1	38%	0.377	48%	0.481	S	S	.	.	H	α-helix	trans	-65.9	-38.4	177.4	-72.2	171.2	0	0	0	112.2	G253 L254 Q260 G261 A314 M315	G253-L257 WeakPolarHBondContact O-CG 3.4Å; G253-L257 PolarHBondContact O-N 3.5Å; L254-L257 PolarHBondContact O-N 3.38Å; L257-Q260 PolarHBondContact O-N 3.23Å; L257-G261 PolarHBondContact O-N 3.13Å; L257-A314 HydrophobicContact CD1-CB 4.17Å; L257-M315 HydrophobicContact CD1-CE 3.94Å
258	V	69.7	Low	68.6	Low	107 Å²	107	90.5 Å²	90.5	65%	0.648	49%	0.488	S	S	*	.	H	α-helix	trans	-66.4	-42.6	175.5	171.6	0	0	0	0	111	L254 K255 G261	L254-V258 HydrophobicContact CD1-CG2 4.4Å; L254-V258 HydrophobicContact CG-CG2 4.38Å; L254-V258 WeakPolarHBondContact O-CB 3.28Å; L254-V258 VanDerWaalsContact O-CG2 3.26Å; L254-V258 WeakPolarHBondContact O-CG2 3.23Å; L254-V258 PolarHBondContact O-N 2.94Å; K255-V258 PolarHBondContact O-N 3.02Å; V258-G261 PolarHBondContact O-N 3.42Å
259	T	69	Low	67.9	Low	120 Å²	120	90.5 Å²	90.5	74%	0.736	49%	0.493	S	S	*	.	H	α-helix	trans	-67.1	-37.7	175.7	-57.9	0	0	0	0	112.1	K255 S256 G261	K255-T259 WeakPolarHBondContact O-CB 3.38Å; K255-T259 PolarHBondContact O-N 2.85Å; K255-T259 PolarHBondContact O-OG1 2.86Å; S256-T259 PolarHBondContact O-N 2.99Å; T259-G261 VanDerWaalsContact C-N 3.3Å
260	Q	68.1	Low	67.2	Low	113 Å²	113	94 Å²	94	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-61.7	-44.5	173.1	-173.3	173	6.2	0	0	109.9	S256 L257	S256-Q260 WeakPolarHBondContact O-CB 2.95Å; S256-Q260 PolarHBondContact O-N 3.21Å; L257-Q260 PolarHBondContact O-N 3.23Å
261	G	63	Low	66.4	Low	41 Å²	41	96.9 Å²	96.9	42%	0.423	54%	0.536	S	S	.	.			trans	60.9	169.6	174.8	0	0	0	0	0	113	L257 V258 T259	L257-G261 PolarHBondContact O-N 3.13Å; V258-G261 PolarHBondContact O-N 3.42Å; T259-G261 VanDerWaalsContact C-N 3.3Å
262	V	62.8	Low	65.5	Low	142 Å²	142	98.6 Å²	98.6	86%	0.861	55%	0.548	S	S	*	.			trans	-94.5	97.7	162.6	-178	0	0	0	0	106.1	N264	V262-N264 VanDerWaalsContact C-N 3.31Å; V262-N264 PolarHBondContact O-N 3.29Å
263	K	57.4	Low	64.3	Low	188 Å²	188	97.2 Å²	97.2	82%	0.817	54%	0.543	S	S	*	.			trans	-74	90.7	172	-69.3	-174.7	-177.4	179.7	0	108.1	P265	K263-P265 WeakPolarHBondContact O-CD 3.43Å
264	N	58.9	Low	63.1	Low	61 Å²	61	101.3 Å²	101.3	33%	0.326	56%	0.558	S	S	.	*			trans	-90.7	107.7	165.2	-170.8	-17.5	0	0	0	108.4	V262 L266 V267	V262-N264 VanDerWaalsContact C-N 3.31Å; V262-N264 PolarHBondContact O-N 3.29Å; N264-L266 PolarHBondContact O-N 3.39Å; N264-L266 WeakPolarHBondContact OD1-CB 3.19Å; N264-L266 PolarHBondContact OD1-N 3.35Å; N264-V267 HydrophobicContact CB-CB 4.44Å; N264-V267 CarbonylContact O-C 3.52Å; N264-V267 PolarHBondContact O-N 2.76Å; N264-V267 VanDerWaalsContact O-N 3.13Å; N264-V267 VanDerWaalsContact O-O 3.14Å
265	P	61.3	Low	62	Low	76 Å²	76	107.9 Å²	107.9	49%	0.494	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.7	-7.5	-179.6	-18.9	32.4	0	0	0	114.2	K263 K352	K263-P265 WeakPolarHBondContact O-CD 3.43Å; P265-K352 HydrophobicContact CB-CB 4.43Å; P265-K352 HydrophobicContact CB-CD 3.86Å; P265-K352 HydrophobicContact CB-CG 3.96Å; P265-K352 HydrophobicContact CG-CB 4.28Å; P265-K352 HydrophobicContact CG-CG 4.33Å
266	L	56.7	Low	60.7	Low	73 Å²	73	106.5 Å²	106.5	38%	0.382	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.1	-15.4	-179.8	-56.2	179.3	0	0	0	113.4	N264 K355 L356	N264-L266 PolarHBondContact O-N 3.39Å; N264-L266 WeakPolarHBondContact OD1-CB 3.19Å; N264-L266 PolarHBondContact OD1-N 3.35Å; L266-K355 HydrophobicContact CD1-CB 4.33Å; L266-L356 HydrophobicContact CD1-CD2 3.76Å; L266-L356 HydrophobicContact CD1-CG 3.92Å; L266-L356 HydrophobicContact CD2-CD1 4.26Å; L266-L356 HydrophobicContact CD2-CD2 3.39Å; L266-L356 HydrophobicContact CD2-CG 3.7Å; L266-L356 HydrophobicContact CG-CD2 4.22Å; L266-L356 HydrophobicContact CG-CG 4.37Å
267	V	60.4	Low	59.4	Low	75 Å²	75	111.9 Å²	111.9	46%	0.455	61%	0.609	S	S	.	*			trans	-138.1	98.9	-179.2	-176.9	0	0	0	0	108	N264 L269	N264-V267 HydrophobicContact CB-CB 4.44Å; N264-V267 CarbonylContact O-C 3.52Å; N264-V267 PolarHBondContact O-N 2.76Å; N264-V267 VanDerWaalsContact O-N 3.13Å; N264-V267 VanDerWaalsContact O-O 3.14Å; V267-L269 HydrophobicContact CG1-CD2 3.64Å; V267-L269 HydrophobicContact CG1-CG 3.92Å; V267-L269 PolarHBondContact O-N 2.8Å
268	D	61.9	Low	58.2	Low	88 Å²	88	113.5 Å²	113.5	47%	0.471	62%	0.618	S	S	.	*			trans	-92.3	90.9	173.3	-178.5	14.3	0	0	0	109.8	L270 S271	D268-L270 PolarHBondContact O-N 2.89Å; D268-L270 WeakPolarHBondContact OD1-CB 3.35Å; D268-L270 PolarHBondContact OD1-N 2.83Å; D268-S271 WeakPolarHBondContact CB-OG 3.45Å; D268-S271 PolarHBondContact O-N 2.84Å; D268-S271 PolarHBondContact O-OG 3.09Å; D268-S271 PolarHBondContact OD1-N 2.85Å; D268-S271 WeakPolarHBondContact OD2-CB 3.33Å; D268-S271 PolarHBondContact OD2-OG 2.94Å
269	L	60.3	Low	57.4	Low	128 Å²	128	116.7 Å²	116.7	67%	0.67	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-12.7	176.6	-61.7	175.9	0	0	0	112.7	V267 L272	V267-L269 HydrophobicContact CG1-CD2 3.64Å; V267-L269 HydrophobicContact CG1-CG 3.92Å; V267-L269 PolarHBondContact O-N 2.8Å; L269-L272 HydrophobicContact CD2-CD1 3.73Å
270	L	61.9	Low	56.4	Low	167 Å²	167	113.1 Å²	113.1	87%	0.874	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-24.3	178.5	-65.3	163.4	0	0	0	112.1	D268	D268-L270 PolarHBondContact O-N 2.89Å; D268-L270 WeakPolarHBondContact OD1-CB 3.35Å; D268-L270 PolarHBondContact OD1-N 2.83Å
271	S	56.6	Low	55.1	Low	81 Å²	81	118.1 Å²	118.1	57%	0.566	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-5.7	171.5	57.9	0	0	0	0	114.2	D268 E273	D268-S271 WeakPolarHBondContact CB-OG 3.45Å; D268-S271 PolarHBondContact O-N 2.84Å; D268-S271 PolarHBondContact O-OG 3.09Å; D268-S271 PolarHBondContact OD1-N 2.85Å; D268-S271 WeakPolarHBondContact OD2-CB 3.33Å; D268-S271 PolarHBondContact OD2-OG 2.94Å; S271-E273 PolarHBondContact O-N 3.24Å
272	L	55.3	Low	54.4	Low	127 Å²	127	119.9 Å²	119.9	67%	0.665	65%	0.647	S	S	*	*			trans	-72.3	58.6	160.8	-66.8	172.4	0	0	0	110	L269 D274	L269-L272 HydrophobicContact CD2-CD1 3.73Å; L272-D274 PolarHBondContact O-N 2.7Å
273	E	53.3	Low	53.5	Low	132 Å²	132	120.7 Å²	120.7	62%	0.617	64%	0.644	S	S	*	*			trans	-64.6	126.3	158.8	-165.2	178	-152.7	0	0	106.4	S271 K275	S271-E273 PolarHBondContact O-N 3.24Å; E273-K275 PolarHBondContact O-N 3.47Å; E273-K275 WeakPolarHBondContact OE2-CE 3.48Å; E273-K275 IonicContact OE2-NZ 3.68Å; E273-K275 PolarHBondContact OE2-NZ 3.31Å
274	D	49.2	Very low	52.8	Low	119 Å²	119	117.3 Å²	117.3	64%	0.636	64%	0.644	S	S	*	*			trans	-66.5	76.1	174.9	-173.2	7.2	0	0	0	109.7	L272 T276	L272-D274 PolarHBondContact O-N 2.7Å; D274-T276 PolarHBondContact O-N 3.04Å; D274-T276 WeakPolarHBondContact OD1-CB 3.49Å; D274-T276 WeakPolarHBondContact OD1-CG2 3.45Å; D274-T276 PolarHBondContact OD1-N 3.48Å; D274-T276 PolarHBondContact OD1-OG1 3.13Å
275	K	50.9	Low	52.1	Low	161 Å²	161	121.3 Å²	121.3	70%	0.7	66%	0.659	S	S	*	*			trans	-92.4	64.9	159.1	-70.6	-176.5	-178.1	149.7	0	107.2	E273 L277	E273-K275 PolarHBondContact O-N 3.47Å; E273-K275 WeakPolarHBondContact OE2-CE 3.48Å; E273-K275 IonicContact OE2-NZ 3.68Å; E273-K275 PolarHBondContact OE2-NZ 3.31Å; K275-L277 PolarHBondContact O-N 3.34Å
276	T	47.3	Very low	51.2	Low	90 Å²	90	121.8 Å²	121.8	55%	0.552	67%	0.669	S	S	*	*			trans	-59.9	126.3	158.6	32.1	0	0	0	0	107.5	D274 D278	D274-T276 PolarHBondContact O-N 3.04Å; D274-T276 WeakPolarHBondContact OD1-CB 3.49Å; D274-T276 WeakPolarHBondContact OD1-CG2 3.45Å; D274-T276 PolarHBondContact OD1-N 3.48Å; D274-T276 PolarHBondContact OD1-OG1 3.13Å; T276-D278 PolarHBondContact O-N 3.28Å
277	L	51.8	Low	50.5	Low	188 Å²	188	124.5 Å²	124.5	98%	0.984	68%	0.683	S	S	*	*	S	Bend	trans	-65.8	14.2	175.2	-79.4	165.2	0	0	0	112.9	K275	K275-L277 PolarHBondContact O-N 3.34Å
278	D	46	Very low	49.6	Very low	106 Å²	106	127 Å²	127	57%	0.567	70%	0.701	S	S	*	*			trans	-143.5	75.3	-166.4	-161.2	29.3	0	0	0	111.1	T276 G280	T276-D278 PolarHBondContact O-N 3.28Å; D278-G280 PolarHBondContact O-N 3.49Å; D278-G280 VanDerWaalsContact OD1-CA 3.29Å; D278-G280 WeakPolarHBondContact OD1-CA 3.42Å; D278-G280 PolarHBondContact OD1-N 2.97Å
279	E	52.8	Low	48.2	Very low	174 Å²	174	127.4 Å²	127.4	81%	0.813	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	44.2	151.7	-71.5	-174.4	156.3	0	0	110.9	K285	E279-K285 IonicContact OE1-NZ 3.1Å
280	G	49	Very low	47.5	Very low	45 Å²	45	127.6 Å²	127.6	46%	0.464	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.3	6.1	-167.9	0	0	0	0	0	115.7	D278	D278-G280 PolarHBondContact O-N 3.49Å; D278-G280 VanDerWaalsContact OD1-CA 3.29Å; D278-G280 WeakPolarHBondContact OD1-CA 3.42Å; D278-G280 PolarHBondContact OD1-N 2.97Å
281	Y	39.6	Very low	46.7	Very low	219 Å²	219	124.5 Å²	124.5	86%	0.859	71%	0.71	S	S	*	*	S	Bend	trans	-141.2	86	169.1	-132.9	-95.8	0	0	0	113.8	I283	Y281-I283 PolarHBondContact O-N 2.96Å; Y281-I283 VanDerWaalsContact O-N 3.11Å
282	G	48.8	Very low	45.7	Very low	78 Å²	78	128.2 Å²	128.2	80%	0.804	72%	0.723	S	S	*	*	S	Bend	trans	74.4	8.6	140.9	0	0	0	0	0	119.8
283	I	43.5	Very low	45	Very low	159 Å²	159	126.3 Å²	126.3	82%	0.815	73%	0.726	S	S	*	*			trans	-129.5	100.4	166.8	-54.2	177.7	0	0	0	108.7	Y281 K285	Y281-I283 PolarHBondContact O-N 2.96Å; Y281-I283 VanDerWaalsContact O-N 3.11Å; I283-K285 PolarHBondContact O-N 2.86Å; I283-K285 VanDerWaalsContact O-N 3.09Å
284	S	44.6	Very low	44.6	Very low	116 Å²	116	127.8 Å²	127.8	81%	0.811	74%	0.738	S	S	*	*			trans	-58.3	115.2	172.9	-14.8	0	0	0	0	108.4	A286	S284-A286 PolarHBondContact O-N 3.25Å
285	K	43.6	Very low	44.4	Very low	146 Å²	146	129.7 Å²	129.7	64%	0.635	74%	0.74	S	S	*	*			trans	-46	114.7	162.1	-142.2	172.1	-167.2	165.2	0	107.2	E279 I283 L287	E279-K285 IonicContact OE1-NZ 3.1Å; I283-K285 PolarHBondContact O-N 2.86Å; I283-K285 VanDerWaalsContact O-N 3.09Å; K285-L287 PolarHBondContact O-N 3.34Å
286	A	41.6	Very low	44.4	Very low	86 Å²	86	125.5 Å²	125.5	71%	0.711	73%	0.732	S	S	*	*			trans	-66.8	91.6	166.1	0	0	0	0	0	106.5	S284	S284-A286 PolarHBondContact O-N 3.25Å
287	L	42.6	Very low	44.6	Very low	130 Å²	130	126.5 Å²	126.5	68%	0.681	74%	0.737	S	S	*	*			trans	-53.4	145.4	160.2	-97.9	87.3	0	0	0	107.7	K285 S289	K285-L287 PolarHBondContact O-N 3.34Å; L287-S289 PolarHBondContact O-N 3.32Å
288	P	40.8	Very low	44.7	Very low	127 Å²	127	125.5 Å²	125.5	83%	0.825	73%	0.725	S	S	*	*			trans	-70	77.6	169.4	30.5	-32	0	0	0	108.3	T290	P288-T290 PolarHBondContact O-N 2.89Å; P288-T290 VanDerWaalsContact O-N 3.14Å
289	S	33	Very low	45.3	Very low	96 Å²	96	126.8 Å²	126.8	67%	0.671	73%	0.728	S	S	*	*			trans	-67.5	109.6	163.7	-65.9	0	0	0	0	106.9	L287 S291	L287-S289 PolarHBondContact O-N 3.32Å; S289-S291 PolarHBondContact O-N 3.23Å
290	T	46.3	Very low	45.8	Very low	132 Å²	132	122.3 Å²	122.3	81%	0.81	72%	0.716	S	S	*	*	S	Bend	trans	-44.1	130.2	153.2	46.5	0	0	0	0	108	P288	P288-T290 PolarHBondContact O-N 2.89Å; P288-T290 VanDerWaalsContact O-N 3.14Å
291	S	45.2	Very low	46.5	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	71%	0.709	S	S	*	*			trans	78.7	87.5	-174.7	74.7	0	0	0	0	117	S289	S289-S291 PolarHBondContact O-N 3.23Å
292	N	34.2	Very low	48.1	Very low	159 Å²	159	116.2 Å²	116.2	85%	0.85	69%	0.691	S	S	*	*				-176.5	112	127.5	-92.8	-33.6	0	0	0	111.5	N294	N292-N294 VanDerWaalsContact C-N 3.25Å; N292-N294 PolarHBondContact O-N 3.37Å
293	A	42.3	Very low	49.2	Very low	87 Å²	87	115 Å²	115	72%	0.719	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	14.4	-167	0	0	0	0	0	116.4
294	N	43.6	Very low	50.5	Low	163 Å²	163	110.1 Å²	110.1	87%	0.872	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	5.7	-169.6	-72.5	-17.9	0	0	0	116.1	N292	N292-N294 VanDerWaalsContact C-N 3.25Å; N292-N294 PolarHBondContact O-N 3.37Å
295	K	44.5	Very low	51.9	Low	158 Å²	158	107.4 Å²	107.4	69%	0.687	63%	0.63	S	S	*	*	S	Bend	trans	-103	-11	172.4	-83.8	-175.4	176.6	-179.8	0	115.1	V297	K295-V297 PolarHBondContact O-N 2.86Å
296	S	52.3	Low	53.4	Low	74 Å²	74	105.3 Å²	105.3	52%	0.517	62%	0.624	S	S	.	*	H	α-helix	trans	-73.9	-25.5	-164.8	65.6	0	0	0	0	115.7	S300	S296-S300 WeakPolarHBondContact O-CB 3.4Å; S296-S300 PolarHBondContact O-N 2.86Å; S296-S300 VanDerWaalsContact O-N 3.1Å
297	V	51.6	Low	55	Low	110 Å²	110	106.6 Å²	106.6	67%	0.667	61%	0.614	S	S	*	*	H	α-helix	trans	-77.5	-42.3	-170.9	-176.2	0	0	0	0	112.2	K295 S300 S301	K295-V297 PolarHBondContact O-N 2.86Å; V297-S300 PolarHBondContact O-N 2.91Å; V297-S301 WeakPolarHBondContact O-CB 3.31Å; V297-S301 PolarHBondContact O-N 3.04Å; V297-S301 PolarHBondContact O-OG 3.44Å
298	K	53.9	Low	56.4	Low	167 Å²	167	104.8 Å²	104.8	73%	0.726	60%	0.598	S	S	*	*	H	α-helix	trans	-69.4	-43.5	-178.7	-118.6	-179.6	-179.2	-179.6	0	111.7	S301 N302	K298-S301 WeakPolarHBondContact CA-OG 3.38Å; K298-S301 PolarHBondContact O-N 3.05Å; K298-S301 PolarHBondContact O-OG 2.86Å; K298-N302 WeakPolarHBondContact O-CB 3.44Å; K298-N302 PolarHBondContact O-N 2.85Å; K298-N302 PolarHBondContact O-ND2 2.78Å
299	E	57.9	Low	58.1	Low	133 Å²	133	105 Å²	105	62%	0.621	59%	0.586	S	S	*	*	H	α-helix	trans	-66	-38.4	175	-76.4	173.7	175.7	0	0	112.4	S303	E299-S303 VanDerWaalsContact O-CB 3.25Å; E299-S303 WeakPolarHBondContact O-CB 3.24Å; E299-S303 PolarHBondContact O-N 2.87Å
300	S	62.7	Low	60.3	Low	81 Å²	81	104.6 Å²	104.6	57%	0.566	58%	0.576	S	S	*	*	H	α-helix	trans	-63.9	-44.3	173.5	-177.9	0	0	0	0	112.1	S296 V297 S303 A304	S296-S300 WeakPolarHBondContact O-CB 3.4Å; S296-S300 PolarHBondContact O-N 2.86Å; S296-S300 VanDerWaalsContact O-N 3.1Å; V297-S300 PolarHBondContact O-N 2.91Å; S300-S303 PolarHBondContact O-N 2.84Å; S300-A304 WeakPolarHBondContact O-CB 3.23Å; S300-A304 PolarHBondContact O-N 3.35Å
301	S	64.4	Low	61.8	Low	47 Å²	47	99 Å²	99	33%	0.329	54%	0.541	S	S	.	.	H	α-helix	trans	-63.9	-45.4	176.9	68.3	0	0	0	0	112.2	V297 K298 S303 A304 I305	V297-S301 WeakPolarHBondContact O-CB 3.31Å; V297-S301 PolarHBondContact O-N 3.04Å; V297-S301 PolarHBondContact O-OG 3.44Å; K298-S301 WeakPolarHBondContact CA-OG 3.38Å; K298-S301 PolarHBondContact O-N 3.05Å; K298-S301 PolarHBondContact O-OG 2.86Å; S301-S303 PolarHBondContact O-N 3.14Å; S301-A304 PolarHBondContact O-N 3.42Å; S301-I305 WeakPolarHBondContact O-CD1 3.38Å; S301-I305 WeakPolarHBondContact O-CG1 3.22Å; S301-I305 PolarHBondContact O-N 3.35Å
302	N	72.8	Confident	63.3	Low	88 Å²	88	95.3 Å²	95.3	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-41.4	177.2	-69.8	-16.6	0	0	0	111.6	K298 A304 I305 I306	K298-N302 WeakPolarHBondContact O-CB 3.44Å; K298-N302 PolarHBondContact O-N 2.85Å; K298-N302 PolarHBondContact O-ND2 2.78Å; N302-A304 PolarHBondContact O-N 2.72Å; N302-I305 PolarHBondContact O-N 3.07Å; N302-I306 VanDerWaalsContact O-CG1 3.31Å; N302-I306 WeakPolarHBondContact O-CG1 3.43Å; N302-I306 PolarHBondContact O-N 3.2Å
303	S	72.8	Confident	65.4	Low	53 Å²	53	89.6 Å²	89.6	37%	0.371	49%	0.485	S	S	.	.	H	α-helix	trans	-62	-42.1	175.6	-173.8	0	0	0	0	112.1	E299 S300 S301 I306 K307	E299-S303 VanDerWaalsContact O-CB 3.25Å; E299-S303 WeakPolarHBondContact O-CB 3.24Å; E299-S303 PolarHBondContact O-N 2.87Å; S300-S303 PolarHBondContact O-N 2.84Å; S301-S303 PolarHBondContact O-N 3.14Å; S303-I306 PolarHBondContact O-N 3.3Å; S303-K307 WeakPolarHBondContact O-CB 3.21Å; S303-K307 VanDerWaalsContact O-CG 3.31Å; S303-K307 WeakPolarHBondContact O-CG 3.42Å; S303-K307 PolarHBondContact O-N 3.39Å
304	A	70.5	Confident	67.1	Low	57 Å²	57	86.8 Å²	86.8	47%	0.471	46%	0.462	S	S	.	.	H	α-helix	trans	-64	-40.2	176.5	0	0	0	0	0	112.1	S300 S301 N302 R308	S300-A304 WeakPolarHBondContact O-CB 3.23Å; S300-A304 PolarHBondContact O-N 3.35Å; S301-A304 PolarHBondContact O-N 3.42Å; N302-A304 PolarHBondContact O-N 2.72Å; A304-R308 WeakPolarHBondContact O-CB 3.35Å; A304-R308 PolarHBondContact O-N 3.43Å; A304-R308 VanDerWaalsContact O-N 3.1Å
305	I	72.6	Confident	68.8	Low	59 Å²	59	80.1 Å²	80.1	30%	0.303	43%	0.425	S	S	.	.	H	α-helix	trans	-62.6	-47.8	176.8	-66.1	166	0	0	0	110.7	R232 S301 N302 R308 F309	R232-I305 HydrophobicContact CG-CG1 4.15Å; S301-I305 WeakPolarHBondContact O-CD1 3.38Å; S301-I305 WeakPolarHBondContact O-CG1 3.22Å; S301-I305 PolarHBondContact O-N 3.35Å; N302-I305 PolarHBondContact O-N 3.07Å; I305-R308 PolarHBondContact O-N 3.49Å; I305-F309 PolarHBondContact O-N 2.99Å
306	I	77.1	Confident	70.5	Confident	102 Å²	102	74.1 Å²	74.1	52%	0.523	40%	0.402	S	S	.	.	H	α-helix	trans	-63	-46	-179.9	-66.7	164.8	0	0	0	110.9	N302 S303 R308 F309 N310	N302-I306 VanDerWaalsContact O-CG1 3.31Å; N302-I306 WeakPolarHBondContact O-CG1 3.43Å; N302-I306 PolarHBondContact O-N 3.2Å; S303-I306 PolarHBondContact O-N 3.3Å; I306-R308 VanDerWaalsContact C-N 3.29Å; I306-R308 PolarHBondContact O-N 3.3Å; I306-F309 PolarHBondContact O-N 2.98Å; I306-N310 PolarHBondContact O-N 3.12Å
307	K	73.3	Confident	71.6	Confident	112 Å²	112	76.7 Å²	76.7	49%	0.487	41%	0.409	S	S	.	.	H	α-helix	trans	-57.4	-42.8	177.6	-75.5	175.1	-178	178.1	0	111.9	L254 S303 H311	L254-K307 HydrophobicContact CD2-CB 4.11Å; L254-K307 WeakPolarHBondContact CD2-O 3.42Å; S303-K307 WeakPolarHBondContact O-CB 3.21Å; S303-K307 VanDerWaalsContact O-CG 3.31Å; S303-K307 WeakPolarHBondContact O-CG 3.42Å; S303-K307 PolarHBondContact O-N 3.39Å; K307-H311 WeakPolarHBondContact O-CB 3.47Å; K307-H311 PolarHBondContact O-N 2.77Å
308	R	72.1	Confident	72.7	Confident	92 Å²	92	72.8 Å²	72.8	35%	0.347	39%	0.388	S	S	.	.	H	α-helix	trans	-70.6	-38.3	179	-168.6	173.8	-177.4	-120.4	9.9	112.4	Y229 F230 A304 I305 I306 H311 H312	Y229-R308 PolarHBondContact O-NH2 2.83Å; F230-R308 PolarHBondContact O-NH2 3.04Å; A304-R308 WeakPolarHBondContact O-CB 3.35Å; A304-R308 PolarHBondContact O-N 3.43Å; A304-R308 VanDerWaalsContact O-N 3.1Å; I305-R308 PolarHBondContact O-N 3.49Å; I306-R308 VanDerWaalsContact C-N 3.29Å; I306-R308 PolarHBondContact O-N 3.3Å; R308-H311 PolarHBondContact O-N 2.78Å; R308-H312 WeakPolarHBondContact O-CB 3.47Å; R308-H312 PolarHBondContact O-N 2.74Å
309	F	76.5	Confident	73.5	Confident	133 Å²	133	65.8 Å²	65.8	58%	0.583	36%	0.362	S	S	*	.	H	α-helix	trans	-62.3	-44.1	174.9	-175.4	-94.8	0	0	0	111.8	I305 I306 H312 S313	I305-F309 PolarHBondContact O-N 2.99Å; I306-F309 PolarHBondContact O-N 2.98Å; F309-H312 PolarHBondContact O-N 2.82Å; F309-S313 WeakPolarHBondContact O-CB 3.45Å; F309-S313 PolarHBondContact O-N 2.82Å; F309-S313 PolarHBondContact O-OG 3.01Å
310	N	79.6	Confident	73.9	Confident	86 Å²	86	62.5 Å²	62.5	46%	0.46	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-42.4	176.2	-70.1	-6.1	0	0	0	111.5	I306 A314	I306-N310 PolarHBondContact O-N 3.12Å; N310-A314 VanDerWaalsContact O-CB 3.24Å; N310-A314 WeakPolarHBondContact O-CB 3.28Å; N310-A314 PolarHBondContact O-N 3.08Å
311	H	77.5	Confident	73.9	Confident	14 Å²	14	62.5 Å²	62.5	7%	0.065	36%	0.364	C	S	.	.	H	α-helix	trans	-61.1	-47.8	174.7	179.9	79.3	0	0	0	112.1	D250 L254 K307 R308 A314 M315	D250-H311 VanDerWaalsContact CB-CE1 3.42Å; D250-H311 WeakPolarHBondContact CB-CE1 3.37Å; D250-H311 VanDerWaalsContact CG-NE2 3.31Å; D250-H311 IonicContact OD1-CE1 3.3Å; D250-H311 IonicContact OD1-NE2 3.77Å; D250-H311 IonicContact OD2-NE2 3.93Å; D250-H311 PolarHBondContact OD2-NE2 2.72Å; L254-H311 HydrophobicContact CD1-CB 4.19Å; L254-H311 HydrophobicContact CD2-CB 4.27Å; K307-H311 WeakPolarHBondContact O-CB 3.47Å; K307-H311 PolarHBondContact O-N 2.77Å; R308-H311 PolarHBondContact O-N 2.78Å; H311-A314 PolarHBondContact O-N 2.86Å; H311-M315 WeakPolarHBondContact O-CG 3.49Å; H311-M315 PolarHBondContact O-N 3.01Å
312	H	76.8	Confident	73.7	Confident	27 Å²	27	67.8 Å²	67.8	13%	0.125	38%	0.376	C	S	.	.	H	α-helix	trans	-59.7	-48.8	177.9	-179.8	69	0	0	0	111.7	G168 R308 F309 A314 M315 V316	G168-H312 PolarHBondContact O-NE2 3.27Å; G168-H312 VanDerWaalsContact O-NE2 3.14Å; R308-H312 WeakPolarHBondContact O-CB 3.47Å; R308-H312 PolarHBondContact O-N 2.74Å; F309-H312 PolarHBondContact O-N 2.82Å; H312-A314 VanDerWaalsContact C-N 3.33Å; H312-A314 PolarHBondContact O-N 2.97Å; H312-M315 PolarHBondContact O-N 3.08Å; H312-V316 WeakPolarHBondContact O-CG2 3.38Å; H312-V316 PolarHBondContact O-N 3.49Å
313	S	79.9	Confident	72.8	Confident	38 Å²	38	70.9 Å²	70.9	27%	0.266	39%	0.386	S	S	.	.	H	α-helix	trans	-61.3	-42.2	178.5	-55.9	0	0	0	0	111.7	F309 V316 L317	F309-S313 WeakPolarHBondContact O-CB 3.45Å; F309-S313 PolarHBondContact O-N 2.82Å; F309-S313 PolarHBondContact O-OG 3.01Å; S313-V316 PolarHBondContact O-N 2.99Å; S313-L317 WeakPolarHBondContact O-CG 3.45Å; S313-L317 PolarHBondContact O-N 2.9Å
314	A	77.8	Confident	71.3	Confident	29 Å²	29	70.5 Å²	70.5	24%	0.24	39%	0.39	C	S	.	.	H	α-helix	trans	-64.2	-39.5	176.1	0	0	0	0	0	112.4	L257 N310 H311 H312 A318	L257-A314 HydrophobicContact CD1-CB 4.17Å; N310-A314 VanDerWaalsContact O-CB 3.24Å; N310-A314 WeakPolarHBondContact O-CB 3.28Å; N310-A314 PolarHBondContact O-N 3.08Å; H311-A314 PolarHBondContact O-N 2.86Å; H312-A314 VanDerWaalsContact C-N 3.33Å; H312-A314 PolarHBondContact O-N 2.97Å; A314-A318 WeakPolarHBondContact O-CB 3.43Å; A314-A318 PolarHBondContact O-N 3.11Å
315	M	77.8	Confident	69.3	Low	22 Å²	22	75.4 Å²	75.4	11%	0.108	41%	0.409	C	S	.	.	H	α-helix	trans	-70.6	-36.2	177.7	-71.8	-55.9	100.9	0	0	112.6	T199 L257 H311 H312 A318 A319	T199-M315 WeakPolarHBondContact O-CB 3.49Å; L257-M315 HydrophobicContact CD1-CE 3.94Å; H311-M315 WeakPolarHBondContact O-CG 3.49Å; H311-M315 PolarHBondContact O-N 3.01Å; H312-M315 PolarHBondContact O-N 3.08Å; M315-A318 PolarHBondContact O-N 3.4Å; M315-A319 VanDerWaalsContact O-CB 3.27Å; M315-A319 WeakPolarHBondContact O-CB 3.4Å; M315-A319 PolarHBondContact O-N 2.9Å
316	V	80.4	Confident	67.6	Low	32 Å²	32	77.2 Å²	77.2	19%	0.194	42%	0.424	C	S	.	.	H	α-helix	trans	-64	-45.4	173.3	172.5	0	0	0	0	111	I166 H312 S313 A319 G320	I166-V316 HydrophobicContact CG2-CG2 4.44Å; H312-V316 WeakPolarHBondContact O-CG2 3.38Å; H312-V316 PolarHBondContact O-N 3.49Å; S313-V316 PolarHBondContact O-N 2.99Å; V316-A319 PolarHBondContact O-N 3.49Å; V316-G320 PolarHBondContact O-N 3.38Å
317	L	75.7	Confident	65.6	Low	128 Å²	128	77.7 Å²	77.7	67%	0.67	43%	0.434	S	S	*	.	H	α-helix	trans	-62.2	-46.3	174.5	-71.2	172	0	0	0	111.6	S313 A319 G320 S321	S313-L317 WeakPolarHBondContact O-CG 3.45Å; S313-L317 PolarHBondContact O-N 2.9Å; L317-A319 VanDerWaalsContact C-N 3.31Å; L317-A319 PolarHBondContact O-N 3.28Å; L317-G320 PolarHBondContact O-N 3.08Å; L317-G320 VanDerWaalsContact O-N 3.14Å; L317-S321 PolarHBondContact O-N 3.43Å; L317-S321 VanDerWaalsContact O-N 3.09Å; L317-S321 PolarHBondContact O-OG 3.07Å
318	A	74.3	Confident	63.7	Low	28 Å²	28	78.2 Å²	78.2	23%	0.231	45%	0.447	C	S	.	.	H	α-helix	trans	-63.3	-36.1	178	0	0	0	0	0	112.4	A314 M315 G320 S321 R322	A314-A318 WeakPolarHBondContact O-CB 3.43Å; A314-A318 PolarHBondContact O-N 3.11Å; M315-A318 PolarHBondContact O-N 3.4Å; A318-G320 VanDerWaalsContact C-N 3.27Å; A318-G320 PolarHBondContact O-N 2.91Å; A318-S321 PolarHBondContact O-N 3.45Å; A318-S321 VanDerWaalsContact O-N 3.17Å; A318-R322 WeakPolarHBondContact O-CG 3.46Å; A318-R322 PolarHBondContact O-N 3.25Å
319	A	71.1	Confident	62.1	Low	20 Å²	20	80 Å²	80	17%	0.165	46%	0.463	C	S	.	.	H	α-helix	trans	-64.3	-33	176	0	0	0	0	0	112.3	I166 R198 M315 V316 L317	I166-A319 HydrophobicContact CD1-CB 3.57Å; R198-A319 HydrophobicContact CB-CB 4.48Å; M315-A319 VanDerWaalsContact O-CB 3.27Å; M315-A319 WeakPolarHBondContact O-CB 3.4Å; M315-A319 PolarHBondContact O-N 2.9Å; V316-A319 PolarHBondContact O-N 3.49Å; L317-A319 VanDerWaalsContact C-N 3.31Å; L317-A319 PolarHBondContact O-N 3.28Å
320	G	66.4	Low	60.3	Low	64 Å²	64	81.4 Å²	81.4	66%	0.66	47%	0.471	S	S	*	.	H	α-helix	trans	-70.1	-35.3	170.8	0	0	0	0	0	113.2	V316 L317 A318	V316-G320 PolarHBondContact O-N 3.38Å; L317-G320 PolarHBondContact O-N 3.08Å; L317-G320 VanDerWaalsContact O-N 3.14Å; A318-G320 VanDerWaalsContact C-N 3.27Å; A318-G320 PolarHBondContact O-N 2.91Å
321	S	63.2	Low	57.9	Low	82 Å²	82	81.6 Å²	81.6	57%	0.573	49%	0.485	S	S	*	.	H	α-helix	trans	-83.9	-24.3	-177.4	-57	0	0	0	0	115	L317 A318 K323 G324	L317-S321 PolarHBondContact O-N 3.43Å; L317-S321 VanDerWaalsContact O-N 3.09Å; L317-S321 PolarHBondContact O-OG 3.07Å; A318-S321 PolarHBondContact O-N 3.45Å; A318-S321 VanDerWaalsContact O-N 3.17Å; S321-K323 PolarHBondContact O-N 2.89Å; S321-G324 PolarHBondContact O-N 3.31Å
322	R	59.8	Low	56.1	Low	157 Å²	157	86.8 Å²	86.8	59%	0.592	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-6.8	-175.1	-82.8	169.5	-165.1	-133.3	8.1	116.3	A318	A318-R322 WeakPolarHBondContact O-CG 3.46Å; A318-R322 PolarHBondContact O-N 3.25Å
323	K	53.5	Low	53.9	Low	154 Å²	154	93.5 Å²	93.5	67%	0.67	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-16.1	175.9	-98.6	-169.2	176.6	-169.1	0	114.7	E163 S321	E163-K323 WeakPolarHBondContact OE1-CE 3.24Å; E163-K323 IonicContact OE1-NZ 3.21Å; E163-K323 PolarHBondContact OE1-NZ 3.39Å; E163-K323 WeakPolarHBondContact OE2-CE 3.47Å; E163-K323 IonicContact OE2-NZ 2.78Å; E163-K323 PolarHBondContact OE2-NZ 2.93Å; E163-K323 VanDerWaalsContact OE2-NZ 3.08Å; S321-K323 PolarHBondContact O-N 2.89Å
324	G	40.5	Very low	51.8	Low	45 Å²	45	98.1 Å²	98.1	46%	0.464	58%	0.581	S	S	.	*	S	Bend	trans	-97	135.7	161.4	0	0	0	0	0	107.1	S321 P326	S321-G324 PolarHBondContact O-N 3.31Å; G324-P326 WeakPolarHBondContact O-CD 3.48Å; G324-P326 VanDerWaalsContact O-N 3.07Å
325	D	30.3	Very low	49.6	Very low	160 Å²	160	102 Å²	102	86%	0.856	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-47.8	124.1	167.5	-80.7	-43.1	0	0	0	108.1
326	P	36.8	Very low	47.7	Very low	97 Å²	97	105.5 Å²	105.5	63%	0.63	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-57.8	132.7	165.9	25.5	-30.3	0	0	0	105.8	G324 T328	G324-P326 WeakPolarHBondContact O-CD 3.48Å; G324-P326 VanDerWaalsContact O-N 3.07Å; P326-T328 PolarHBondContact O-N 3.25Å
327	P	34.8	Very low	45.8	Very low	112 Å²	112	109.9 Å²	109.9	73%	0.727	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-54.5	120.6	168.6	22.8	-29.5	0	0	0	106.4	D329	P327-D329 PolarHBondContact O-N 3.27Å
328	T	32.8	Very low	43.7	Very low	123 Å²	123	111.9 Å²	111.9	76%	0.755	67%	0.672	S	S	*	*			trans	-63.2	82.6	-176.9	-46	0	0	0	0	109.2	P326 Q330	P326-T328 PolarHBondContact O-N 3.25Å; T328-Q330 PolarHBondContact O-N 3.39Å
329	D	39.8	Very low	42.2	Very low	128 Å²	128	114.3 Å²	114.3	68%	0.684	70%	0.699	S	S	*	*			trans	-78.1	33.8	173.7	-95.2	-12.9	0	0	0	111.8	P327	P327-D329 PolarHBondContact O-N 3.27Å
330	Q	36.8	Very low	40.3	Very low	163 Å²	163	121.1 Å²	121.1	76%	0.762	73%	0.733	S	S	*	*			trans	-128.9	73	171.5	-72.7	-168.3	8.8	0	0	110.4	T328	T328-Q330 PolarHBondContact O-N 3.39Å
331	A	29.9	Very low	39.4	Very low	90 Å²	90	123 Å²	123	74%	0.744	74%	0.736	S	S	*	*			trans	-121.8	78.8	146.5	0	0	0	0	0	107.2	E333	A331-E333 PolarHBondContact O-N 3.47Å; A331-E333 VanDerWaalsContact O-N 3.14Å
332	S	39.8	Very low	38.2	Very low	123 Å²	123	130.2 Å²	130.2	86%	0.86	75%	0.75	S	S	*	*			trans	-77.4	79.5	157.3	-69.7	0	0	0	0	107.1
333	E	30	Very low	37.3	Very low	169 Å²	169	130 Å²	130	79%	0.79	76%	0.761	S	S	*	*			trans	-94.8	115.3	162.2	-71.7	-144.4	160.7	0	0	109.1	A331 S335	A331-E333 PolarHBondContact O-N 3.47Å; A331-E333 VanDerWaalsContact O-N 3.14Å; E333-S335 PolarHBondContact O-N 3.49Å; E333-S335 VanDerWaalsContact O-N 3.14Å
334	T	36.9	Very low	36.4	Very low	134 Å²	134	128.1 Å²	128.1	82%	0.822	77%	0.767	S	S	*	*			trans	-69.9	92.2	165.5	51.2	0	0	0	0	108.6
335	S	31.1	Very low	36.3	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	78%	0.78	S	S	*	*			trans	-100.4	71.2	169.2	53.1	0	0	0	0	110.7	E333	E333-S335 PolarHBondContact O-N 3.49Å; E333-S335 VanDerWaalsContact O-N 3.14Å
336	S	37.4	Very low	36.5	Very low	97 Å²	97	134.5 Å²	134.5	68%	0.678	78%	0.781	S	S	*	*			trans	-68.4	125.7	150.2	36.2	0	0	0	0	108.3
337	T	40.7	Very low	36.7	Very low	123 Å²	123	138.1 Å²	138.1	76%	0.755	79%	0.787	S	S	*	*	S	Bend	trans	58.1	98.1	165.5	55.2	0	0	0	0	116.9
338	D	31.7	Very low	37.2	Very low	171 Å²	171	140.9 Å²	140.9	91%	0.914	79%	0.791	S	S	*	*				-171.5	126	123.4	-97.3	-22.2	0	0	0	111.2
339	G	41.9	Very low	38	Very low	78 Å²	78	137.9 Å²	137.9	80%	0.804	77%	0.773	S	S	*	*			trans	-88.9	119.7	171.9	0	0	0	0	0	110.1
340	N	33	Very low	39.3	Very low	164 Å²	164	135.7 Å²	135.7	88%	0.877	77%	0.766	S	S	*	*			trans	-156.1	142.2	147.4	-145.9	-6.1	0	0	0	112.4
341	S	46	Very low	40.5	Very low	103 Å²	103	133.9 Å²	133.9	72%	0.72	76%	0.761	S	S	*	*			trans	-74.7	125	-173.1	-178.9	0	0	0	0	112
342	R	38.8	Very low	42.1	Very low	234 Å²	234	134.8 Å²	134.8	88%	0.883	75%	0.748	S	S	*	*			trans	172.1	113.2	135.8	-97.7	164.6	149.3	168.1	-6.3	113.2
343	D	40.8	Very low	43.6	Very low	152 Å²	152	135 Å²	135	81%	0.813	73%	0.733	S	S	*	*			trans	54.8	90.2	136	-131.6	-1.1	0	0	0	118.9
344	S	35.6	Very low	45.6	Very low	114 Å²	114	130 Å²	130	80%	0.797	72%	0.715	S	S	*	*			trans	-157.3	69.9	152.7	45.4	0	0	0	0	110.1	F346	S344-F346 VanDerWaalsContact C-N 3.33Å; S344-F346 PolarHBondContact O-N 2.97Å
345	D	36.8	Very low	47.2	Very low	139 Å²	139	128.4 Å²	128.4	74%	0.743	70%	0.696	S	S	*	*			trans	-73.2	83.9	176	-85.4	-25.9	0	0	0	111.8
346	F	35.7	Very low	49.2	Very low	200 Å²	200	126.1 Å²	126.1	88%	0.877	68%	0.675	S	S	*	*			trans	-127.8	81.4	140.5	-98.8	-87.7	0	0	0	107.2	S344 Q348	S344-F346 VanDerWaalsContact C-N 3.33Å; S344-F346 PolarHBondContact O-N 2.97Å; F346-Q348 VanDerWaalsContact C-N 3.31Å; F346-Q348 PolarHBondContact O-N 3.19Å
347	F	41.5	Very low	50.8	Low	173 Å²	173	127 Å²	127	76%	0.759	67%	0.668	S	S	*	*			trans	-69.7	87.6	176	-154.2	-88.9	0	0	0	108.9	P349	F347-P349 WeakPolarHBondContact O-CD 3.48Å
348	Q	43.7	Very low	52.4	Low	171 Å²	171	126.9 Å²	126.9	80%	0.799	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-61.9	120.4	162.9	-80.2	-175.1	11	0	0	107	F346	F346-Q348 VanDerWaalsContact C-N 3.31Å; F346-Q348 PolarHBondContact O-N 3.19Å
349	P	50.1	Low	54.4	Low	59 Å²	59	122 Å²	122	38%	0.383	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-59.1	141.7	175.7	-10.5	22.2	0	0	0	108	F347 L351 K353 V354	F347-P349 WeakPolarHBondContact O-CD 3.48Å; P349-L351 PolarHBondContact O-N 3.45Å; P349-K353 HydrophobicContact CB-CB 4.23Å; P349-K353 HydrophobicContact CB-CD 4.25Å; P349-K353 HydrophobicContact CB-CG 4.47Å; P349-V354 HydrophobicContact CB-CG2 3.81Å; P349-V354 HydrophobicContact CG-CG2 3.91Å
350	P	66.9	Low	56.2	Low	82 Å²	82	123.8 Å²	123.8	53%	0.532	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-48.9	134.6	175.1	-24.9	31.6	0	0	0	109.3	K352 K353 V354	P350-K352 CarbonylContact O-C 3.51Å; P350-K352 PolarHBondContact O-N 3.01Å; P350-K353 WeakPolarHBondContact O-CA 3.3Å; P350-K353 WeakPolarHBondContact O-CB 3.45Å; P350-K353 PolarHBondContact O-N 3.31Å; P350-V354 PolarHBondContact O-N 3.34Å
351	L	61.8	Low	58.2	Low	125 Å²	125	120.8 Å²	120.8	65%	0.654	61%	0.613	S	S	*	*	H	α-helix	trans	-44.5	-33	-175	-73.1	165.3	0	0	0	113.5	P349 V354 K355	P349-L351 PolarHBondContact O-N 3.45Å; L351-V354 PolarHBondContact O-N 2.83Å; L351-K355 WeakPolarHBondContact O-CB 3.22Å; L351-K355 WeakPolarHBondContact O-CG 3.14Å; L351-K355 PolarHBondContact O-N 3.28Å
352	K	64.5	Low	59.4	Low	110 Å²	110	123.2 Å²	123.2	48%	0.478	61%	0.607	S	S	.	*	H	α-helix	trans	-60.1	-44.1	173.9	-171.5	171.8	-175.4	177.2	0	113.6	P265 P350 L356	P265-K352 HydrophobicContact CB-CB 4.43Å; P265-K352 HydrophobicContact CB-CD 3.86Å; P265-K352 HydrophobicContact CB-CG 3.96Å; P265-K352 HydrophobicContact CG-CB 4.28Å; P265-K352 HydrophobicContact CG-CG 4.33Å; P350-K352 CarbonylContact O-C 3.51Å; P350-K352 PolarHBondContact O-N 3.01Å; K352-L356 HydrophobicContact CG-CD1 4.13Å; K352-L356 WeakPolarHBondContact O-CB 3.27Å; K352-L356 WeakPolarHBondContact O-CD1 3.46Å; K352-L356 VanDerWaalsContact O-CG 3.29Å; K352-L356 WeakPolarHBondContact O-CG 3.31Å; K352-L356 PolarHBondContact O-N 3.02Å
353	K	70.8	Confident	60.8	Low	127 Å²	127	120 Å²	120	55%	0.552	60%	0.602	S	S	*	*	H	α-helix	trans	-68.9	-38.7	178.8	-170.4	176.4	176.3	-174.3	0	111.4	P349 P350 L356 Q357	P349-K353 HydrophobicContact CB-CB 4.23Å; P349-K353 HydrophobicContact CB-CD 4.25Å; P349-K353 HydrophobicContact CB-CG 4.47Å; P350-K353 WeakPolarHBondContact O-CA 3.3Å; P350-K353 WeakPolarHBondContact O-CB 3.45Å; P350-K353 PolarHBondContact O-N 3.31Å; K353-L356 PolarHBondContact O-N 2.99Å; K353-Q357 WeakPolarHBondContact O-CB 3.43Å; K353-Q357 PolarHBondContact O-N 3.46Å
354	V	71.4	Confident	62	Low	65 Å²	65	120.4 Å²	120.4	39%	0.394	61%	0.605	S	S	.	*	H	α-helix	trans	-63.7	-48.1	175.5	-179.4	0	0	0	0	110.8	P349 P350 L351 L356 Q357 E358	P349-V354 HydrophobicContact CB-CG2 3.81Å; P349-V354 HydrophobicContact CG-CG2 3.91Å; P350-V354 PolarHBondContact O-N 3.34Å; L351-V354 PolarHBondContact O-N 2.83Å; V354-L356 VanDerWaalsContact C-N 3.35Å; V354-L356 PolarHBondContact O-N 3.34Å; V354-Q357 WeakPolarHBondContact O-CB 3.32Å; V354-Q357 PolarHBondContact O-N 2.7Å; V354-E358 PolarHBondContact O-N 2.93Å
355	K	70.6	Confident	63.7	Low	99 Å²	99	121.8 Å²	121.8	43%	0.43	60%	0.602	S	S	.	*	H	α-helix	trans	-65.2	-36.3	178.7	-73.2	-74.5	163.1	-157	0	113.2	L266 L351 E358 A359	L266-K355 HydrophobicContact CD1-CB 4.33Å; L351-K355 WeakPolarHBondContact O-CB 3.22Å; L351-K355 WeakPolarHBondContact O-CG 3.14Å; L351-K355 PolarHBondContact O-N 3.28Å; K355-E358 IonicContact NZ-OE1 3.93Å; K355-E358 IonicContact NZ-OE2 3.74Å; K355-E358 PolarHBondContact NZ-OE2 3.44Å; K355-A359 WeakPolarHBondContact O-CB 2.89Å; K355-A359 PolarHBondContact O-N 3.24Å; K355-A359 VanDerWaalsContact O-N 3.1Å
356	L	72.8	Confident	65.2	Low	63 Å²	63	118.9 Å²	118.9	33%	0.33	58%	0.584	S	S	.	*	H	α-helix	trans	-64.5	-44.1	172	-81.9	166.6	0	0	0	111.7	L266 K352 K353 V354 A359 I360	L266-L356 HydrophobicContact CD1-CD2 3.76Å; L266-L356 HydrophobicContact CD1-CG 3.92Å; L266-L356 HydrophobicContact CD2-CD1 4.26Å; L266-L356 HydrophobicContact CD2-CD2 3.39Å; L266-L356 HydrophobicContact CD2-CG 3.7Å; L266-L356 HydrophobicContact CG-CD2 4.22Å; L266-L356 HydrophobicContact CG-CG 4.37Å; K352-L356 HydrophobicContact CG-CD1 4.13Å; K352-L356 WeakPolarHBondContact O-CB 3.27Å; K352-L356 WeakPolarHBondContact O-CD1 3.46Å; K352-L356 VanDerWaalsContact O-CG 3.29Å; K352-L356 WeakPolarHBondContact O-CG 3.31Å; K352-L356 PolarHBondContact O-N 3.02Å; K353-L356 PolarHBondContact O-N 2.99Å; V354-L356 VanDerWaalsContact C-N 3.35Å; V354-L356 PolarHBondContact O-N 3.34Å; L356-A359 PolarHBondContact O-N 3.14Å; L356-I360 HydrophobicContact CB-CD1 4.36Å; L356-I360 HydrophobicContact CD2-CD1 4.44Å; L356-I360 WeakPolarHBondContact O-CB 3.39Å; L356-I360 VanDerWaalsContact O-CD1 3.29Å; L356-I360 WeakPolarHBondContact O-CD1 3.44Å; L356-I360 WeakPolarHBondContact O-CG1 3.22Å; L356-I360 PolarHBondContact O-N 3.43Å
357	Q	72	Confident	66.7	Low	114 Å²	114	120.7 Å²	120.7	53%	0.533	59%	0.585	S	S	.	*	H	α-helix	trans	-61.8	-46.1	178.6	-164.4	111.4	17.6	0	0	110.8	K353 V354 A359 I360 E361	K353-Q357 WeakPolarHBondContact O-CB 3.43Å; K353-Q357 PolarHBondContact O-N 3.46Å; V354-Q357 WeakPolarHBondContact O-CB 3.32Å; V354-Q357 PolarHBondContact O-N 2.7Å; Q357-A359 VanDerWaalsContact C-N 3.31Å; Q357-A359 PolarHBondContact O-N 3.48Å; Q357-I360 PolarHBondContact O-N 3.15Å; Q357-E361 WeakPolarHBondContact O-CB 3.44Å; Q357-E361 PolarHBondContact O-N 3.46Å
358	E	73.9	Confident	67.7	Low	122 Å²	122	120.7 Å²	120.7	57%	0.57	59%	0.588	S	S	*	*	H	α-helix	trans	-58.7	-39	175.9	-172	-177	-178.1	0	0	112.5	V354 K355	V354-E358 PolarHBondContact O-N 2.93Å; K355-E358 IonicContact NZ-OE1 3.93Å; K355-E358 IonicContact NZ-OE2 3.74Å; K355-E358 PolarHBondContact NZ-OE2 3.44Å
359	A	74.3	Confident	68.5	Low	67 Å²	67	119.2 Å²	119.2	55%	0.554	59%	0.585	S	S	*	*	H	α-helix	trans	-79.2	-22.8	179.9	0	0	0	0	0	114.3	K355 L356 Q357	K355-A359 WeakPolarHBondContact O-CB 2.89Å; K355-A359 PolarHBondContact O-N 3.24Å; K355-A359 VanDerWaalsContact O-N 3.1Å; L356-A359 PolarHBondContact O-N 3.14Å; Q357-A359 VanDerWaalsContact C-N 3.31Å; Q357-A359 PolarHBondContact O-N 3.48Å
360	I	79.6	Confident	69.1	Low	116 Å²	116	120.7 Å²	120.7	60%	0.595	59%	0.593	S	S	*	*	H	α-helix	trans	-93.8	-26.6	-177.7	-66	165.1	0	0	0	111.2	L356 Q357 Y362	L356-I360 HydrophobicContact CB-CD1 4.36Å; L356-I360 HydrophobicContact CD2-CD1 4.44Å; L356-I360 WeakPolarHBondContact O-CB 3.39Å; L356-I360 VanDerWaalsContact O-CD1 3.29Å; L356-I360 WeakPolarHBondContact O-CD1 3.44Å; L356-I360 WeakPolarHBondContact O-CG1 3.22Å; L356-I360 PolarHBondContact O-N 3.43Å; Q357-I360 PolarHBondContact O-N 3.15Å; I360-Y362 WeakPolarHBondContact O-CD2 3.19Å; I360-Y362 PolarHBondContact O-N 3.48Å
361	E	74.8	Confident	69	Low	102 Å²	102	121.8 Å²	121.8	48%	0.477	60%	0.601	S	S	.	*			trans	-79.4	115.2	-178.5	-169.8	166.5	-173	0	0	110.9	Q357 Q366	Q357-E361 WeakPolarHBondContact O-CB 3.44Å; Q357-E361 PolarHBondContact O-N 3.46Å; E361-Q366 HydrophobicContact CG-CG 4.24Å; E361-Q366 PolarHBondContact OE1-NE2 3.24Å
362	Y	72.1	Confident	69	Low	153 Å²	153	125.9 Å²	125.9	60%	0.6	61%	0.613	S	S	*	*			trans	-96.8	129.5	172.2	-65.1	-86.1	0	0	0	109.1	I360 D364 L365 Q366	I360-Y362 WeakPolarHBondContact O-CD2 3.19Å; I360-Y362 PolarHBondContact O-N 3.48Å; Y362-D364 PolarHBondContact O-N 3.1Å; Y362-L365 HydrophobicContact CD2-CD1 4.08Å; Y362-L365 HydrophobicContact CG-CD1 4.41Å; Y362-L365 PolarHBondContact O-N 2.82Å; Y362-Q366 PolarHBondContact O-N 3.3Å
363	E	66.6	Low	69.1	Low	166 Å²	166	126.4 Å²	126.4	78%	0.776	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-53.2	-38.4	179.1	-74.2	-175	156.1	0	0	111.9	L365 Q366	E363-L365 VanDerWaalsContact C-N 3.32Å; E363-L365 PolarHBondContact O-N 2.87Å; E363-Q366 PolarHBondContact O-N 2.96Å
364	D	67.4	Low	69.3	Low	161 Å²	161	126.8 Å²	126.8	86%	0.861	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-71.4	-20.4	-178.7	-58.8	-23.7	0	0	0	114.6	Y362	Y362-D364 PolarHBondContact O-N 3.1Å
365	L	70.7	Confident	69.3	Low	144 Å²	144	127.4 Å²	127.4	75%	0.754	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-101.7	-0.1	-178.9	-72.6	170.2	0	0	0	112.8	Y362 E363	Y362-L365 HydrophobicContact CD2-CD1 4.08Å; Y362-L365 HydrophobicContact CG-CD1 4.41Å; Y362-L365 PolarHBondContact O-N 2.82Å; E363-L365 VanDerWaalsContact C-N 3.32Å; E363-L365 PolarHBondContact O-N 2.87Å
366	Q	67.9	Low	69.4	Low	78 Å²	78	129.2 Å²	129.2	36%	0.364	66%	0.664	S	S	.	*	S	Bend	trans	-64.7	138.2	170.2	-69.2	179.1	-10.3	0	0	109	E361 Y362 E363 E368	E361-Q366 HydrophobicContact CG-CG 4.24Å; E361-Q366 PolarHBondContact OE1-NE2 3.24Å; Y362-Q366 PolarHBondContact O-N 3.3Å; E363-Q366 PolarHBondContact O-N 2.96Å; Q366-E368 PolarHBondContact O-N 3.05Å; Q366-E368 VanDerWaalsContact O-N 3.14Å
367	R	68	Low	69.6	Low	238 Å²	238	133.2 Å²	133.2	90%	0.898	69%	0.686	S	S	*	*			trans	-54.1	126.9	164.4	-73.5	-178	-170.1	166.7	4.1	106.2	N369	R367-N369 PolarHBondContact O-N 3.3Å
368	E	63.1	Low	70	Confident	172 Å²	172	132.1 Å²	132.1	80%	0.804	68%	0.683	S	S	*	*			trans	-40.7	108.5	-179.7	-75.6	-162.6	168.6	0	0	109	Q366 T370	Q366-E368 PolarHBondContact O-N 3.05Å; Q366-E368 VanDerWaalsContact O-N 3.14Å; E368-T370 HydrophobicContact CB-CG2 4.27Å; E368-T370 PolarHBondContact O-N 3.09Å
369	N	59.2	Low	70.2	Confident	141 Å²	141	135.9 Å²	135.9	75%	0.754	70%	0.697	S	S	*	*			trans	-80.7	56.4	-179.3	-137.6	-6.9	0	0	0	106	R367 P371	R367-N369 PolarHBondContact O-N 3.3Å; N369-P371 VanDerWaalsContact O-CD 3.31Å; N369-P371 WeakPolarHBondContact O-CD 3.22Å
370	T	62.1	Low	70.2	Confident	90 Å²	90	138.1 Å²	138.1	55%	0.552	69%	0.694	S	S	*	*			trans	-57.6	117.2	166.1	56.3	0	0	0	0	104.3	E368 K372	E368-T370 HydrophobicContact CB-CG2 4.27Å; E368-T370 PolarHBondContact O-N 3.09Å; T370-K372 PolarHBondContact O-N 2.97Å
371	P	65.1	Low	70.1	Confident	105 Å²	105	135.8 Å²	135.8	68%	0.682	69%	0.689	S	S	*	*			trans	-51.9	125.3	178.7	21.2	-31.7	0	0	0	106.3	N369 T373	N369-P371 VanDerWaalsContact O-CD 3.31Å; N369-P371 WeakPolarHBondContact O-CD 3.22Å; P371-T373 VanDerWaalsContact C-N 3.34Å; P371-T373 WeakPolarHBondContact O-CG2 3.24Å; P371-T373 PolarHBondContact O-N 2.87Å
372	K	63	Low	70	Confident	210 Å²	210	136.1 Å²	136.1	91%	0.913	69%	0.694	S	S	*	*			trans	-46.7	101	-177.1	-78.5	-179.4	178.8	175.8	0	108.7	T370 V374	T370-K372 PolarHBondContact O-N 2.97Å; K372-V374 PolarHBondContact O-N 2.78Å
373	T	65.4	Low	70	Confident	121 Å²	121	137 Å²	137	74%	0.742	70%	0.696	S	S	*	*			trans	-73.9	121.2	-179.4	53.9	0	0	0	0	106.2	P371 A375	P371-T373 VanDerWaalsContact C-N 3.34Å; P371-T373 WeakPolarHBondContact O-CG2 3.24Å; P371-T373 PolarHBondContact O-N 2.87Å; T373-A375 PolarHBondContact O-N 3.2Å
374	V	76	Confident	70.4	Confident	136 Å²	136	137.8 Å²	137.8	82%	0.824	69%	0.693	S	S	*	*			trans	-63.2	110	172.4	179.2	0	0	0	0	107.1	K372 L376	K372-V374 PolarHBondContact O-N 2.78Å; V374-L376 PolarHBondContact O-N 3.21Å
375	A	70	Confident	70.8	Confident	77 Å²	77	134.2 Å²	134.2	64%	0.636	69%	0.686	S	S	*	*			trans	-64.1	102.9	176.3	0	0	0	0	0	109.3	T373 N377	T373-A375 PolarHBondContact O-N 3.2Å; A375-N377 PolarHBondContact O-N 3.22Å; A375-N377 VanDerWaalsContact O-N 3.1Å
376	L	73.4	Confident	70.9	Confident	137 Å²	137	134 Å²	134	72%	0.717	68%	0.681	S	S	*	*			trans	-80	90.8	178.7	-172.8	72.8	0	0	0	109.8	V374 L378	V374-L376 PolarHBondContact O-N 3.21Å; L376-L378 HydrophobicContact CD2-CD2 3.8Å; L376-L378 HydrophobicContact CD2-CG 4.33Å; L376-L378 HydrophobicContact CG-CD2 4Å; L376-L378 HydrophobicContact CG-CG 4.37Å; L376-L378 PolarHBondContact O-N 2.89Å
377	N	78.4	Confident	71	Confident	148 Å²	148	131.8 Å²	131.8	79%	0.791	68%	0.679	S	S	*	*			trans	-80.7	99.1	171.4	-71.3	-46	0	0	0	110.1	A375 K379	A375-N377 PolarHBondContact O-N 3.22Å; A375-N377 VanDerWaalsContact O-N 3.1Å; N377-K379 PolarHBondContact O-N 3.12Å; N377-K379 VanDerWaalsContact O-N 3.16Å
378	L	80.3	Confident	71.3	Confident	91 Å²	91	127.1 Å²	127.1	48%	0.476	68%	0.68	S	S	.	*			trans	-69.8	107.6	177.6	-64.4	172	0	0	0	110.4	L376 K380 Y384	L376-L378 HydrophobicContact CD2-CD2 3.8Å; L376-L378 HydrophobicContact CD2-CG 4.33Å; L376-L378 HydrophobicContact CG-CD2 4Å; L376-L378 HydrophobicContact CG-CG 4.37Å; L376-L378 PolarHBondContact O-N 2.89Å; L378-K380 VanDerWaalsContact C-N 3.28Å; L378-K380 PolarHBondContact O-N 3.2Å; L378-Y384 HydrophobicContact CD2-CE2 4.18Å
379	K	76.6	Confident	71.8	Confident	201 Å²	201	123.3 Å²	123.3	87%	0.874	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-24.3	-179.1	-170.5	170.7	-178.1	173.2	0	114.3	N377	N377-K379 PolarHBondContact O-N 3.12Å; N377-K379 VanDerWaalsContact O-N 3.16Å
380	K	74.9	Confident	72.3	Confident	113 Å²	113	121.7 Å²	121.7	49%	0.491	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-144.1	71.4	-176.5	-65.9	-172.7	177.4	-176.5	0	110.6	L378 D382 R383	L378-K380 VanDerWaalsContact C-N 3.28Å; L378-K380 PolarHBondContact O-N 3.2Å; K380-D382 PolarHBondContact O-N 3.31Å; K380-R383 HydrophobicContact CB-CG 4.29Å; K380-R383 PolarHBondContact O-N 3.1Å
381	S	76.9	Confident	72.6	Confident	68 Å²	68	126 Å²	126	48%	0.476	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.8	-32.4	176.4	44.7	0	0	0	0	113	R383 Y384 A385	S381-R383 PolarHBondContact O-N 3.34Å; S381-Y384 WeakPolarHBondContact O-CB 3.45Å; S381-Y384 PolarHBondContact O-N 2.96Å; S381-A385 PolarHBondContact O-N 3.15Å
382	D	73.7	Confident	72.9	Confident	109 Å²	109	128.3 Å²	128.3	58%	0.583	69%	0.686	S	S	*	*	H	α-helix	trans	-59.9	-32.2	-178.6	-51.5	-51.2	0	0	0	112.6	K380 Y384 A385 H386	K380-D382 PolarHBondContact O-N 3.31Å; D382-Y384 VanDerWaalsContact C-N 3.29Å; D382-Y384 PolarHBondContact O-N 2.67Å; D382-A385 PolarHBondContact O-N 3.05Å; D382-H386 PolarHBondContact O-CD2 3.09Å; D382-H386 PolarHBondContact O-N 3.27Å; D382-H386 VanDerWaalsContact O-N 3.12Å
383	R	72.3	Confident	72.8	Confident	172 Å²	172	123.8 Å²	123.8	65%	0.649	68%	0.681	S	S	*	*	H	α-helix	trans	-66.8	-30.5	177	-69.1	-173.9	177	-169.3	-4.1	113	K380 S381 G387	K380-R383 HydrophobicContact CB-CG 4.29Å; K380-R383 PolarHBondContact O-N 3.1Å; S381-R383 PolarHBondContact O-N 3.34Å; R383-G387 PolarHBondContact O-N 3.02Å
384	Y	73.3	Confident	72.6	Confident	182 Å²	182	126.3 Å²	126.3	71%	0.714	68%	0.684	S	S	*	*	H	α-helix	trans	-74.5	-37.5	174.5	-86.1	-86.1	0	0	0	111.3	L378 S381 D382 H386 G387	L378-Y384 HydrophobicContact CD2-CE2 4.18Å; S381-Y384 WeakPolarHBondContact O-CB 3.45Å; S381-Y384 PolarHBondContact O-N 2.96Å; D382-Y384 VanDerWaalsContact C-N 3.29Å; D382-Y384 PolarHBondContact O-N 2.67Å; Y384-H386 VanDerWaalsContact C-N 3.33Å; Y384-H386 PolarHBondContact O-N 3.11Å; Y384-G387 PolarHBondContact O-N 2.83Å
385	A	75.7	Confident	71.9	Confident	86 Å²	86	128.2 Å²	128.2	71%	0.711	68%	0.684	S	S	*	*	H	α-helix	trans	-63.8	-37.5	177.8	0	0	0	0	0	112.5	S381 D382	S381-A385 PolarHBondContact O-N 3.15Å; D382-A385 PolarHBondContact O-N 3.05Å
386	H	73.9	Confident	71.1	Confident	138 Å²	138	135.5 Å²	135.5	64%	0.639	70%	0.697	S	S	*	*	H	α-helix	trans	-81.1	-19.7	176.9	-64	-58.9	0	0	0	114	D382 Y384	D382-H386 PolarHBondContact O-CD2 3.09Å; D382-H386 PolarHBondContact O-N 3.27Å; D382-H386 VanDerWaalsContact O-N 3.12Å; Y384-H386 VanDerWaalsContact C-N 3.33Å; Y384-H386 PolarHBondContact O-N 3.11Å
387	G	70.4	Confident	70.6	Confident	33 Å²	33	132.9 Å²	132.9	34%	0.34	69%	0.686	S	S	.	*	T	Hydrogen-bonded Turn	trans	63.1	-179.8	-179.2	0	0	0	0	0	114.2	R383 Y384 V389	R383-G387 PolarHBondContact O-N 3.02Å; Y384-G387 PolarHBondContact O-N 2.83Å; G387-V389 PolarHBondContact O-N 2.87Å
388	P	74.6	Confident	70.2	Confident	140 Å²	140	129.4 Å²	129.4	91%	0.909	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	46.4	176.5	35.5	-36.2	0	0	0	111.4
389	V	72.1	Confident	70	Confident	91 Å²	91	129.1 Å²	129.1	55%	0.552	68%	0.676	S	S	*	*			trans	-85.2	126.2	172.5	-169.7	0	0	0	0	106.6	G387 L391	G387-V389 PolarHBondContact O-N 2.87Å; V389-L391 PolarHBondContact O-N 3.39Å
390	P	71.3	Confident	70	Confident	108 Å²	108	125.6 Å²	125.6	70%	0.701	66%	0.663	S	S	*	*			trans	-49.3	130.9	170.5	-23.5	32.5	0	0	0	108.2	Q392	P390-Q392 VanDerWaalsContact C-N 3.3Å; P390-Q392 PolarHBondContact O-N 2.68Å
391	L	68	Low	70.2	Confident	181 Å²	181	124 Å²	124	95%	0.948	66%	0.659	S	S	*	*			trans	-52.9	98.3	178.5	-77.7	158.5	0	0	0	108.2	V389 S393	V389-L391 PolarHBondContact O-N 3.39Å; L391-S393 PolarHBondContact O-N 3.28Å
392	Q	70.6	Confident	70.4	Confident	153 Å²	153	125.1 Å²	125.1	72%	0.715	66%	0.659	S	S	*	*			trans	-65.4	135.3	166.6	-68.4	-178.8	-12.8	0	0	104.9	P390 Q394	P390-Q392 VanDerWaalsContact C-N 3.3Å; P390-Q392 PolarHBondContact O-N 2.68Å; Q392-Q394 PolarHBondContact O-N 3.3Å
393	S	62.2	Low	70.9	Confident	115 Å²	115	125.2 Å²	125.2	80%	0.804	66%	0.659	S	S	*	*			trans	-61.1	88.4	172.9	51.5	0	0	0	0	108.2	L391 Q395	L391-S393 PolarHBondContact O-N 3.28Å; S393-Q395 PolarHBondContact O-N 2.67Å; S393-Q395 VanDerWaalsContact O-N 3.08Å
394	Q	61	Low	71.6	Confident	173 Å²	173	120.4 Å²	120.4	81%	0.808	65%	0.646	S	S	*	*			trans	-67.3	107.1	165.5	-72.3	-171.7	-16.7	0	0	104.9	Q392 Y396	Q392-Q394 PolarHBondContact O-N 3.3Å; Q394-Y396 PolarHBondContact O-N 2.92Å
395	Q	59.6	Low	72.1	Confident	176 Å²	176	114.8 Å²	114.8	82%	0.822	63%	0.633	S	S	*	*			trans	-56.5	126	168.6	-71.1	-178.2	-20.2	0	0	106.7	S393 T397	S393-Q395 PolarHBondContact O-N 2.67Å; S393-Q395 VanDerWaalsContact O-N 3.08Å; Q395-T397 VanDerWaalsContact C-N 3.31Å; Q395-T397 PolarHBondContact O-N 3.46Å
396	Y	54.4	Low	72.7	Confident	231 Å²	231	114.6 Å²	114.6	91%	0.906	62%	0.623	S	S	*	*			trans	-65.9	95.9	174.5	-129.4	-94.7	0	0	0	106.8	Q394 T398	Q394-Y396 PolarHBondContact O-N 2.92Å; Y396-T398 PolarHBondContact O-N 3.23Å
397	T	61.8	Low	73.3	Confident	81 Å²	81	110.2 Å²	110.2	50%	0.497	61%	0.607	S	S	.	*			trans	-70.2	117.3	172.1	-48.4	0	0	0	0	106.7	Q395 D401 I402	Q395-T397 VanDerWaalsContact C-N 3.31Å; Q395-T397 PolarHBondContact O-N 3.46Å; T397-D401 HydrophobicContact CG2-CB 3.73Å; T397-I402 HydrophobicContact CG2-CG1 3.75Å
398	T	71.9	Confident	74.1	Confident	75 Å²	75	116 Å²	116	46%	0.46	62%	0.62	S	S	.	*			trans	-62.2	143.8	179.1	-49.3	0	0	0	0	108.2	Y396 Q400 D401 I402	Y396-T398 PolarHBondContact O-N 3.23Å; T398-Q400 HydrophobicContact CG2-CB 4.26Å; T398-Q400 PolarHBondContact O-N 2.94Å; T398-D401 PolarHBondContact N-OD2 2.96Å; T398-D401 WeakPolarHBondContact O-CB 3.21Å; T398-D401 PolarHBondContact O-N 3.15Å; T398-I402 PolarHBondContact O-N 3.44Å
399	S	74.3	Confident	74.8	Confident	85 Å²	85	114 Å²	114	59%	0.594	60%	0.601	S	S	*	*	H	α-helix	trans	-51.4	-30.6	176.9	49.6	0	0	0	0	112.7	I402 I403	S399-I402 PolarHBondContact O-N 2.84Å; S399-I403 WeakPolarHBondContact O-CD1 2.97Å; S399-I403 VanDerWaalsContact O-CG1 3.26Å; S399-I403 WeakPolarHBondContact O-CG1 3.41Å; S399-I403 PolarHBondContact O-N 2.96Å
400	Q	77.2	Confident	75.6	Confident	128 Å²	128	115.9 Å²	115.9	60%	0.598	60%	0.604	S	S	*	*	H	α-helix	trans	-70.5	-34.5	176.3	-157.2	149.2	2.9	0	0	113.7	T398 I402 I403 N404	T398-Q400 HydrophobicContact CG2-CB 4.26Å; T398-Q400 PolarHBondContact O-N 2.94Å; Q400-I402 VanDerWaalsContact C-N 3.33Å; Q400-I403 PolarHBondContact O-N 3.3Å; Q400-N404 VanDerWaalsContact O-CB 3.31Å; Q400-N404 WeakPolarHBondContact O-CB 3.39Å; Q400-N404 PolarHBondContact O-N 3.22Å; Q400-N404 PolarHBondContact O-ND2 3.2Å
401	D	78.8	Confident	76.4	Confident	78 Å²	78	116.6 Å²	116.6	42%	0.417	60%	0.598	S	S	.	*	H	α-helix	trans	-69.2	-34.4	174	-63	-36.9	0	0	0	111.1	T397 T398 S405	T397-D401 HydrophobicContact CG2-CB 3.73Å; T398-D401 PolarHBondContact N-OD2 2.96Å; T398-D401 WeakPolarHBondContact O-CB 3.21Å; T398-D401 PolarHBondContact O-N 3.15Å; D401-S405 VanDerWaalsContact O-CB 3.26Å; D401-S405 WeakPolarHBondContact O-CB 3.18Å; D401-S405 PolarHBondContact O-N 3.22Å; D401-S405 PolarHBondContact O-OG 3.02Å
402	I	81.1	Confident	77.2	Confident	92 Å²	92	114.5 Å²	114.5	47%	0.472	58%	0.583	S	S	.	*	H	α-helix	trans	-65.3	-49	173.9	-57.4	176.8	0	0	0	109.9	T397 T398 S399 Q400 N404 S405 V406	T397-I402 HydrophobicContact CG2-CG1 3.75Å; T398-I402 PolarHBondContact O-N 3.44Å; S399-I402 PolarHBondContact O-N 2.84Å; Q400-I402 VanDerWaalsContact C-N 3.33Å; I402-N404 VanDerWaalsContact C-N 3.34Å; I402-N404 PolarHBondContact O-N 3.47Å; I402-S405 PolarHBondContact O-N 3.27Å; I402-V406 VanDerWaalsContact O-CG2 3.3Å; I402-V406 WeakPolarHBondContact O-CG2 3.41Å; I402-V406 PolarHBondContact O-N 2.78Å
403	I	85.3	Confident	77.8	Confident	112 Å²	112	114.2 Å²	114.2	57%	0.574	58%	0.583	S	S	*	*	H	α-helix	trans	-61.3	-43.5	178.9	-67	163	0	0	0	110.8	S399 Q400 V406 S407	S399-I403 WeakPolarHBondContact O-CD1 2.97Å; S399-I403 VanDerWaalsContact O-CG1 3.26Å; S399-I403 WeakPolarHBondContact O-CG1 3.41Å; S399-I403 PolarHBondContact O-N 2.96Å; Q400-I403 PolarHBondContact O-N 3.3Å; I403-V406 PolarHBondContact O-N 3.45Å; I403-S407 PolarHBondContact O-N 2.86Å; I403-S407 PolarHBondContact O-OG 2.78Å
404	N	85.9	Confident	79	Confident	71 Å²	71	113.9 Å²	113.9	38%	0.38	58%	0.577	S	S	.	*	H	α-helix	trans	-64.7	-42.8	176.3	-70	-18.4	0	0	0	111.6	Q400 I402 V406 S407 Y408	Q400-N404 VanDerWaalsContact O-CB 3.31Å; Q400-N404 WeakPolarHBondContact O-CB 3.39Å; Q400-N404 PolarHBondContact O-N 3.22Å; Q400-N404 PolarHBondContact O-ND2 3.2Å; I402-N404 VanDerWaalsContact C-N 3.34Å; I402-N404 PolarHBondContact O-N 3.47Å; N404-V406 VanDerWaalsContact C-N 3.33Å; N404-V406 PolarHBondContact O-N 3.42Å; N404-S407 PolarHBondContact O-N 3.44Å; N404-S407 PolarHBondContact O-OG 3.49Å; N404-Y408 WeakPolarHBondContact O-CB 3.39Å; N404-Y408 WeakPolarHBondContact O-CD2 3.19Å; N404-Y408 PolarHBondContact O-N 3.36Å
405	S	84.9	Confident	80	Confident	63 Å²	63	111.8 Å²	111.8	44%	0.441	57%	0.571	S	S	.	*	H	α-helix	trans	-63.4	-40.7	178.2	-60	0	0	0	0	111.5	D401 I402 Y408 I409	D401-S405 VanDerWaalsContact O-CB 3.26Å; D401-S405 WeakPolarHBondContact O-CB 3.18Å; D401-S405 PolarHBondContact O-N 3.22Å; D401-S405 PolarHBondContact O-OG 3.02Å; I402-S405 PolarHBondContact O-N 3.27Å; S405-Y408 PolarHBondContact O-N 3.5Å; S405-I409 WeakPolarHBondContact O-CB 3.23Å; S405-I409 WeakPolarHBondContact O-CD1 3.46Å; S405-I409 WeakPolarHBondContact O-CG1 3.32Å; S405-I409 PolarHBondContact O-N 3.48Å
406	V	87.5	Confident	81	Confident	83 Å²	83	110.5 Å²	110.5	50%	0.503	56%	0.56	S	S	.	*	H	α-helix	trans	-64.4	-42.9	176.2	172	0	0	0	0	111.1	I402 I403 N404 I409 Q410	I402-V406 VanDerWaalsContact O-CG2 3.3Å; I402-V406 WeakPolarHBondContact O-CG2 3.41Å; I402-V406 PolarHBondContact O-N 2.78Å; I403-V406 PolarHBondContact O-N 3.45Å; N404-V406 VanDerWaalsContact C-N 3.33Å; N404-V406 PolarHBondContact O-N 3.42Å; V406-I409 PolarHBondContact O-N 3.08Å; V406-Q410 WeakPolarHBondContact O-CB 3.48Å; V406-Q410 PolarHBondContact O-N 3.02Å
407	S	86.4	Confident	82.2	Confident	45 Å²	45	107.8 Å²	107.8	32%	0.315	55%	0.553	S	S	.	*	H	α-helix	trans	-66.7	-40.2	177.8	68.4	0	0	0	0	112.2	I403 N404 Q410 Q411	I403-S407 PolarHBondContact O-N 2.86Å; I403-S407 PolarHBondContact O-OG 2.78Å; N404-S407 PolarHBondContact O-N 3.44Å; N404-S407 PolarHBondContact O-OG 3.49Å; S407-Q410 PolarHBondContact O-N 3.37Å; S407-Q411 WeakPolarHBondContact O-CG 3.44Å; S407-Q411 PolarHBondContact O-N 3.43Å
408	Y	87	Confident	82.8	Confident	154 Å²	154	108.3 Å²	108.3	60%	0.604	56%	0.557	S	S	*	*	H	α-helix	trans	-62.5	-46.5	173.1	-82.9	-63.5	0	0	0	112.1	N404 S405 Q410 Q411 E412	N404-Y408 WeakPolarHBondContact O-CB 3.39Å; N404-Y408 WeakPolarHBondContact O-CD2 3.19Å; N404-Y408 PolarHBondContact O-N 3.36Å; S405-Y408 PolarHBondContact O-N 3.5Å; Y408-Q410 VanDerWaalsContact C-N 3.32Å; Y408-Q410 PolarHBondContact O-N 3.07Å; Y408-Q411 PolarHBondContact O-N 3.39Å; Y408-E412 WeakPolarHBondContact O-CB 3.29Å; Y408-E412 WeakPolarHBondContact O-CG 3.46Å; Y408-E412 PolarHBondContact O-N 3.49Å
409	I	89.4	Confident	82.8	Confident	99 Å²	99	109.7 Å²	109.7	51%	0.508	56%	0.562	S	S	.	*	H	α-helix	trans	-61	-43.8	177	-70.2	163.1	0	0	0	110.4	S405 V406 Q411 E412 M413	S405-I409 WeakPolarHBondContact O-CB 3.23Å; S405-I409 WeakPolarHBondContact O-CD1 3.46Å; S405-I409 WeakPolarHBondContact O-CG1 3.32Å; S405-I409 PolarHBondContact O-N 3.48Å; V406-I409 PolarHBondContact O-N 3.08Å; I409-Q411 PolarHBondContact O-N 3.41Å; I409-E412 PolarHBondContact O-N 2.89Å; I409-M413 HydrophobicContact CG2-CG 4.18Å; I409-M413 HydrophobicContact CG2-SD 4.02Å; I409-M413 WeakPolarHBondContact O-CB 3.24Å; I409-M413 VanDerWaalsContact O-CG 3.29Å; I409-M413 WeakPolarHBondContact O-CG 3.44Å; I409-M413 PolarHBondContact O-N 2.93Å
410	Q	89.4	Confident	82.4	Confident	131 Å²	131	113 Å²	113	61%	0.612	57%	0.572	S	S	*	*	H	α-helix	trans	-64	-41.6	179.8	-169.7	174.6	7	0	0	111.7	V406 S407 Y408 T414	V406-Q410 WeakPolarHBondContact O-CB 3.48Å; V406-Q410 PolarHBondContact O-N 3.02Å; S407-Q410 PolarHBondContact O-N 3.37Å; Y408-Q410 VanDerWaalsContact C-N 3.32Å; Y408-Q410 PolarHBondContact O-N 3.07Å; Q410-T414 WeakPolarHBondContact O-CB 3.46Å; Q410-T414 PolarHBondContact O-N 3.43Å; Q410-T414 PolarHBondContact O-OG1 3.17Å
411	Q	87.3	Confident	82	Confident	122 Å²	122	113.2 Å²	113.2	57%	0.57	58%	0.582	S	S	*	*	H	α-helix	trans	-66.8	-45.1	175.3	-75	-177	-3.9	0	0	112.3	S407 Y408 I409 T414 N415	S407-Q411 WeakPolarHBondContact O-CG 3.44Å; S407-Q411 PolarHBondContact O-N 3.43Å; Y408-Q411 PolarHBondContact O-N 3.39Å; I409-Q411 PolarHBondContact O-N 3.41Å; Q411-T414 PolarHBondContact O-N 3.24Å; Q411-N415 WeakPolarHBondContact O-CB 3.42Å; Q411-N415 PolarHBondContact O-N 3.28Å
412	E	85.1	Confident	81.4	Confident	138 Å²	138	120 Å²	120	65%	0.645	60%	0.602	S	S	*	*	H	α-helix	trans	-60.4	-47.1	176.5	-82.6	-70.2	144.2	0	0	111.3	Y408 I409 T414 N415 Y416	Y408-E412 WeakPolarHBondContact O-CB 3.29Å; Y408-E412 WeakPolarHBondContact O-CG 3.46Å; Y408-E412 PolarHBondContact O-N 3.49Å; I409-E412 PolarHBondContact O-N 2.89Å; E412-T414 PolarHBondContact O-N 2.66Å; E412-N415 CarbonylContact O-C 3.56Å; E412-N415 PolarHBondContact O-N 3.18Å; E412-Y416 WeakPolarHBondContact O-CA 3.35Å; E412-Y416 VanDerWaalsContact O-CB 3.28Å; E412-Y416 WeakPolarHBondContact O-CB 3.4Å; E412-Y416 PolarHBondContact O-N 3.34Å
413	M	84.5	Confident	81	Confident	146 Å²	146	120.3 Å²	120.3	72%	0.719	61%	0.608	S	S	*	*	H	α-helix	trans	-65.3	-37.2	178.1	-72.4	-168.4	83.8	0	0	112.8	I409 N415	I409-M413 HydrophobicContact CG2-CG 4.18Å; I409-M413 HydrophobicContact CG2-SD 4.02Å; I409-M413 WeakPolarHBondContact O-CB 3.24Å; I409-M413 VanDerWaalsContact O-CG 3.29Å; I409-M413 WeakPolarHBondContact O-CG 3.44Å; I409-M413 PolarHBondContact O-N 2.93Å; M413-N415 VanDerWaalsContact C-N 3.35Å
414	T	85.6	Confident	80.6	Confident	109 Å²	109	121 Å²	121	67%	0.669	61%	0.612	S	S	*	*	H	α-helix	trans	-70.6	-34.3	179	-52.8	0	0	0	0	111.5	Q410 Q411 E412	Q410-T414 WeakPolarHBondContact O-CB 3.46Å; Q410-T414 PolarHBondContact O-N 3.43Å; Q410-T414 PolarHBondContact O-OG1 3.17Å; Q411-T414 PolarHBondContact O-N 3.24Å; E412-T414 PolarHBondContact O-N 2.66Å
415	N	82.3	Confident	80.4	Confident	128 Å²	128	120.2 Å²	120.2	68%	0.684	61%	0.613	S	S	*	*	H	α-helix	trans	-93.8	0.4	-179.9	-67.7	-22	0	0	0	113.5	Q411 E412 M413 K417	Q411-N415 WeakPolarHBondContact O-CB 3.42Å; Q411-N415 PolarHBondContact O-N 3.28Å; E412-N415 CarbonylContact O-C 3.56Å; E412-N415 PolarHBondContact O-N 3.18Å; M413-N415 VanDerWaalsContact C-N 3.35Å; N415-K417 PolarHBondContact O-N 3.25Å
416	Y	81.1	Confident	80.3	Confident	150 Å²	150	121.7 Å²	121.7	59%	0.588	62%	0.623	S	S	*	*			trans	-70.1	117	-176.6	-174.4	-104.6	0	0	0	111.3	E412 P418	E412-Y416 WeakPolarHBondContact O-CA 3.35Å; E412-Y416 VanDerWaalsContact O-CB 3.28Å; E412-Y416 WeakPolarHBondContact O-CB 3.4Å; E412-Y416 PolarHBondContact O-N 3.34Å; Y416-P418 HydrophobicContact CE1-CB 3.84Å
417	K	79.7	Confident	80.2	Confident	174 Å²	174	122.5 Å²	122.5	76%	0.757	63%	0.628	S	S	*	*			trans	-108.4	118.8	165.7	-69.5	-176.2	179.1	179	0	108.6	N415 N419	N415-K417 PolarHBondContact O-N 3.25Å; K417-N419 PolarHBondContact O-N 2.92Å; K417-N419 VanDerWaalsContact O-N 3.14Å
418	P	74.6	Confident	80.2	Confident	91 Å²	91	124.3 Å²	124.3	59%	0.591	64%	0.637	S	S	*	*			trans	-66.8	115.8	-176.7	25.6	-32.8	0	0	0	110.6	Y416	Y416-P418 HydrophobicContact CE1-CB 3.84Å
419	N	72.6	Confident	80.2	Confident	104 Å²	104	118.7 Å²	118.7	56%	0.556	62%	0.623	S	S	*	*			trans	-101.4	89.4	170.9	-83	-44.3	0	0	0	109.5	K417 T421 R422	K417-N419 PolarHBondContact O-N 2.92Å; K417-N419 VanDerWaalsContact O-N 3.14Å; N419-T421 PolarHBondContact O-N 3.39Å; N419-T421 VanDerWaalsContact O-N 3.11Å; N419-R422 HydrophobicContact CB-CB 4.37Å; N419-R422 PolarHBondContact O-N 3.43Å
420	L	65.6	Low	80.1	Confident	154 Å²	154	118.3 Å²	118.3	81%	0.806	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-57.2	-26.4	-178.5	-66.9	170.1	0	0	0	113.2	R422	L420-R422 VanDerWaalsContact C-N 3.3Å; L420-R422 PolarHBondContact O-N 3.02Å
421	T	67.3	Low	80.1	Confident	133 Å²	133	115.9 Å²	115.9	82%	0.816	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-76.4	-12.6	179.6	52.6	0	0	0	0	114.4	N419	N419-T421 PolarHBondContact O-N 3.39Å; N419-T421 VanDerWaalsContact O-N 3.11Å
422	R	67.3	Low	80	Confident	220 Å²	220	112.3 Å²	112.3	83%	0.83	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-112.5	1	-175.8	-121.9	-176.6	178.4	-168.4	-2.6	114	N419 L420 L424	N419-R422 HydrophobicContact CB-CB 4.37Å; N419-R422 PolarHBondContact O-N 3.43Å; L420-R422 VanDerWaalsContact C-N 3.3Å; L420-R422 PolarHBondContact O-N 3.02Å; R422-L424 VanDerWaalsContact C-N 3.31Å; R422-L424 PolarHBondContact O-N 3.18Å
423	V	72.9	Confident	80.1	Confident	99 Å²	99	111 Å²	111	60%	0.6	61%	0.61	S	S	*	*	S	Bend	trans	-65	-36.6	-176.1	179.1	0	0	0	0	111.6
424	L	75.6	Confident	80.2	Confident	126 Å²	126	106.7 Å²	106.7	66%	0.66	60%	0.598	S	S	*	*	S	Bend	trans	-135.2	118	179.3	-77.9	152.9	0	0	0	108.8	R422	R422-L424 VanDerWaalsContact C-N 3.31Å; R422-L424 PolarHBondContact O-N 3.18Å
425	S	83.3	Confident	80.2	Confident	56 Å²	56	102.5 Å²	102.5	39%	0.392	57%	0.574	S	S	.	*			trans	-74.5	145.2	165.1	62.7	0	0	0	0	109.4	T427 T428 A429	S425-T427 PolarHBondContact O-N 3.31Å; S425-T427 PolarHBondContact OG-OG1 3.49Å; S425-T428 PolarHBondContact O-N 3.3Å; S425-T428 WeakPolarHBondContact OG-CB 3.49Å; S425-T428 PolarHBondContact OG-N 2.79Å; S425-T428 PolarHBondContact OG-OG1 2.99Å; S425-A429 PolarHBondContact O-N 3.39Å; S425-A429 VanDerWaalsContact O-N 3.16Å
426	S	82.6	Confident	80.3	Confident	94 Å²	94	101.8 Å²	101.8	66%	0.657	57%	0.57	S	S	*	*	H	α-helix	trans	-55.3	-40	176.4	57.3	0	0	0	0	111.4	T428 A429 T430	S426-T428 PolarHBondContact O-N 3.5Å; S426-A429 PolarHBondContact O-N 3.28Å; S426-T430 PolarHBondContact O-N 3.34Å; S426-T430 PolarHBondContact O-OG1 2.92Å
427	T	85.8	Confident	80.4	Confident	99 Å²	99	97 Å²	97	61%	0.607	56%	0.558	S	S	*	*	H	α-helix	trans	-61.1	-41.5	178.7	50.4	0	0	0	0	113.8	S425 S431	S425-T427 PolarHBondContact O-N 3.31Å; S425-T427 PolarHBondContact OG-OG1 3.49Å; T427-S431 WeakPolarHBondContact O-CB 3.46Å; T427-S431 PolarHBondContact O-N 3.39Å
428	T	86.3	Confident	80.4	Confident	83 Å²	83	94.2 Å²	94.2	51%	0.509	56%	0.558	S	S	.	*	H	α-helix	trans	-70.5	-38.4	178	-59.6	0	0	0	0	110.9	S425 S426 S431 A432	S425-T428 PolarHBondContact O-N 3.3Å; S425-T428 WeakPolarHBondContact OG-CB 3.49Å; S425-T428 PolarHBondContact OG-N 2.79Å; S425-T428 PolarHBondContact OG-OG1 2.99Å; S426-T428 PolarHBondContact O-N 3.5Å; T428-S431 PolarHBondContact O-N 2.7Å; T428-A432 WeakPolarHBondContact O-CB 3.43Å; T428-A432 PolarHBondContact O-N 3.37Å
429	A	86.6	Confident	80.5	Confident	37 Å²	37	93.7 Å²	93.7	31%	0.306	57%	0.569	S	S	.	*	H	α-helix	trans	-62.7	-45.4	175.1	0	0	0	0	0	111.6	S425 S426 S431 A432 I433	S425-A429 PolarHBondContact O-N 3.39Å; S425-A429 VanDerWaalsContact O-N 3.16Å; S426-A429 PolarHBondContact O-N 3.28Å; A429-S431 VanDerWaalsContact C-N 3.35Å; A429-S431 PolarHBondContact O-N 3.41Å; A429-A432 PolarHBondContact O-N 2.94Å; A429-I433 VanDerWaalsContact O-CG1 3.29Å; A429-I433 WeakPolarHBondContact O-CG1 3.25Å; A429-I433 PolarHBondContact O-N 2.95Å
430	T	87.8	Confident	80.9	Confident	91 Å²	91	89.5 Å²	89.5	56%	0.558	55%	0.55	S	S	*	*	H	α-helix	trans	-65.3	-38.3	177.2	-31.3	0	0	0	0	112	S426 I433 A434	S426-T430 PolarHBondContact O-N 3.34Å; S426-T430 PolarHBondContact O-OG1 2.92Å; T430-I433 PolarHBondContact O-N 3.08Å; T430-A434 WeakPolarHBondContact O-CB 3.09Å; T430-A434 PolarHBondContact O-N 3Å
431	S	87.8	Confident	81.5	Confident	79 Å²	79	88.5 Å²	88.5	55%	0.552	55%	0.551	S	S	*	*	H	α-helix	trans	-64.7	-42.3	175.9	-175.2	0	0	0	0	112.2	T427 T428 A429 A434 A435	T427-S431 WeakPolarHBondContact O-CB 3.46Å; T427-S431 PolarHBondContact O-N 3.39Å; T428-S431 PolarHBondContact O-N 2.7Å; A429-S431 VanDerWaalsContact C-N 3.35Å; A429-S431 PolarHBondContact O-N 3.41Å; S431-A434 PolarHBondContact O-N 2.88Å; S431-A435 WeakPolarHBondContact O-CB 3.41Å; S431-A435 PolarHBondContact O-N 3.33Å
432	A	86.4	Confident	82	Confident	47 Å²	47	88.1 Å²	88.1	39%	0.388	54%	0.543	S	S	.	.	H	α-helix	trans	-64.2	-42.1	175.4	0	0	0	0	0	111.9	T428 A429 A434 A435 L436	T428-A432 WeakPolarHBondContact O-CB 3.43Å; T428-A432 PolarHBondContact O-N 3.37Å; A429-A432 PolarHBondContact O-N 2.94Å; A432-A434 VanDerWaalsContact C-N 3.34Å; A432-A435 PolarHBondContact O-N 3.33Å; A432-L436 WeakPolarHBondContact O-CG 3.44Å; A432-L436 PolarHBondContact O-N 3.33Å
433	I	86.8	Confident	82.4	Confident	110 Å²	110	81.8 Å²	81.8	56%	0.564	52%	0.523	S	S	*	.	H	α-helix	trans	-62.9	-42.2	174.5	-67.1	165.8	0	0	0	110.5	A429 T430 A435 L436 S437	A429-I433 VanDerWaalsContact O-CG1 3.29Å; A429-I433 WeakPolarHBondContact O-CG1 3.25Å; A429-I433 PolarHBondContact O-N 2.95Å; T430-I433 PolarHBondContact O-N 3.08Å; I433-A435 VanDerWaalsContact C-N 3.33Å; I433-A435 PolarHBondContact O-N 3.46Å; I433-L436 CarbonylContact O-C 3.57Å; I433-L436 PolarHBondContact O-N 3.2Å; I433-S437 WeakPolarHBondContact O-CB 3.47Å; I433-S437 PolarHBondContact O-N 2.96Å; I433-S437 PolarHBondContact O-OG 3.47Å
434	A	86.3	Confident	82	Confident	57 Å²	57	84 Å²	84	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-63.7	-37.7	176	0	0	0	0	0	112.1	T430 S431 A432 L436 S437 G440	T430-A434 WeakPolarHBondContact O-CB 3.09Å; T430-A434 PolarHBondContact O-N 3Å; S431-A434 PolarHBondContact O-N 2.88Å; A432-A434 VanDerWaalsContact C-N 3.34Å; A434-L436 VanDerWaalsContact C-N 3.32Å; A434-L436 PolarHBondContact O-N 3.43Å; A434-S437 PolarHBondContact O-N 3.48Å; A434-G440 WeakPolarHBondContact O-CA 3.45Å
435	A	86.1	Confident	81.4	Confident	20 Å²	20	83.7 Å²	83.7	17%	0.165	53%	0.533	C	S	.	.	H	α-helix	trans	-68.4	-29.6	176.2	0	0	0	0	0	113.3	S431 A432 I433 G440 V441 L442 M443	S431-A435 WeakPolarHBondContact O-CB 3.41Å; S431-A435 PolarHBondContact O-N 3.33Å; A432-A435 PolarHBondContact O-N 3.33Å; I433-A435 VanDerWaalsContact C-N 3.33Å; I433-A435 PolarHBondContact O-N 3.46Å; A435-G440 CarbonylContact O-C 3.27Å; A435-G440 VanDerWaalsContact O-C 3.27Å; A435-G440 WeakPolarHBondContact O-CA 3.44Å; A435-V441 PolarHBondContact O-N 2.89Å; A435-L442 HydrophobicContact CB-CD1 4.08Å; A435-L442 HydrophobicContact CB-CG 4.24Å; A435-L442 PolarHBondContact O-N 3.37Å; A435-M443 PolarHBondContact O-N 3.18Å
436	L	84.8	Confident	80.1	Confident	114 Å²	114	87.6 Å²	87.6	60%	0.597	55%	0.554	S	S	*	*	H	α-helix	trans	-91.9	-12.6	177.6	-68.1	170.2	0	0	0	113.7	A432 I433 A434 L442	A432-L436 WeakPolarHBondContact O-CG 3.44Å; A432-L436 PolarHBondContact O-N 3.33Å; I433-L436 CarbonylContact O-C 3.57Å; I433-L436 PolarHBondContact O-N 3.2Å; A434-L436 VanDerWaalsContact C-N 3.32Å; A434-L436 PolarHBondContact O-N 3.43Å; L436-L442 HydrophobicContact CD2-CB 4.29Å; L436-L442 HydrophobicContact CD2-CD1 4.44Å
437	S	83.7	Confident	78.8	Confident	48 Å²	48	85.5 Å²	85.5	34%	0.336	55%	0.547	S	S	.	.	S	Bend	trans	-69.3	156.9	177.2	-67.4	0	0	0	0	110.9	I433 A434 G439 G440	I433-S437 WeakPolarHBondContact O-CB 3.47Å; I433-S437 PolarHBondContact O-N 2.96Å; I433-S437 PolarHBondContact O-OG 3.47Å; A434-S437 PolarHBondContact O-N 3.48Å; S437-G439 PolarHBondContact O-N 3.15Å; S437-G439 VanDerWaalsContact O-N 3.11Å; S437-G440 WeakPolarHBondContact O-CA 3.33Å; S437-G440 PolarHBondContact O-N 3.4Å
438	P	79.2	Confident	77.3	Confident	117 Å²	117	89.1 Å²	89.1	76%	0.76	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	117.6	175.1	-25.9	34.9	0	0	0	112.2	M443	P438-M443 VanDerWaalsContact CA-SD 3.57Å; P438-M443 HydrophobicContact CB-CE 4.22Å; P438-M443 HydrophobicContact CB-SD 4.24Å; P438-M443 HydrophobicContact CG-SD 4.19Å
439	G	75.4	Confident	75.7	Confident	79 Å²	79	92.3 Å²	92.3	81%	0.814	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	93	-0.6	-174.1	0	0	0	0	0	115.3	S437	S437-G439 PolarHBondContact O-N 3.15Å; S437-G439 VanDerWaalsContact O-N 3.11Å
440	G	80.7	Confident	74.1	Confident	16 Å²	16	93.7 Å²	93.7	17%	0.165	57%	0.574	C	S	.	*	S	Bend	trans	-74	159.4	173.3	0	0	0	0	0	113.2	A434 A435 S437 L442 M443	A434-G440 WeakPolarHBondContact O-CA 3.45Å; A435-G440 CarbonylContact O-C 3.27Å; A435-G440 VanDerWaalsContact O-C 3.27Å; A435-G440 WeakPolarHBondContact O-CA 3.44Å; S437-G440 WeakPolarHBondContact O-CA 3.33Å; S437-G440 PolarHBondContact O-N 3.4Å; G440-L442 PolarHBondContact O-N 2.84Å; G440-L442 VanDerWaalsContact O-N 3.12Å; G440-M443 PolarHBondContact O-N 2.91Å; G440-M443 VanDerWaalsContact O-N 3.1Å
441	V	79.8	Confident	72.5	Confident	134 Å²	134	92.3 Å²	92.3	81%	0.812	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-30.8	-173	179.4	0	0	0	0	113.4	A435	A435-V441 PolarHBondContact O-N 2.89Å
442	L	77.4	Confident	70.9	Confident	124 Å²	124	94.6 Å²	94.6	65%	0.649	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-20.2	-178.2	-63.3	174.9	0	0	0	112.8	A435 L436 G440 Q444	A435-L442 HydrophobicContact CB-CD1 4.08Å; A435-L442 HydrophobicContact CB-CG 4.24Å; A435-L442 PolarHBondContact O-N 3.37Å; L436-L442 HydrophobicContact CD2-CB 4.29Å; L436-L442 HydrophobicContact CD2-CD1 4.44Å; G440-L442 PolarHBondContact O-N 2.84Å; G440-L442 VanDerWaalsContact O-N 3.12Å; L442-Q444 PolarHBondContact O-N 3.35Å
443	M	75	Confident	69.5	Low	87 Å²	87	100.4 Å²	100.4	43%	0.429	59%	0.588	S	S	.	*			trans	-83.3	71.7	171.9	-141.7	-161	92.1	0	0	108.9	A435 P438 G440	A435-M443 PolarHBondContact O-N 3.18Å; P438-M443 VanDerWaalsContact CA-SD 3.57Å; P438-M443 HydrophobicContact CB-CE 4.22Å; P438-M443 HydrophobicContact CB-SD 4.24Å; P438-M443 HydrophobicContact CG-SD 4.19Å; G440-M443 PolarHBondContact O-N 2.91Å; G440-M443 VanDerWaalsContact O-N 3.1Å
444	Q	65.8	Low	68.3	Low	145 Å²	145	100.5 Å²	100.5	68%	0.678	59%	0.587	S	S	*	*			trans	-54.2	142.1	165.3	-70.4	-146.2	-0.7	0	0	108.2	L442 V446	L442-Q444 PolarHBondContact O-N 3.35Å; Q444-V446 HydrophobicContact CB-CG2 4.16Å; Q444-V446 WeakPolarHBondContact O-CG2 3.42Å; Q444-V446 PolarHBondContact O-N 3.44Å
445	P	62.9	Low	67.5	Low	120 Å²	120	98.7 Å²	98.7	78%	0.779	57%	0.57	S	S	*	*			trans	-66.9	78.2	174.1	27.1	-32.2	0	0	0	109.2	G447	P445-G447 PolarHBondContact O-N 3.12Å
446	V	55.6	Low	67.3	Low	139 Å²	139	100.5 Å²	100.5	84%	0.842	58%	0.58	S	S	*	*			trans	-79.3	32.2	171.3	-166.7	0	0	0	0	109.7	Q444	Q444-V446 HydrophobicContact CB-CG2 4.16Å; Q444-V446 WeakPolarHBondContact O-CG2 3.42Å; Q444-V446 PolarHBondContact O-N 3.44Å
447	G	55.2	Low	67	Low	49 Å²	49	100.1 Å²	100.1	51%	0.505	58%	0.583	S	S	.	*			trans	-118.8	74	171.5	0	0	0	0	0	107.8	P445 Q449	P445-G447 PolarHBondContact O-N 3.12Å; G447-Q449 PolarHBondContact O-N 2.86Å
448	Q	52.9	Low	66.9	Low	175 Å²	175	103.9 Å²	103.9	82%	0.818	60%	0.599	S	S	*	*			trans	-60.8	85.7	140.5	-84.8	-179.3	-28.6	0	0	105.2	S450	Q448-S450 PolarHBondContact O-N 3.33Å
449	Q	53	Low	67.1	Low	150 Å²	150	98.4 Å²	98.4	70%	0.701	56%	0.563	S	S	*	*			trans	-46.2	130.9	167.8	-67.5	177.7	-16.1	0	0	106.5	G447 I451	G447-Q449 PolarHBondContact O-N 2.86Å; Q449-I451 VanDerWaalsContact C-N 3.29Å; Q449-I451 PolarHBondContact O-N 3.46Å
450	S	53.6	Low	67.4	Low	66 Å²	66	99.2 Å²	99.2	46%	0.462	55%	0.546	S	S	.	.			trans	-27.9	82.8	179.8	-37.8	0	0	0	0	113.2	Q448 N452 Q453	Q448-S450 PolarHBondContact O-N 3.33Å; S450-N452 PolarHBondContact O-N 3.48Å; S450-Q453 PolarHBondContact O-N 3.39Å
451	I	55	Low	67.6	Low	63 Å²	63	99.8 Å²	99.8	32%	0.323	55%	0.552	S	S	.	*	H	α-helix	trans	-55	-31.2	176.1	-84	167.7	0	0	0	109.3	Q449 Q453 M454 V455 T521	Q449-I451 VanDerWaalsContact C-N 3.29Å; Q449-I451 PolarHBondContact O-N 3.46Å; I451-Q453 PolarHBondContact O-N 3.01Å; I451-Q453 VanDerWaalsContact O-N 3.15Å; I451-M454 PolarHBondContact O-N 3.27Å; I451-M454 VanDerWaalsContact O-N 3.11Å; I451-V455 HydrophobicContact CG2-CG2 4.14Å; I451-V455 PolarHBondContact O-N 3.49Å; I451-T521 HydrophobicContact CD1-CG2 4.18Å; I451-T521 HydrophobicContact CG1-CG2 4.5Å
452	N	54.3	Low	67.8	Low	127 Å²	127	96.7 Å²	96.7	68%	0.679	53%	0.528	S	S	*	.	H	α-helix	trans	-58.6	-19.6	174	-68.3	-19.9	0	0	0	115	S450	S450-N452 PolarHBondContact O-N 3.48Å
453	Q	56.4	Low	68.2	Low	169 Å²	169	92 Å²	92	79%	0.79	50%	0.504	S	S	*	.	H	α-helix	trans	-101.2	-13	176.9	-67.8	-177.6	-5.5	0	0	113.3	S450 I451	S450-Q453 PolarHBondContact O-N 3.39Å; I451-Q453 PolarHBondContact O-N 3.01Å; I451-Q453 VanDerWaalsContact O-N 3.15Å
454	M	61.6	Low	68.8	Low	112 Å²	112	94 Å²	94	55%	0.552	51%	0.51	S	S	*	.	H	α-helix	trans	-97	-19.3	-179.1	-62.7	-175.7	83.3	0	0	113.2	I451	I451-M454 PolarHBondContact O-N 3.27Å; I451-M454 VanDerWaalsContact O-N 3.11Å
455	V	69.3	Low	69.9	Low	18 Å²	18	90.1 Å²	90.1	11%	0.109	49%	0.492	C	S	.	.	S	Bend	trans	-102.6	126	-178	-175.1	0	0	0	0	110	I451 I459 L519 L523	I451-V455 HydrophobicContact CG2-CG2 4.14Å; I451-V455 PolarHBondContact O-N 3.49Å; V455-I459 HydrophobicContact CG1-CB 3.89Å; V455-I459 HydrophobicContact CG1-CG2 3.81Å; V455-L519 HydrophobicContact CB-CD2 4.43Å; V455-L519 HydrophobicContact CG1-CD2 4.24Å; V455-L519 HydrophobicContact CG2-CD2 3.9Å; V455-L523 HydrophobicContact CG1-CD1 4.2Å; V455-L523 HydrophobicContact CG2-CD1 4.13Å; V455-L523 HydrophobicContact CG2-CD2 4.09Å
456	P	80.8	Confident	71.1	Confident	59 Å²	59	84.9 Å²	84.9	38%	0.383	46%	0.457	S	S	.	.			trans	-55.9	141.3	173.6	-24.8	33.7	0	0	0	112.1	D458 I459 Q460	P456-D458 PolarHBondContact O-N 3.19Å; P456-D458 VanDerWaalsContact O-N 3.11Å; P456-I459 HydrophobicContact CB-CG1 4.26Å; P456-I459 HydrophobicContact CG-CG1 4.36Å; P456-I459 PolarHBondContact O-N 3.21Å; P456-Q460 PolarHBondContact O-N 2.86Å; P456-Q460 VanDerWaalsContact O-N 3.09Å
457	T	79.5	Confident	72.7	Confident	106 Å²	106	81.7 Å²	81.7	65%	0.65	43%	0.431	S	S	*	.	H	α-helix	trans	-56	-30.8	179.6	47.3	0	0	0	0	112.9	Q460 G461	T457-Q460 PolarHBondContact O-N 2.66Å; T457-G461 PolarHBondContact O-N 2.97Å
458	D	81.9	Confident	74.3	Confident	126 Å²	126	82 Å²	82	67%	0.674	42%	0.42	S	S	*	.	H	α-helix	trans	-67.4	-41.7	177.8	-60.4	-18.7	0	0	0	112.1	P456 Q460 G461 E462	P456-D458 PolarHBondContact O-N 3.19Å; P456-D458 VanDerWaalsContact O-N 3.11Å; D458-Q460 VanDerWaalsContact C-N 3.34Å; D458-G461 PolarHBondContact O-N 3.4Å; D458-E462 WeakPolarHBondContact O-CB 3.44Å; D458-E462 PolarHBondContact O-N 3.42Å
459	I	82.8	Confident	76	Confident	3 Å²	3	73.7 Å²	73.7	2%	0.015	38%	0.381	C	S	.	.	H	α-helix	trans	-69.7	-36.7	176.9	-60.9	-61.5	0	0	0	110.2	V455 P456 E462 L463 F510 K513 V514 L523	V455-I459 HydrophobicContact CG1-CB 3.89Å; V455-I459 HydrophobicContact CG1-CG2 3.81Å; P456-I459 HydrophobicContact CB-CG1 4.26Å; P456-I459 HydrophobicContact CG-CG1 4.36Å; P456-I459 PolarHBondContact O-N 3.21Å; I459-E462 PolarHBondContact O-N 3.05Å; I459-L463 VanDerWaalsContact O-CB 3.22Å; I459-L463 WeakPolarHBondContact O-CB 3.34Å; I459-L463 PolarHBondContact O-N 3.5Å; I459-F510 HydrophobicContact CG2-CE2 4.1Å; I459-F510 HydrophobicContact CG2-CZ 3.79Å; I459-K513 HydrophobicContact CD1-CD 4.32Å; I459-V514 HydrophobicContact CG2-CG2 4.36Å; I459-L523 HydrophobicContact CG2-CD1 4.33Å
460	Q	82.1	Confident	77.7	Confident	96 Å²	96	66.6 Å²	66.6	45%	0.449	35%	0.348	S	S	.	.	H	α-helix	trans	-64.7	-42	173.9	-171.7	-177.6	2.3	0	0	111.9	P456 T457 D458 L463 K464	P456-Q460 PolarHBondContact O-N 2.86Å; P456-Q460 VanDerWaalsContact O-N 3.09Å; T457-Q460 PolarHBondContact O-N 2.66Å; D458-Q460 VanDerWaalsContact C-N 3.34Å; Q460-L463 PolarHBondContact O-N 3.33Å; Q460-K464 WeakPolarHBondContact O-CB 3.48Å; Q460-K464 PolarHBondContact O-N 3Å
461	G	84.1	Confident	79.4	Confident	28 Å²	28	64.9 Å²	64.9	29%	0.289	34%	0.341	S	S	.	.	H	α-helix	trans	-62.3	-46.3	175.4	0	0	0	0	0	112.1	T457 D458 K464 H465	T457-G461 PolarHBondContact O-N 2.97Å; D458-G461 PolarHBondContact O-N 3.4Å; G461-K464 WeakPolarHBondContact O-CB 3.17Å; G461-K464 PolarHBondContact O-N 3.45Å; G461-H465 PolarHBondContact O-N 2.99Å; G461-H465 PolarHBondContact O-ND1 2.95Å; G461-H465 VanDerWaalsContact O-ND1 3.08Å
462	E	84.6	Confident	81	Confident	69 Å²	69	63.2 Å²	63.2	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-63.7	-41.7	176.2	-169.7	170.2	-168.8	0	0	112	D458 I459 K464 H465 L466 F510 K513	D458-E462 WeakPolarHBondContact O-CB 3.44Å; D458-E462 PolarHBondContact O-N 3.42Å; I459-E462 PolarHBondContact O-N 3.05Å; E462-K464 VanDerWaalsContact C-N 3.35Å; E462-K464 PolarHBondContact O-N 3.25Å; E462-H465 PolarHBondContact O-N 3.38Å; E462-L466 WeakPolarHBondContact O-CG 3.09Å; E462-L466 PolarHBondContact O-N 3.27Å; E462-F510 HydrophobicContact CB-CD2 4.41Å; E462-F510 HydrophobicContact CB-CE2 3.93Å; E462-F510 HydrophobicContact CG-CD2 3.72Å; E462-F510 HydrophobicContact CG-CE2 3.76Å; E462-K513 IonicContact OE1-NZ 3.85Å; E462-K513 IonicContact OE2-NZ 3.61Å; E462-K513 PolarHBondContact OE2-NZ 2.7Å
463	L	86.9	Confident	82.6	Confident	25 Å²	25	57.3 Å²	57.3	13%	0.131	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-43.1	174.2	-175.1	60.5	0	0	0	111.5	I459 Q460 H465 L466 Y467 F510 L527	I459-L463 VanDerWaalsContact O-CB 3.22Å; I459-L463 WeakPolarHBondContact O-CB 3.34Å; I459-L463 PolarHBondContact O-N 3.5Å; Q460-L463 PolarHBondContact O-N 3.33Å; L463-H465 VanDerWaalsContact C-N 3.34Å; L463-H465 PolarHBondContact O-N 3.31Å; L463-L466 WeakPolarHBondContact O-CB 3.31Å; L463-L466 PolarHBondContact O-N 3.28Å; L463-Y467 HydrophobicContact CD1-CD2 3.89Å; L463-Y467 HydrophobicContact CD1-CE2 3.55Å; L463-Y467 HydrophobicContact CD2-CE2 4.17Å; L463-Y467 HydrophobicContact CG-CD2 3.82Å; L463-Y467 HydrophobicContact CG-CE2 3.66Å; L463-Y467 VanDerWaalsContact O-CD2 3.24Å; L463-Y467 WeakPolarHBondContact O-CD2 3.44Å; L463-Y467 PolarHBondContact O-N 3.46Å; L463-F510 HydrophobicContact CB-CZ 4.06Å; L463-F510 HydrophobicContact CD1-CE1 3.98Å; L463-F510 HydrophobicContact CD1-CZ 4.26Å; L463-L527 HydrophobicContact CD1-CD1 4.12Å
464	K	87.6	Confident	84.2	Confident	130 Å²	130	49.5 Å²	49.5	57%	0.565	26%	0.264	S	S	*	.	H	α-helix	trans	-58.8	-45.2	175.6	-174.3	-177.6	178.7	-175.8	0	111.3	Q460 G461 E462 Y467 I468	Q460-K464 WeakPolarHBondContact O-CB 3.48Å; Q460-K464 PolarHBondContact O-N 3Å; G461-K464 WeakPolarHBondContact O-CB 3.17Å; G461-K464 PolarHBondContact O-N 3.45Å; E462-K464 VanDerWaalsContact C-N 3.35Å; E462-K464 PolarHBondContact O-N 3.25Å; K464-Y467 PolarHBondContact O-N 3.23Å; K464-I468 HydrophobicContact CG-CD1 4.1Å; K464-I468 VanDerWaalsContact O-CG1 3.31Å; K464-I468 WeakPolarHBondContact O-CG1 3.21Å; K464-I468 PolarHBondContact O-N 3.19Å
465	H	87.3	Confident	85.5	Confident	62 Å²	62	50.4 Å²	50.4	29%	0.287	26%	0.261	S	S	.	.	H	α-helix	trans	-64	-40.6	176.8	-60.6	137.8	0	0	0	112.1	Q126 G461 E462 L463 Y467 I468 A469	Q126-H465 HydrophobicContact CG-CB 4.35Å; G461-H465 PolarHBondContact O-N 2.99Å; G461-H465 PolarHBondContact O-ND1 2.95Å; G461-H465 VanDerWaalsContact O-ND1 3.08Å; E462-H465 PolarHBondContact O-N 3.38Å; L463-H465 VanDerWaalsContact C-N 3.34Å; L463-H465 PolarHBondContact O-N 3.31Å; H465-Y467 VanDerWaalsContact C-N 3.33Å; H465-Y467 PolarHBondContact O-N 3.31Å; H465-I468 PolarHBondContact O-N 3.23Å; H465-A469 WeakPolarHBondContact O-CB 3.46Å; H465-A469 PolarHBondContact O-N 3.29Å
466	L	88.3	Confident	86.2	Confident	11 Å²	11	50.5 Å²	50.5	6%	0.058	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-42.5	173.6	-73.8	169.6	0	0	0	112.2	E462 L463 A469 A470 F502 K506 F510 L527	E462-L466 WeakPolarHBondContact O-CG 3.09Å; E462-L466 PolarHBondContact O-N 3.27Å; L463-L466 WeakPolarHBondContact O-CB 3.31Å; L463-L466 PolarHBondContact O-N 3.28Å; L466-A469 PolarHBondContact O-N 3.5Å; L466-A470 WeakPolarHBondContact O-CB 3.4Å; L466-A470 PolarHBondContact O-N 2.83Å; L466-F502 HydrophobicContact CD2-CZ 3.95Å; L466-K506 HydrophobicContact CD2-CB 3.8Å; L466-F510 HydrophobicContact CD1-CB 3.75Å; L466-F510 HydrophobicContact CD1-CD1 3.54Å; L466-F510 HydrophobicContact CD1-CD2 3.71Å; L466-F510 HydrophobicContact CD1-CE1 4.01Å; L466-F510 HydrophobicContact CD1-CE2 4.16Å; L466-F510 HydrophobicContact CD1-CG 3.37Å; L466-F510 HydrophobicContact CD1-CZ 4.29Å; L466-L527 HydrophobicContact CB-CD1 4.33Å
467	Y	89.9	Confident	86.7	Confident	72 Å²	72	47.7 Å²	47.7	28%	0.282	24%	0.242	S	C	.	.	H	α-helix	trans	-64.9	-41.7	176.5	-90.3	-74.3	0	0	0	113	L463 K464 H465 G471 H526 L527 M530	L463-Y467 HydrophobicContact CD1-CD2 3.89Å; L463-Y467 HydrophobicContact CD1-CE2 3.55Å; L463-Y467 HydrophobicContact CD2-CE2 4.17Å; L463-Y467 HydrophobicContact CG-CD2 3.82Å; L463-Y467 HydrophobicContact CG-CE2 3.66Å; L463-Y467 VanDerWaalsContact O-CD2 3.24Å; L463-Y467 WeakPolarHBondContact O-CD2 3.44Å; L463-Y467 PolarHBondContact O-N 3.46Å; K464-Y467 PolarHBondContact O-N 3.23Å; H465-Y467 VanDerWaalsContact C-N 3.33Å; H465-Y467 PolarHBondContact O-N 3.31Å; Y467-G471 WeakPolarHBondContact O-CA 3.3Å; Y467-G471 PolarHBondContact O-N 3.16Å; Y467-H526 AromaticContact CE1-CE1 3.97Å; Y467-H526 AromaticContact CE1-ND1 3.41Å; Y467-H526 WeakPolarHBondContact CE1-ND1 3.38Å; Y467-H526 AromaticContact CZ-ND1 3.68Å; Y467-H526 PolarHBondContact OH-ND1 3.17Å; Y467-H526 VanDerWaalsContact OH-ND1 3.08Å; Y467-L527 HydrophobicContact CD1-CD1 4.48Å; Y467-L527 HydrophobicContact CD1-CD2 3.46Å; Y467-L527 VanDerWaalsContact CD1-CD2 3.46Å; Y467-L527 HydrophobicContact CD1-CG 3.99Å; Y467-L527 HydrophobicContact CD2-CD1 4.21Å; Y467-L527 HydrophobicContact CD2-CG 4.48Å; Y467-L527 HydrophobicContact CE1-CD1 4.26Å; Y467-L527 HydrophobicContact CE1-CD2 3.39Å; Y467-L527 HydrophobicContact CE1-CG 3.5Å; Y467-L527 HydrophobicContact CE2-CD1 3.99Å; Y467-L527 HydrophobicContact CE2-CG 4.06Å; Y467-L527 HydrophobicContact CG-CD1 4.44Å; Y467-L527 HydrophobicContact CG-CD2 4.08Å; Y467-L527 HydrophobicContact CG-CG 4.44Å; Y467-M530 HydrophobicContact CE1-SD 4.37Å
468	I	89.3	Confident	87.2	Confident	56 Å²	56	47.6 Å²	47.6	29%	0.287	23%	0.23	S	C	.	.	H	α-helix	trans	-65.2	-44.4	178.1	-64.6	166.8	0	0	0	109.8	V123 L127 K464 H465 G471 E472	V123-I468 HydrophobicContact CG1-CD1 3.76Å; L127-I468 HydrophobicContact CD1-CG2 4.18Å; L127-I468 HydrophobicContact CD2-CG2 4.41Å; K464-I468 HydrophobicContact CG-CD1 4.1Å; K464-I468 VanDerWaalsContact O-CG1 3.31Å; K464-I468 WeakPolarHBondContact O-CG1 3.21Å; K464-I468 PolarHBondContact O-N 3.19Å; H465-I468 PolarHBondContact O-N 3.23Å; I468-G471 PolarHBondContact O-N 2.95Å; I468-E472 PolarHBondContact O-N 2.7Å
469	A	87.6	Confident	87.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.5	-47.2	178	0	0	0	0	0	112.9	L127 D130 L131 H465 L466 G471 E472 L473 F502	L127-A469 VanDerWaalsContact CD1-CA 3.47Å; L127-A469 HydrophobicContact CD1-CB 3.86Å; D130-A469 HydrophobicContact CB-CB 4.48Å; L131-A469 HydrophobicContact CD2-CB 3.96Å; L131-A469 HydrophobicContact CG-CB 4.28Å; H465-A469 WeakPolarHBondContact O-CB 3.46Å; H465-A469 PolarHBondContact O-N 3.29Å; L466-A469 PolarHBondContact O-N 3.5Å; A469-G471 VanDerWaalsContact C-N 3.32Å; A469-G471 PolarHBondContact O-N 3Å; A469-E472 PolarHBondContact O-N 3.46Å; A469-L473 WeakPolarHBondContact O-CG 3.47Å; A469-L473 PolarHBondContact O-N 2.88Å; A469-F502 HydrophobicContact CB-CE2 3.59Å; A469-F502 HydrophobicContact CB-CZ 3.77Å
470	A	89.6	Confident	87.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-41.3	174.8	0	0	0	0	0	111.7	L466 E472 L473 L474 F502 L527 F531	L466-A470 WeakPolarHBondContact O-CB 3.4Å; L466-A470 PolarHBondContact O-N 2.83Å; A470-E472 PolarHBondContact O-N 3.02Å; A470-L473 PolarHBondContact O-N 2.96Å; A470-L474 VanDerWaalsContact O-CB 3.32Å; A470-L474 WeakPolarHBondContact O-CB 3.43Å; A470-L474 VanDerWaalsContact O-CG 3.23Å; A470-L474 WeakPolarHBondContact O-CG 3.26Å; A470-L474 PolarHBondContact O-N 3.11Å; A470-F502 HydrophobicContact CB-CE1 3.9Å; A470-F502 HydrophobicContact CB-CZ 4.34Å; A470-L527 HydrophobicContact CB-CD2 3.78Å; A470-F531 HydrophobicContact CB-CE1 4.31Å; A470-F531 HydrophobicContact CB-CE2 4.37Å; A470-F531 HydrophobicContact CB-CZ 3.6Å
471	G	89.1	Confident	87.7	Confident	30 Å²	30	42.8 Å²	42.8	31%	0.309	21%	0.212	S	C	.	.	H	α-helix	trans	-60.7	-43.2	178.5	0	0	0	0	0	112.5	Y467 I468 A469 L474 R475	Y467-G471 WeakPolarHBondContact O-CA 3.3Å; Y467-G471 PolarHBondContact O-N 3.16Å; I468-G471 PolarHBondContact O-N 2.95Å; A469-G471 VanDerWaalsContact C-N 3.32Å; A469-G471 PolarHBondContact O-N 3Å; G471-L474 PolarHBondContact O-N 2.79Å; G471-R475 WeakPolarHBondContact O-CB 3.29Å; G471-R475 PolarHBondContact O-N 3.13Å
472	E	87.3	Confident	87.6	Confident	27 Å²	27	46.6 Å²	46.6	13%	0.126	23%	0.232	C	C	.	.	H	α-helix	trans	-68	-41.9	177.7	-170.3	67.3	168.4	0	0	111.7	L127 I468 A469 A470 L474 R475 H476	L127-E472 HydrophobicContact CD2-CG 4.49Å; I468-E472 PolarHBondContact O-N 2.7Å; A469-E472 PolarHBondContact O-N 3.46Å; A470-E472 PolarHBondContact O-N 3.02Å; E472-L474 PolarHBondContact O-N 3.03Å; E472-R475 PolarHBondContact O-N 2.68Å; E472-R475 IonicContact OE1-NH1 3.39Å; E472-R475 PolarHBondContact OE1-NH1 3.04Å; E472-R475 IonicContact OE2-NH1 3.97Å; E472-R475 PolarHBondContact OE2-NH1 2.96Å; E472-H476 PolarHBondContact O-CD2 3.27Å; E472-H476 PolarHBondContact O-N 3.17Å; E472-H476 IonicContact OE1-CE1 3.89Å; E472-H476 IonicContact OE1-NE2 2.76Å; E472-H476 PolarHBondContact OE1-NE2 3.2Å
473	L	88.8	Confident	87.6	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-44.6	174.6	-66.8	175.7	0	0	0	111.9	L131 V136 I137 A469 A470 H476 F477 M495 L499 F502	L131-L473 HydrophobicContact CD2-CD1 3.93Å; L131-L473 HydrophobicContact CD2-CD2 4.27Å; L131-L473 HydrophobicContact CD2-CG 4.05Å; V136-L473 HydrophobicContact CG1-CD1 4.14Å; I137-L473 HydrophobicContact CG2-CD2 4.09Å; A469-L473 WeakPolarHBondContact O-CG 3.47Å; A469-L473 PolarHBondContact O-N 2.88Å; A470-L473 PolarHBondContact O-N 2.96Å; L473-H476 PolarHBondContact O-N 3.32Å; L473-F477 WeakPolarHBondContact O-CB 3.42Å; L473-F477 PolarHBondContact O-N 2.97Å; L473-M495 HydrophobicContact CD2-SD 4.25Å; L473-L499 HydrophobicContact CB-CD2 3.64Å; L473-L499 HydrophobicContact CD1-CD2 4.41Å; L473-F502 HydrophobicContact CD1-CB 3.64Å; L473-F502 HydrophobicContact CD1-CD1 4.33Å; L473-F502 HydrophobicContact CD1-CD2 3.79Å; L473-F502 HydrophobicContact CD1-CG 3.65Å
474	L	90.1	Very high	87.4	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-67.5	-40.1	177.8	-72	170.9	0	0	0	111.5	A470 G471 E472 H476 F477 W478 L499 M530 F531 A534	A470-L474 VanDerWaalsContact O-CB 3.32Å; A470-L474 WeakPolarHBondContact O-CB 3.43Å; A470-L474 VanDerWaalsContact O-CG 3.23Å; A470-L474 WeakPolarHBondContact O-CG 3.26Å; A470-L474 PolarHBondContact O-N 3.11Å; G471-L474 PolarHBondContact O-N 2.79Å; E472-L474 PolarHBondContact O-N 3.03Å; L474-H476 VanDerWaalsContact C-N 3.31Å; L474-H476 PolarHBondContact O-N 3.04Å; L474-F477 WeakPolarHBondContact O-CB 3.45Å; L474-F477 PolarHBondContact O-N 3.48Å; L474-W478 PolarHBondContact O-N 2.84Å; L474-L499 HydrophobicContact CD2-CD1 4.31Å; L474-L499 HydrophobicContact CD2-CD2 3.97Å; L474-L499 HydrophobicContact CG-CD2 4.22Å; L474-M530 HydrophobicContact CD1-CB 3.81Å; L474-M530 HydrophobicContact CD1-CE 3.59Å; L474-M530 HydrophobicContact CD1-SD 4.37Å; L474-F531 HydrophobicContact CD2-CD1 4.28Å; L474-F531 HydrophobicContact CG-CE1 4.43Å; L474-A534 HydrophobicContact CD2-CB 3.75Å
475	R	89.4	Confident	87.2	Confident	132 Å²	132	45.8 Å²	45.8	50%	0.498	24%	0.239	S	C	.	.	H	α-helix	trans	-56.4	-47.2	174.1	177.2	178.8	170.7	-120.5	0	110.5	G471 E472 W478 S479	G471-R475 WeakPolarHBondContact O-CB 3.29Å; G471-R475 PolarHBondContact O-N 3.13Å; E472-R475 PolarHBondContact O-N 2.68Å; E472-R475 IonicContact OE1-NH1 3.39Å; E472-R475 PolarHBondContact OE1-NH1 3.04Å; E472-R475 IonicContact OE2-NH1 3.97Å; E472-R475 PolarHBondContact OE2-NH1 2.96Å; R475-W478 PolarHBondContact O-N 3.3Å; R475-S479 VanDerWaalsContact O-CB 3.29Å; R475-S479 WeakPolarHBondContact O-CB 3.33Å; R475-S479 PolarHBondContact O-N 3.42Å; R475-S479 PolarHBondContact O-OG 3.41Å
476	H	84.1	Confident	87	Confident	20 Å²	20	48 Å²	48	9%	0.093	26%	0.259	C	S	.	.	H	α-helix	trans	-66.7	-39.5	176.4	-67.9	-49.3	0	0	0	112.8	E472 L473 L474 S479 C480 M495	E472-H476 PolarHBondContact O-CD2 3.27Å; E472-H476 PolarHBondContact O-N 3.17Å; E472-H476 IonicContact OE1-CE1 3.89Å; E472-H476 IonicContact OE1-NE2 2.76Å; E472-H476 PolarHBondContact OE1-NE2 3.2Å; L473-H476 PolarHBondContact O-N 3.32Å; L474-H476 VanDerWaalsContact C-N 3.31Å; L474-H476 PolarHBondContact O-N 3.04Å; H476-S479 PolarHBondContact O-N 3Å; H476-C480 PolarHBondContact O-N 3.43Å; H476-C480 PolarHBondContact O-SG 3.47Å; H476-M495 HydrophobicContact CB-CE 3.49Å; H476-M495 VanDerWaalsContact CB-CE 3.49Å; H476-M495 HydrophobicContact CB-SD 4.19Å
477	F	89.5	Confident	86.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.2	-52.2	174.1	178	-94.5	0	0	0	111.6	L473 L474 S479 C480 F481 V492 M495 L499 A534 F538	L473-F477 WeakPolarHBondContact O-CB 3.42Å; L473-F477 PolarHBondContact O-N 2.97Å; L474-F477 WeakPolarHBondContact O-CB 3.45Å; L474-F477 PolarHBondContact O-N 3.48Å; F477-S479 PolarHBondContact O-N 3.24Å; F477-C480 WeakPolarHBondContact O-CB 3.21Å; F477-C480 PolarHBondContact O-N 2.92Å; F477-F481 HydrophobicContact CD1-CE2 4.16Å; F477-F481 HydrophobicContact CE1-CD2 4.32Å; F477-F481 AromaticContact CE1-CE2 3.63Å; F477-F481 HydrophobicContact CE1-CE2 3.63Å; F477-F481 HydrophobicContact CE1-CZ 4.42Å; F477-F481 HydrophobicContact CE2-CE2 4.03Å; F477-F481 AromaticContact CZ-CE2 3.55Å; F477-F481 HydrophobicContact CZ-CE2 3.55Å; F477-F481 HydrophobicContact CZ-CZ 4.02Å; F477-F481 VanDerWaalsContact O-CD2 3.31Å; F477-F481 WeakPolarHBondContact O-CD2 3.33Å; F477-V492 HydrophobicContact CE2-CG1 4.2Å; F477-M495 HydrophobicContact CB-CG 3.63Å; F477-M495 HydrophobicContact CD2-CB 4.24Å; F477-M495 HydrophobicContact CD2-CG 4Å; F477-M495 HydrophobicContact CG-CG 4.33Å; F477-L499 HydrophobicContact CB-CD1 4.23Å; F477-L499 HydrophobicContact CD2-CD1 3.84Å; F477-L499 HydrophobicContact CE2-CD1 4.42Å; F477-L499 HydrophobicContact CG-CD1 4.03Å; F477-A534 HydrophobicContact CD1-CB 3.91Å; F477-A534 HydrophobicContact CE1-CB 3.66Å; F477-A534 HydrophobicContact CZ-CB 4.12Å; F477-A534 VanDerWaalsContact CZ-O 3.24Å; F477-A534 WeakPolarHBondContact CZ-O 3.33Å; F477-F538 HydrophobicContact CE2-CB 4.29Å; F477-F538 HydrophobicContact CE2-CD2 4.44Å; F477-F538 HydrophobicContact CZ-CB 4.03Å
478	W	90.3	Very high	86.4	Confident	104 Å²	104	52.1 Å²	52.1	39%	0.394	28%	0.279	S	S	.	.	H	α-helix	trans	-69.6	-32.4	-179	-67.2	117.3	0	0	0	113	L474 R475 C480 F481 A534 K537	L474-W478 PolarHBondContact O-N 2.84Å; R475-W478 PolarHBondContact O-N 3.3Å; W478-C480 PolarHBondContact O-N 3.38Å; W478-F481 HydrophobicContact CE3-CD2 4.44Å; W478-F481 PolarHBondContact O-N 2.87Å; W478-A534 HydrophobicContact CZ2-CB 4.24Å; W478-K537 HydrophobicContact CH2-CB 3.72Å; W478-K537 HydrophobicContact CH2-CG 3.95Å; W478-K537 HydrophobicContact CZ3-CB 3.96Å; W478-K537 HydrophobicContact CZ3-CD 4.18Å; W478-K537 HydrophobicContact CZ3-CG 3.62Å
479	S	86.7	Confident	86.1	Confident	83 Å²	83	52.2 Å²	52.2	58%	0.58	28%	0.278	S	S	*	.	H	α-helix	trans	-63.7	-19.9	174.5	-60	0	0	0	0	113	R475 H476 F477 F481	R475-S479 VanDerWaalsContact O-CB 3.29Å; R475-S479 WeakPolarHBondContact O-CB 3.33Å; R475-S479 PolarHBondContact O-N 3.42Å; R475-S479 PolarHBondContact O-OG 3.41Å; H476-S479 PolarHBondContact O-N 3Å; F477-S479 PolarHBondContact O-N 3.24Å; S479-F481 VanDerWaalsContact C-N 3.26Å
480	C	84.9	Confident	86	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.014	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-8.2	174.5	-59	0	0	0	0	113.3	H476 F477 W478 P482 V483 L488 V492	H476-C480 PolarHBondContact O-N 3.43Å; H476-C480 PolarHBondContact O-SG 3.47Å; F477-C480 WeakPolarHBondContact O-CB 3.21Å; F477-C480 PolarHBondContact O-N 2.92Å; W478-C480 PolarHBondContact O-N 3.38Å; C480-P482 CarbonylContact O-C 3.43Å; C480-V483 WeakPolarHBondContact O-CG2 3.35Å; C480-V483 PolarHBondContact O-N 3.06Å; C480-L488 HydrophobicContact CB-CD2 4.09Å; C480-V492 HydrophobicContact CB-CG2 3.23Å
481	F	85.7	Confident	85.8	Confident	39 Å²	39	59.7 Å²	59.7	17%	0.171	31%	0.313	C	S	.	.			trans	-101.7	133.6	174.7	-68.8	-88.7	0	0	0	110.2	F477 W478 S479 V483 V492 K537 W541	F477-F481 HydrophobicContact CD1-CE2 4.16Å; F477-F481 HydrophobicContact CE1-CD2 4.32Å; F477-F481 AromaticContact CE1-CE2 3.63Å; F477-F481 HydrophobicContact CE1-CE2 3.63Å; F477-F481 HydrophobicContact CE1-CZ 4.42Å; F477-F481 HydrophobicContact CE2-CE2 4.03Å; F477-F481 AromaticContact CZ-CE2 3.55Å; F477-F481 HydrophobicContact CZ-CE2 3.55Å; F477-F481 HydrophobicContact CZ-CZ 4.02Å; F477-F481 VanDerWaalsContact O-CD2 3.31Å; F477-F481 WeakPolarHBondContact O-CD2 3.33Å; W478-F481 HydrophobicContact CE3-CD2 4.44Å; W478-F481 PolarHBondContact O-N 2.87Å; S479-F481 VanDerWaalsContact C-N 3.26Å; F481-V483 HydrophobicContact CD1-CG2 3.68Å; F481-V483 HydrophobicContact CE1-CG2 3.68Å; F481-V483 HydrophobicContact CG-CG2 4.3Å; F481-V483 HydrophobicContact CZ-CG2 4.3Å; F481-V492 HydrophobicContact CE2-CG1 4.02Å; F481-V492 HydrophobicContact CE2-CG2 4.23Å; F481-V492 HydrophobicContact CZ-CG1 3.8Å; F481-V492 HydrophobicContact CZ-CG2 4.4Å; F481-K537 HydrophobicContact CE1-CG 4.2Å; F481-K537 HydrophobicContact CZ-CG 4.18Å; F481-W541 HydrophobicContact CE1-CB 4.08Å; F481-W541 HydrophobicContact CE1-CG 4.09Å
482	P	83.4	Confident	85.8	Confident	107 Å²	107	58.3 Å²	58.3	70%	0.695	30%	0.298	S	S	*	.	S	Bend	cis	-74.9	135.4	3.5	30.2	-34.4	0	0	0	113.3	C480 N484	C480-P482 CarbonylContact O-C 3.43Å; P482-N484 PolarHBondContact O-N 3.16Å
483	V	83.5	Confident	85.8	Confident	27 Å²	27	59.9 Å²	59.9	16%	0.164	31%	0.31	C	S	.	.			trans	-75.2	90	-179.9	-165.6	0	0	0	0	109.2	C480 F481 L488 E489 V492 W541	C480-V483 WeakPolarHBondContact O-CG2 3.35Å; C480-V483 PolarHBondContact O-N 3.06Å; F481-V483 HydrophobicContact CD1-CG2 3.68Å; F481-V483 HydrophobicContact CE1-CG2 3.68Å; F481-V483 HydrophobicContact CG-CG2 4.3Å; F481-V483 HydrophobicContact CZ-CG2 4.3Å; V483-L488 HydrophobicContact CG1-CB 3.95Å; V483-E489 HydrophobicContact CG1-CB 4.21Å; V483-E489 HydrophobicContact CG1-CG 3.55Å; V483-V492 HydrophobicContact CG2-CG2 3.91Å; V483-W541 HydrophobicContact CG1-CZ2 4.09Å
484	N	82.7	Confident	85.7	Confident	124 Å²	124	64.4 Å²	64.4	66%	0.663	33%	0.329	S	S	*	.			trans	-103.8	-11.2	-175.3	62.6	2	0	0	0	113.9	P482 L488	P482-N484 PolarHBondContact O-N 3.16Å; N484-L488 VanDerWaalsContact OD1-CD1 3.3Å; N484-L488 WeakPolarHBondContact OD1-CD1 3Å
485	T	84.6	Confident	85.6	Confident	56 Å²	56	64.5 Å²	64.5	34%	0.344	33%	0.329	S	S	.	.	S	Bend	trans	-129.4	150.1	-176.4	53.7	0	0	0	0	111.5	F487 L488 E489	T485-F487 PolarHBondContact O-N 3.37Å; T485-L488 PolarHBondContact O-N 3.12Å; T485-L488 WeakPolarHBondContact OG1-CD1 3.36Å; T485-L488 WeakPolarHBondContact OG1-CG 3.48Å; T485-E489 PolarHBondContact O-N 3.31Å
486	P	81.6	Confident	85.6	Confident	109 Å²	109	60.6 Å²	60.6	71%	0.708	32%	0.316	S	S	*	.	H	α-helix	trans	-61.3	-31.2	178.8	24.5	-34.3	0	0	0	112.6	E489 E490	P486-E489 WeakPolarHBondContact O-CB 3.48Å; P486-E489 PolarHBondContact O-N 2.99Å; P486-E490 PolarHBondContact O-N 3.4Å
487	F	82.6	Confident	85.9	Confident	139 Å²	139	62.7 Å²	62.7	61%	0.61	33%	0.33	S	S	*	.	H	α-helix	trans	-60.8	-44.3	172.8	174.4	-100.8	0	0	0	112.2	T485 E489 E490 K491	T485-F487 PolarHBondContact O-N 3.37Å; F487-E489 VanDerWaalsContact C-N 3.3Å; F487-E489 PolarHBondContact O-N 3.4Å; F487-E490 PolarHBondContact O-N 2.91Å; F487-K491 HydrophobicContact CE1-CD 4.14Å; F487-K491 HydrophobicContact CZ-CD 4.45Å; F487-K491 WeakPolarHBondContact O-CB 3.36Å; F487-K491 PolarHBondContact O-N 2.91Å
488	L	82.7	Confident	85.8	Confident	31 Å²	31	63.4 Å²	63.4	16%	0.162	33%	0.334	C	S	.	.	H	α-helix	trans	-67.2	-31.5	177	-70.3	175.2	0	0	0	111.8	C480 V483 N484 T485 K491 V492	C480-L488 HydrophobicContact CB-CD2 4.09Å; V483-L488 HydrophobicContact CG1-CB 3.95Å; N484-L488 VanDerWaalsContact OD1-CD1 3.3Å; N484-L488 WeakPolarHBondContact OD1-CD1 3Å; T485-L488 PolarHBondContact O-N 3.12Å; T485-L488 WeakPolarHBondContact OG1-CD1 3.36Å; T485-L488 WeakPolarHBondContact OG1-CG 3.48Å; L488-K491 PolarHBondContact O-N 3.24Å; L488-V492 WeakPolarHBondContact O-CB 3.48Å; L488-V492 WeakPolarHBondContact O-CG2 3.33Å; L488-V492 PolarHBondContact O-N 3.19Å
489	E	83.8	Confident	85.8	Confident	57 Å²	57	58.4 Å²	58.4	27%	0.266	32%	0.315	S	S	.	.	H	α-helix	trans	-61.5	-45.9	175.1	-58.6	-166.9	160.9	0	0	112.2	V483 T485 P486 F487 T493 W541 R545	V483-E489 HydrophobicContact CG1-CB 4.21Å; V483-E489 HydrophobicContact CG1-CG 3.55Å; T485-E489 PolarHBondContact O-N 3.31Å; P486-E489 WeakPolarHBondContact O-CB 3.48Å; P486-E489 PolarHBondContact O-N 2.99Å; F487-E489 VanDerWaalsContact C-N 3.3Å; F487-E489 PolarHBondContact O-N 3.4Å; E489-T493 PolarHBondContact O-N 3.43Å; E489-T493 PolarHBondContact O-OG1 2.91Å; E489-W541 HydrophobicContact CB-CH2 4.33Å; E489-W541 HydrophobicContact CB-CZ2 4.23Å; E489-W541 HydrophobicContact CG-CZ2 4.05Å; E489-R545 IonicContact OE1-NE 2.59Å; E489-R545 IonicContact OE2-CZ 3.19Å; E489-R545 VanDerWaalsContact OE2-CZ 3.22Å; E489-R545 IonicContact OE2-NE 2.75Å; E489-R545 PolarHBondContact OE2-NE 3.37Å; E489-R545 IonicContact OE2-NH2 3.01Å; E489-R545 PolarHBondContact OE2-NH2 3.22Å
490	E	85.6	Confident	86	Confident	106 Å²	106	58 Å²	58	50%	0.495	30%	0.304	S	S	.	.	H	α-helix	trans	-65.2	-43.3	176.4	-167.7	-173.8	159	0	0	110.5	P486 F487 V492 T493 K494	P486-E490 PolarHBondContact O-N 3.4Å; F487-E490 PolarHBondContact O-N 2.91Å; E490-V492 PolarHBondContact O-N 2.95Å; E490-T493 PolarHBondContact O-N 3.3Å; E490-K494 WeakPolarHBondContact O-CG 3.42Å; E490-K494 PolarHBondContact O-N 3.28Å; E490-K494 WeakPolarHBondContact OE1-CE 3.2Å; E490-K494 IonicContact OE1-NZ 2.77Å; E490-K494 PolarHBondContact OE1-NZ 3.32Å
491	K	85.9	Confident	86.2	Confident	53 Å²	53	63.4 Å²	63.4	23%	0.23	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-42.9	179.7	-168.9	172.5	-178.8	168.6	0	112.7	N145 F487 L488 T493 K494 M495	N145-K491 WeakPolarHBondContact OD1-CE 3.49Å; N145-K491 PolarHBondContact OD1-NZ 2.83Å; F487-K491 HydrophobicContact CE1-CD 4.14Å; F487-K491 HydrophobicContact CZ-CD 4.45Å; F487-K491 WeakPolarHBondContact O-CB 3.36Å; F487-K491 PolarHBondContact O-N 2.91Å; L488-K491 PolarHBondContact O-N 3.24Å; K491-T493 VanDerWaalsContact C-N 3.32Å; K491-T493 PolarHBondContact O-N 3.28Å; K491-K494 PolarHBondContact O-N 3.26Å; K491-M495 WeakPolarHBondContact O-CB 3.24Å; K491-M495 PolarHBondContact O-N 3.21Å
492	V	88	Confident	86.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-41.2	177.1	173.5	0	0	0	0	111	F477 C480 F481 V483 L488 E490 M495 K496 F538	F477-V492 HydrophobicContact CE2-CG1 4.2Å; C480-V492 HydrophobicContact CB-CG2 3.23Å; F481-V492 HydrophobicContact CE2-CG1 4.02Å; F481-V492 HydrophobicContact CE2-CG2 4.23Å; F481-V492 HydrophobicContact CZ-CG1 3.8Å; F481-V492 HydrophobicContact CZ-CG2 4.4Å; V483-V492 HydrophobicContact CG2-CG2 3.91Å; L488-V492 WeakPolarHBondContact O-CB 3.48Å; L488-V492 WeakPolarHBondContact O-CG2 3.33Å; L488-V492 PolarHBondContact O-N 3.19Å; E490-V492 PolarHBondContact O-N 2.95Å; V492-M495 PolarHBondContact O-N 2.67Å; V492-K496 PolarHBondContact O-N 3.48Å; V492-F538 HydrophobicContact CG1-CD2 3.51Å; V492-F538 HydrophobicContact CG1-CE2 3.7Å
493	T	88.1	Confident	86.6	Confident	61 Å²	61	58.4 Å²	58.4	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-64.5	-46.4	178.9	-52.7	0	0	0	0	111	E489 E490 K491 M495 K496 T497	E489-T493 PolarHBondContact O-N 3.43Å; E489-T493 PolarHBondContact O-OG1 2.91Å; E490-T493 PolarHBondContact O-N 3.3Å; K491-T493 VanDerWaalsContact C-N 3.32Å; K491-T493 PolarHBondContact O-N 3.28Å; T493-M495 VanDerWaalsContact C-N 3.34Å; T493-M495 PolarHBondContact O-N 3.43Å; T493-K496 PolarHBondContact O-N 2.8Å; T493-T497 PolarHBondContact O-N 3.11Å; T493-T497 PolarHBondContact O-OG1 3.34Å
494	K	87.5	Confident	86.7	Confident	98 Å²	98	60.6 Å²	60.6	43%	0.426	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-43.3	173.9	-70.9	179.5	-177.8	172	0	111.8	E490 K491 K496 T497 N498	E490-K494 WeakPolarHBondContact O-CG 3.42Å; E490-K494 PolarHBondContact O-N 3.28Å; E490-K494 WeakPolarHBondContact OE1-CE 3.2Å; E490-K494 IonicContact OE1-NZ 2.77Å; E490-K494 PolarHBondContact OE1-NZ 3.32Å; K491-K494 PolarHBondContact O-N 3.26Å; K494-K496 VanDerWaalsContact C-N 3.33Å; K494-K496 PolarHBondContact O-N 3.26Å; K494-T497 WeakPolarHBondContact O-CB 3.27Å; K494-T497 PolarHBondContact O-N 3.12Å; K494-T497 VanDerWaalsContact O-N 3.15Å; K494-N498 VanDerWaalsContact O-CG 3.32Å; K494-N498 PolarHBondContact O-N 3.45Å; K494-N498 PolarHBondContact O-OD1 3.01Å
495	M	87.9	Confident	86.9	Confident	6 Å²	6	57.5 Å²	57.5	3%	0.03	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-37.8	-179.4	-166.7	60.7	59.9	0	0	112.4	L473 H476 F477 K491 V492 T493 T497 N498 L499	L473-M495 HydrophobicContact CD2-SD 4.25Å; H476-M495 HydrophobicContact CB-CE 3.49Å; H476-M495 VanDerWaalsContact CB-CE 3.49Å; H476-M495 HydrophobicContact CB-SD 4.19Å; F477-M495 HydrophobicContact CB-CG 3.63Å; F477-M495 HydrophobicContact CD2-CB 4.24Å; F477-M495 HydrophobicContact CD2-CG 4Å; F477-M495 HydrophobicContact CG-CG 4.33Å; K491-M495 WeakPolarHBondContact O-CB 3.24Å; K491-M495 PolarHBondContact O-N 3.21Å; V492-M495 PolarHBondContact O-N 2.67Å; T493-M495 VanDerWaalsContact C-N 3.34Å; T493-M495 PolarHBondContact O-N 3.43Å; M495-T497 VanDerWaalsContact C-N 3.34Å; M495-T497 PolarHBondContact O-N 2.85Å; M495-N498 PolarHBondContact O-N 2.99Å; M495-N498 HydrophobicContact SD-CB 4.48Å; M495-L499 WeakPolarHBondContact O-CG 3.46Å; M495-L499 PolarHBondContact O-N 3.47Å
496	K	89.5	Confident	86.9	Confident	50 Å²	50	57.2 Å²	57.2	22%	0.217	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-44.6	173.2	-179.7	-93	-177.9	-174.8	0	111.5	V492 T493 K494 N498 L499 E500 Y535 F538	V492-K496 PolarHBondContact O-N 3.48Å; T493-K496 PolarHBondContact O-N 2.8Å; K494-K496 VanDerWaalsContact C-N 3.33Å; K494-K496 PolarHBondContact O-N 3.26Å; K496-N498 VanDerWaalsContact C-N 3.32Å; K496-N498 PolarHBondContact O-N 3.41Å; K496-L499 PolarHBondContact O-N 3.25Å; K496-E500 WeakPolarHBondContact CE-OE1 3.4Å; K496-E500 WeakPolarHBondContact CE-OE2 3.46Å; K496-E500 IonicContact NZ-OE1 2.7Å; K496-E500 PolarHBondContact NZ-OE1 3.26Å; K496-E500 IonicContact NZ-OE2 3.22Å; K496-E500 PolarHBondContact NZ-OE2 2.88Å; K496-E500 WeakPolarHBondContact O-CG 3.4Å; K496-E500 PolarHBondContact O-N 3.03Å; K496-Y535 HydrophobicContact CG-CD1 4.26Å; K496-Y535 HydrophobicContact CG-CE1 4.31Å; K496-F538 HydrophobicContact CB-CD2 4.24Å; K496-F538 HydrophobicContact CB-CE2 4.26Å; K496-F538 HydrophobicContact CB-CG 4.41Å; K496-F538 HydrophobicContact CB-CZ 4.43Å; K496-F538 HydrophobicContact CD-CE1 4.33Å; K496-F538 HydrophobicContact CG-CD1 4Å; K496-F538 HydrophobicContact CG-CD2 4.49Å; K496-F538 HydrophobicContact CG-CE1 4.16Å; K496-F538 HydrophobicContact CG-CG 4.17Å; K496-F538 HydrophobicContact CG-CZ 4.46Å
497	T	89.9	Confident	87.1	Confident	64 Å²	64	52 Å²	52	39%	0.393	25%	0.248	S	C	.	.	H	α-helix	trans	-63.1	-38.6	175.4	-55.2	0	0	0	0	111.9	T493 K494 M495 E500 R501	T493-T497 PolarHBondContact O-N 3.11Å; T493-T497 PolarHBondContact O-OG1 3.34Å; K494-T497 WeakPolarHBondContact O-CB 3.27Å; K494-T497 PolarHBondContact O-N 3.12Å; K494-T497 VanDerWaalsContact O-N 3.15Å; M495-T497 VanDerWaalsContact C-N 3.34Å; M495-T497 PolarHBondContact O-N 2.85Å; T497-E500 PolarHBondContact O-N 3.47Å; T497-R501 WeakPolarHBondContact O-CB 3.29Å; T497-R501 PolarHBondContact O-N 3.29Å
498	N	88.1	Confident	87.3	Confident	15 Å²	15	51.6 Å²	51.6	8%	0.08	24%	0.242	C	C	.	.	H	α-helix	trans	-66.4	-40.1	176.9	-65.9	-6.9	0	0	0	111.8	I137 K494 M495 K496 R501 F502	I137-N498 HydrophobicContact CG2-CB 4.13Å; I137-N498 WeakPolarHBondContact CG2-ND2 3.46Å; K494-N498 VanDerWaalsContact O-CG 3.32Å; K494-N498 PolarHBondContact O-N 3.45Å; K494-N498 PolarHBondContact O-OD1 3.01Å; M495-N498 PolarHBondContact O-N 2.99Å; M495-N498 HydrophobicContact SD-CB 4.48Å; K496-N498 VanDerWaalsContact C-N 3.32Å; K496-N498 PolarHBondContact O-N 3.41Å; N498-R501 PolarHBondContact O-N 3.35Å; N498-F502 WeakPolarHBondContact O-CB 3.45Å; N498-F502 PolarHBondContact O-N 3.1Å
499	L	89.9	Confident	87.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-45	173.9	-69.3	169.8	0	0	0	111.4	L473 L474 F477 M495 K496 F502 Q503 F531 A534 Y535	L473-L499 HydrophobicContact CB-CD2 3.64Å; L473-L499 HydrophobicContact CD1-CD2 4.41Å; L474-L499 HydrophobicContact CD2-CD1 4.31Å; L474-L499 HydrophobicContact CD2-CD2 3.97Å; L474-L499 HydrophobicContact CG-CD2 4.22Å; F477-L499 HydrophobicContact CB-CD1 4.23Å; F477-L499 HydrophobicContact CD2-CD1 3.84Å; F477-L499 HydrophobicContact CE2-CD1 4.42Å; F477-L499 HydrophobicContact CG-CD1 4.03Å; M495-L499 WeakPolarHBondContact O-CG 3.46Å; M495-L499 PolarHBondContact O-N 3.47Å; K496-L499 PolarHBondContact O-N 3.25Å; L499-F502 PolarHBondContact O-N 3.39Å; L499-Q503 PolarHBondContact O-N 3.44Å; L499-F531 HydrophobicContact CB-CD1 4.5Å; L499-F531 HydrophobicContact CD2-CD1 3.91Å; L499-F531 HydrophobicContact CD2-CE1 3.62Å; L499-A534 HydrophobicContact CD1-CB 4.25Å; L499-Y535 VanDerWaalsContact C-OH 3.31Å; L499-Y535 HydrophobicContact CB-CE1 4.08Å; L499-Y535 PolarHBondContact O-OH 2.69Å
500	E	89.8	Confident	87.5	Confident	73 Å²	73	50.6 Å²	50.6	34%	0.341	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-45.2	175.1	-71.4	178	145.4	0	0	111.6	K496 T497 F502 Q503 M504 Y535	K496-E500 WeakPolarHBondContact CE-OE1 3.4Å; K496-E500 WeakPolarHBondContact CE-OE2 3.46Å; K496-E500 IonicContact NZ-OE1 2.7Å; K496-E500 PolarHBondContact NZ-OE1 3.26Å; K496-E500 IonicContact NZ-OE2 3.22Å; K496-E500 PolarHBondContact NZ-OE2 2.88Å; K496-E500 WeakPolarHBondContact O-CG 3.4Å; K496-E500 PolarHBondContact O-N 3.03Å; T497-E500 PolarHBondContact O-N 3.47Å; E500-F502 VanDerWaalsContact C-N 3.33Å; E500-F502 PolarHBondContact O-N 3.12Å; E500-Q503 PolarHBondContact O-N 3.01Å; E500-M504 WeakPolarHBondContact O-CG 3.38Å; E500-M504 PolarHBondContact O-N 2.75Å; E500-Y535 WeakPolarHBondContact CA-OH 3.4Å; E500-Y535 HydrophobicContact CG-CE1 3.9Å; E500-Y535 WeakPolarHBondContact CG-OH 3.4Å; E500-Y535 PolarHBondContact N-OH 3.48Å
501	R	89.3	Confident	87.4	Confident	116 Å²	116	47 Å²	47	44%	0.438	23%	0.225	S	C	.	.	H	α-helix	trans	-61.9	-41.2	177.5	-167.3	-178.4	-68.2	168.2	3	111.6	Q135 T497 N498 M504 T505	Q135-R501 WeakPolarHBondContact O-CD 3.18Å; Q135-R501 PolarHBondContact O-NH1 3.47Å; T497-R501 WeakPolarHBondContact O-CB 3.29Å; T497-R501 PolarHBondContact O-N 3.29Å; N498-R501 PolarHBondContact O-N 3.35Å; R501-M504 PolarHBondContact O-N 2.89Å; R501-T505 VanDerWaalsContact O-CB 3.25Å; R501-T505 WeakPolarHBondContact O-CB 3.37Å; R501-T505 PolarHBondContact O-N 2.59Å; R501-T505 PolarHBondContact O-OG1 3.4Å
502	F	89.8	Confident	87.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-45.7	175.1	-176.4	-97.6	0	0	0	111.6	L131 V136 L466 A469 A470 L473 N498 L499 E500 M504 T505 K506 L507 F531	L131-F502 HydrophobicContact CD2-CD2 4.04Å; L131-F502 HydrophobicContact CD2-CE2 4.15Å; V136-F502 HydrophobicContact CG1-CB 3.74Å; V136-F502 HydrophobicContact CG1-CD2 4.21Å; V136-F502 HydrophobicContact CG1-CG 4.48Å; V136-F502 HydrophobicContact CG2-CB 4.45Å; V136-F502 HydrophobicContact CG2-CD2 4.16Å; L466-F502 HydrophobicContact CD2-CZ 3.95Å; A469-F502 HydrophobicContact CB-CE2 3.59Å; A469-F502 HydrophobicContact CB-CZ 3.77Å; A470-F502 HydrophobicContact CB-CE1 3.9Å; A470-F502 HydrophobicContact CB-CZ 4.34Å; L473-F502 HydrophobicContact CD1-CB 3.64Å; L473-F502 HydrophobicContact CD1-CD1 4.33Å; L473-F502 HydrophobicContact CD1-CD2 3.79Å; L473-F502 HydrophobicContact CD1-CG 3.65Å; N498-F502 WeakPolarHBondContact O-CB 3.45Å; N498-F502 PolarHBondContact O-N 3.1Å; L499-F502 PolarHBondContact O-N 3.39Å; E500-F502 VanDerWaalsContact C-N 3.33Å; E500-F502 PolarHBondContact O-N 3.12Å; F502-M504 VanDerWaalsContact C-N 3.32Å; F502-M504 PolarHBondContact O-N 3.05Å; F502-T505 PolarHBondContact O-N 2.87Å; F502-K506 HydrophobicContact CD2-CB 4.26Å; F502-K506 HydrophobicContact CD2-CG 4.3Å; F502-K506 HydrophobicContact CE2-CB 3.96Å; F502-K506 HydrophobicContact CE2-CG 4.04Å; F502-K506 HydrophobicContact CZ-CB 4.14Å; F502-K506 PolarHBondContact O-N 3.11Å; F502-L507 PolarHBondContact O-N 3.44Å; F502-F531 HydrophobicContact CD1-CE1 4.28Å; F502-F531 HydrophobicContact CD1-CE2 4.35Å; F502-F531 AromaticContact CD1-CZ 3.58Å; F502-F531 HydrophobicContact CD1-CZ 3.58Å; F502-F531 HydrophobicContact CE1-CE2 4.42Å; F502-F531 AromaticContact CE1-CZ 3.8Å; F502-F531 HydrophobicContact CE1-CZ 3.8Å
503	Q	87.3	Confident	87.1	Confident	42 Å²	42	53.2 Å²	53.2	20%	0.196	25%	0.254	C	S	.	.	I	π-helix	trans	-59.7	-42.6	178.5	-164.9	-178.3	7.3	0	0	111.6	L499 E500 L507 R508 Y535	L499-Q503 PolarHBondContact O-N 3.44Å; E500-Q503 PolarHBondContact O-N 3.01Å; Q503-L507 HydrophobicContact CG-CB 4.28Å; Q503-L507 HydrophobicContact CG-CD2 3.88Å; Q503-L507 WeakPolarHBondContact O-CB 3.43Å; Q503-L507 PolarHBondContact O-N 2.97Å; Q503-R508 PolarHBondContact O-N 3.49Å; Q503-Y535 PolarHBondContact OE1-OH 3.32Å
504	M	87.1	Confident	86.8	Confident	72 Å²	72	50.9 Å²	50.9	36%	0.355	24%	0.239	S	C	.	.	I	π-helix	trans	-71	-40.6	178.6	-60.3	-54	94	0	0	112.9	E500 R501 F502 R508 P509	E500-M504 WeakPolarHBondContact O-CG 3.38Å; E500-M504 PolarHBondContact O-N 2.75Å; R501-M504 PolarHBondContact O-N 2.89Å; F502-M504 VanDerWaalsContact C-N 3.32Å; F502-M504 PolarHBondContact O-N 3.05Å; M504-R508 VanDerWaalsContact CE-NE 3.27Å; M504-R508 PolarHBondContact SD-NE 2.94Å; M504-R508 PolarHBondContact SD-NH1 3.31Å; M504-R508 PolarHBondContact SD-NH2 3.47Å; M504-P509 WeakPolarHBondContact O-CD 3.34Å
505	T	86.6	Confident	86.4	Confident	60 Å²	60	53 Å²	53	37%	0.368	25%	0.251	S	S	.	.	I	π-helix	trans	-86.8	-29.3	-168.1	-49.3	0	0	0	0	112.8	R501 F502 P509	R501-T505 VanDerWaalsContact O-CB 3.25Å; R501-T505 WeakPolarHBondContact O-CB 3.37Å; R501-T505 PolarHBondContact O-N 2.59Å; R501-T505 PolarHBondContact O-OG1 3.4Å; F502-T505 PolarHBondContact O-N 2.87Å; T505-P509 WeakPolarHBondContact O-CG 3.41Å
506	K	85	Confident	85.9	Confident	50 Å²	50	61.6 Å²	61.6	22%	0.217	28%	0.283	C	S	.	.	I	π-helix	trans	-122	-47.9	-172.7	-75.5	-69.4	-165.6	169.3	0	113	D130 S134 L466 F502 F510	D130-K506 IonicContact OD1-NZ 3.63Å; D130-K506 PolarHBondContact OD1-NZ 3.43Å; S134-K506 WeakPolarHBondContact OG-CE 3.04Å; S134-K506 PolarHBondContact OG-NZ 3.05Å; L466-K506 HydrophobicContact CD2-CB 3.8Å; F502-K506 HydrophobicContact CD2-CB 4.26Å; F502-K506 HydrophobicContact CD2-CG 4.3Å; F502-K506 HydrophobicContact CE2-CB 3.96Å; F502-K506 HydrophobicContact CE2-CG 4.04Å; F502-K506 HydrophobicContact CZ-CB 4.14Å; F502-K506 PolarHBondContact O-N 3.11Å; K506-F510 WeakPolarHBondContact O-CB 3.28Å; K506-F510 PolarHBondContact O-N 2.88Å
507	L	85.4	Confident	85.2	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	29%	0.291	C	S	.	.	I	π-helix	trans	-70.4	-47	-175.1	-167.8	67.7	0	0	0	112.2	F502 Q503 F510 Q511 T524 L527 E528 F531	F502-L507 PolarHBondContact O-N 3.44Å; Q503-L507 HydrophobicContact CG-CB 4.28Å; Q503-L507 HydrophobicContact CG-CD2 3.88Å; Q503-L507 WeakPolarHBondContact O-CB 3.43Å; Q503-L507 PolarHBondContact O-N 2.97Å; L507-F510 PolarHBondContact O-N 3.3Å; L507-Q511 WeakPolarHBondContact O-CG 3.4Å; L507-Q511 PolarHBondContact O-N 3.01Å; L507-T524 HydrophobicContact CD1-CG2 4.22Å; L507-L527 HydrophobicContact CD1-CB 4.35Å; L507-L527 HydrophobicContact CD1-CD1 3.99Å; L507-E528 HydrophobicContact CD2-CG 4.11Å; L507-F531 HydrophobicContact CD2-CD2 4.11Å; L507-F531 HydrophobicContact CD2-CE2 4Å
508	R	85.8	Confident	83.8	Confident	130 Å²	130	70.6 Å²	70.6	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-48.2	178.9	-75.4	-173.3	-178.7	177	3.9	113.6	Q503 M504 F510 Q511 E512	Q503-R508 PolarHBondContact O-N 3.49Å; M504-R508 VanDerWaalsContact CE-NE 3.27Å; M504-R508 PolarHBondContact SD-NE 2.94Å; M504-R508 PolarHBondContact SD-NH1 3.31Å; M504-R508 PolarHBondContact SD-NH2 3.47Å; R508-F510 VanDerWaalsContact C-N 3.26Å; R508-F510 PolarHBondContact O-N 3.14Å; R508-Q511 WeakPolarHBondContact O-CB 3.47Å; R508-Q511 PolarHBondContact O-N 3.36Å; R508-Q511 VanDerWaalsContact O-N 3.11Å; R508-E512 PolarHBondContact O-N 3.44Å
509	P	86.1	Confident	82.8	Confident	64 Å²	64	71.8 Å²	71.8	42%	0.416	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-35	176.3	-27	37.2	0	0	0	113.2	M504 T505 E512 K513	M504-P509 WeakPolarHBondContact O-CD 3.34Å; T505-P509 WeakPolarHBondContact O-CG 3.41Å; P509-E512 PolarHBondContact O-N 3.5Å; P509-K513 WeakPolarHBondContact O-CB 3.5Å; P509-K513 PolarHBondContact O-N 3.18Å
510	F	85.8	Confident	81.1	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.009	36%	0.36	C	S	.	.	H	α-helix	trans	-66.4	-41.8	174.2	-178.9	-102.1	0	0	0	111.8	I459 E462 L463 L466 K506 L507 R508 E512 K513 V514 T524	I459-F510 HydrophobicContact CG2-CE2 4.1Å; I459-F510 HydrophobicContact CG2-CZ 3.79Å; E462-F510 HydrophobicContact CB-CD2 4.41Å; E462-F510 HydrophobicContact CB-CE2 3.93Å; E462-F510 HydrophobicContact CG-CD2 3.72Å; E462-F510 HydrophobicContact CG-CE2 3.76Å; L463-F510 HydrophobicContact CB-CZ 4.06Å; L463-F510 HydrophobicContact CD1-CE1 3.98Å; L463-F510 HydrophobicContact CD1-CZ 4.26Å; L466-F510 HydrophobicContact CD1-CB 3.75Å; L466-F510 HydrophobicContact CD1-CD1 3.54Å; L466-F510 HydrophobicContact CD1-CD2 3.71Å; L466-F510 HydrophobicContact CD1-CE1 4.01Å; L466-F510 HydrophobicContact CD1-CE2 4.16Å; L466-F510 HydrophobicContact CD1-CG 3.37Å; L466-F510 HydrophobicContact CD1-CZ 4.29Å; K506-F510 WeakPolarHBondContact O-CB 3.28Å; K506-F510 PolarHBondContact O-N 2.88Å; L507-F510 PolarHBondContact O-N 3.3Å; R508-F510 VanDerWaalsContact C-N 3.26Å; R508-F510 PolarHBondContact O-N 3.14Å; F510-E512 PolarHBondContact O-N 3.22Å; F510-K513 WeakPolarHBondContact O-CB 3.41Å; F510-K513 PolarHBondContact O-N 3.5Å; F510-V514 HydrophobicContact CD1-CG2 4.13Å; F510-V514 HydrophobicContact CE1-CG2 3.73Å; F510-V514 HydrophobicContact CE2-CG2 4.28Å; F510-V514 HydrophobicContact CZ-CG2 3.82Å; F510-V514 WeakPolarHBondContact O-CG2 3.41Å; F510-V514 PolarHBondContact O-N 2.71Å; F510-T524 HydrophobicContact CD1-CG2 3.71Å; F510-T524 HydrophobicContact CE1-CG2 3.78Å
511	Q	83.8	Confident	79.9	Confident	32 Å²	32	76.1 Å²	76.1	15%	0.15	36%	0.356	C	S	.	.	H	α-helix	trans	-60.8	-44.6	174.6	-72.8	173.3	-25.6	0	0	112.1	L507 R508 K513 V514 Q515 T524 E528	L507-Q511 WeakPolarHBondContact O-CG 3.4Å; L507-Q511 PolarHBondContact O-N 3.01Å; R508-Q511 WeakPolarHBondContact O-CB 3.47Å; R508-Q511 PolarHBondContact O-N 3.36Å; R508-Q511 VanDerWaalsContact O-N 3.11Å; Q511-K513 VanDerWaalsContact C-N 3.28Å; Q511-K513 PolarHBondContact O-N 2.9Å; Q511-V514 PolarHBondContact O-N 3.21Å; Q511-Q515 WeakPolarHBondContact O-CB 3.28Å; Q511-Q515 VanDerWaalsContact O-CG 3.29Å; Q511-Q515 WeakPolarHBondContact O-CG 3.29Å; Q511-Q515 PolarHBondContact O-N 3.35Å; Q511-T524 HydrophobicContact CG-CG2 3.91Å; Q511-T524 PolarHBondContact NE2-OG1 2.88Å; Q511-T524 VanDerWaalsContact NE2-OG1 3.13Å; Q511-E528 PolarHBondContact NE2-OE1 2.83Å
512	E	84.6	Confident	78.9	Confident	100 Å²	100	76.4 Å²	76.4	47%	0.467	37%	0.366	S	S	.	.	H	α-helix	trans	-60.2	-39.4	174.9	-70.5	178.5	-164.5	0	0	111.5	R508 P509 F510 Q515 R516	R508-E512 PolarHBondContact O-N 3.44Å; P509-E512 PolarHBondContact O-N 3.5Å; F510-E512 PolarHBondContact O-N 3.22Å; E512-Q515 PolarHBondContact O-N 3.02Å; E512-R516 VanDerWaalsContact O-CG 3.26Å; E512-R516 WeakPolarHBondContact O-CG 3.35Å; E512-R516 PolarHBondContact O-N 2.78Å; E512-R516 IonicContact OE2-NH2 3.3Å
513	K	82.6	Confident	78.2	Confident	82 Å²	82	77.6 Å²	77.6	36%	0.357	37%	0.372	S	S	.	.	H	α-helix	trans	-65	-42.5	176.2	-172.2	-178.8	177.6	-173.7	0	112.1	I459 E462 P509 F510 Q511 R516 Q517	I459-K513 HydrophobicContact CD1-CD 4.32Å; E462-K513 IonicContact OE1-NZ 3.85Å; E462-K513 IonicContact OE2-NZ 3.61Å; E462-K513 PolarHBondContact OE2-NZ 2.7Å; P509-K513 WeakPolarHBondContact O-CB 3.5Å; P509-K513 PolarHBondContact O-N 3.18Å; F510-K513 WeakPolarHBondContact O-CB 3.41Å; F510-K513 PolarHBondContact O-N 3.5Å; Q511-K513 VanDerWaalsContact C-N 3.28Å; Q511-K513 PolarHBondContact O-N 2.9Å; K513-R516 PolarHBondContact O-N 3.34Å; K513-Q517 WeakPolarHBondContact O-CG 3.38Å; K513-Q517 PolarHBondContact O-N 2.97Å
514	V	81.3	Confident	78	Confident	13 Å²	13	76.2 Å²	76.2	8%	0.079	37%	0.367	C	S	.	.	H	α-helix	trans	-66.8	-40.5	176.9	173.4	0	0	0	0	111.2	I459 F510 Q511 R516 Q517 L519 L523	I459-V514 HydrophobicContact CG2-CG2 4.36Å; F510-V514 HydrophobicContact CD1-CG2 4.13Å; F510-V514 HydrophobicContact CE1-CG2 3.73Å; F510-V514 HydrophobicContact CE2-CG2 4.28Å; F510-V514 HydrophobicContact CZ-CG2 3.82Å; F510-V514 WeakPolarHBondContact O-CG2 3.41Å; F510-V514 PolarHBondContact O-N 2.71Å; Q511-V514 PolarHBondContact O-N 3.21Å; V514-R516 PolarHBondContact O-N 2.64Å; V514-Q517 PolarHBondContact O-N 3.25Å; V514-L519 HydrophobicContact CG1-CB 3.96Å; V514-L523 HydrophobicContact CG1-CD1 4.42Å
515	Q	78.7	Confident	77.9	Confident	142 Å²	142	73.7 Å²	73.7	66%	0.664	36%	0.359	S	S	*	.	H	α-helix	trans	-63.1	-40.5	175.8	-74.2	175	3.3	0	0	112.2	Q511 E512 Q517 Y518	Q511-Q515 WeakPolarHBondContact O-CB 3.28Å; Q511-Q515 VanDerWaalsContact O-CG 3.29Å; Q511-Q515 WeakPolarHBondContact O-CG 3.29Å; Q511-Q515 PolarHBondContact O-N 3.35Å; E512-Q515 PolarHBondContact O-N 3.02Å; Q515-Q517 PolarHBondContact O-N 3.28Å; Q515-Y518 PolarHBondContact O-N 2.92Å
516	R	77.7	Confident	77.9	Confident	187 Å²	187	76 Å²	76	71%	0.706	37%	0.366	S	S	*	.	H	α-helix	trans	-64	-24	175.6	-73.9	174.5	-168.2	-175.6	7.8	113.5	E512 K513 V514 Y518	E512-R516 VanDerWaalsContact O-CG 3.26Å; E512-R516 WeakPolarHBondContact O-CG 3.35Å; E512-R516 PolarHBondContact O-N 2.78Å; E512-R516 IonicContact OE2-NH2 3.3Å; K513-R516 PolarHBondContact O-N 3.34Å; V514-R516 PolarHBondContact O-N 2.64Å; R516-Y518 VanDerWaalsContact C-N 3.34Å
517	Q	73.9	Confident	78	Confident	84 Å²	84	73.7 Å²	73.7	39%	0.393	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	6.3	179	-67.8	179.7	-4.4	0	0	113.1	K513 V514 Q515 L519	K513-Q517 WeakPolarHBondContact O-CG 3.38Å; K513-Q517 PolarHBondContact O-N 2.97Å; V514-Q517 PolarHBondContact O-N 3.25Å; Q515-Q517 PolarHBondContact O-N 3.28Å; Q517-L519 HydrophobicContact CB-CD1 4.26Å; Q517-L519 PolarHBondContact O-N 3.45Å; Q517-L519 VanDerWaalsContact O-N 3.17Å
518	Y	62	Low	78.2	Confident	219 Å²	219	77.1 Å²	77.1	86%	0.859	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	30.8	179.3	-63.5	-85.4	0	0	0	114.4	Q515 R516 S520	Q515-Y518 PolarHBondContact O-N 2.92Å; R516-Y518 VanDerWaalsContact C-N 3.34Å; Y518-S520 PolarHBondContact O-N 3.37Å
519	L	65.6	Low	78.4	Confident	40 Å²	40	74.8 Å²	74.8	21%	0.209	37%	0.369	C	S	.	.			trans	-74	110.8	171.1	-101.9	73.7	0	0	0	109.3	V455 V514 Q517 T521 L523	V455-L519 HydrophobicContact CB-CD2 4.43Å; V455-L519 HydrophobicContact CG1-CD2 4.24Å; V455-L519 HydrophobicContact CG2-CD2 3.9Å; V514-L519 HydrophobicContact CG1-CB 3.96Å; Q517-L519 HydrophobicContact CB-CD1 4.26Å; Q517-L519 PolarHBondContact O-N 3.45Å; Q517-L519 VanDerWaalsContact O-N 3.17Å; L519-T521 PolarHBondContact O-N 3.02Å; L519-L523 HydrophobicContact CD2-CD1 3.62Å
520	S	54.9	Low	78.7	Confident	120 Å²	120	74.6 Å²	74.6	84%	0.839	36%	0.363	S	S	*	.			trans	-73.4	-5.7	178.2	57.3	0	0	0	0	114	Y518	Y518-S520 PolarHBondContact O-N 3.37Å
521	T	65.3	Low	78.9	Confident	43 Å²	43	74.5 Å²	74.5	26%	0.264	36%	0.363	S	S	.	.	S	Bend	trans	-86	127.7	-177.6	-50.5	0	0	0	0	110.2	I451 L519 L523	I451-T521 HydrophobicContact CD1-CG2 4.18Å; I451-T521 HydrophobicContact CG1-CG2 4.5Å; L519-T521 PolarHBondContact O-N 3.02Å; T521-L523 VanDerWaalsContact C-N 3.27Å; T521-L523 HydrophobicContact CG2-CD2 3.9Å; T521-L523 HydrophobicContact CG2-CG 4.45Å; T521-L523 PolarHBondContact O-N 3.16Å
522	N	68.9	Low	79.3	Confident	122 Å²	122	78.6 Å²	78.6	65%	0.652	38%	0.382	S	S	*	.			trans	-71.2	81.3	174.5	-169.7	-12.8	0	0	0	110.9	G525	N522-G525 WeakPolarHBondContact OD1-CA 3.39Å; N522-G525 PolarHBondContact OD1-N 3.35Å
523	L	75.1	Confident	79.7	Confident	25 Å²	25	79.7 Å²	79.7	13%	0.131	39%	0.385	C	S	.	.	S	Bend	trans	-75.5	-25.5	-177.9	-65.6	179.6	0	0	0	113.4	V455 I459 V514 L519 T521	V455-L523 HydrophobicContact CG1-CD1 4.2Å; V455-L523 HydrophobicContact CG2-CD1 4.13Å; V455-L523 HydrophobicContact CG2-CD2 4.09Å; I459-L523 HydrophobicContact CG2-CD1 4.33Å; V514-L523 HydrophobicContact CG1-CD1 4.42Å; L519-L523 HydrophobicContact CD2-CD1 3.62Å; T521-L523 VanDerWaalsContact C-N 3.27Å; T521-L523 HydrophobicContact CG2-CD2 3.9Å; T521-L523 HydrophobicContact CG2-CG 4.45Å; T521-L523 PolarHBondContact O-N 3.16Å
524	T	82.1	Confident	80.1	Confident	13 Å²	13	75.8 Å²	75.8	8%	0.08	37%	0.368	C	S	.	.	S	Bend	trans	-101	-11.4	-175	57.2	0	0	0	0	114.4	L507 F510 Q511 H526 L527 E528	L507-T524 HydrophobicContact CD1-CG2 4.22Å; F510-T524 HydrophobicContact CD1-CG2 3.71Å; F510-T524 HydrophobicContact CE1-CG2 3.78Å; Q511-T524 HydrophobicContact CG-CG2 3.91Å; Q511-T524 PolarHBondContact NE2-OG1 2.88Å; Q511-T524 VanDerWaalsContact NE2-OG1 3.13Å; T524-H526 PolarHBondContact O-N 3.19Å; T524-H526 VanDerWaalsContact O-N 3.17Å; T524-L527 WeakPolarHBondContact O-CB 3.29Å; T524-L527 PolarHBondContact O-N 3.05Å; T524-E528 PolarHBondContact O-N 3.24Å
525	G	84.1	Confident	80.7	Confident	19 Å²	19	76.9 Å²	76.9	20%	0.196	37%	0.371	C	S	.	.	H	α-helix	trans	-59.8	-32	-172.5	0	0	0	0	0	113.8	N522 E528 D529	N522-G525 WeakPolarHBondContact OD1-CA 3.39Å; N522-G525 PolarHBondContact OD1-N 3.35Å; G525-E528 PolarHBondContact O-N 3.24Å; G525-D529 PolarHBondContact O-N 3.36Å
526	H	88.3	Confident	81.3	Confident	110 Å²	110	72.9 Å²	72.9	51%	0.509	36%	0.359	S	S	.	.	H	α-helix	trans	-67.4	-43.1	173.7	174.7	-104.8	0	0	0	112.5	Y467 T524 E528 D529 M530	Y467-H526 AromaticContact CE1-CE1 3.97Å; Y467-H526 AromaticContact CE1-ND1 3.41Å; Y467-H526 WeakPolarHBondContact CE1-ND1 3.38Å; Y467-H526 AromaticContact CZ-ND1 3.68Å; Y467-H526 PolarHBondContact OH-ND1 3.17Å; Y467-H526 VanDerWaalsContact OH-ND1 3.08Å; T524-H526 PolarHBondContact O-N 3.19Å; T524-H526 VanDerWaalsContact O-N 3.17Å; H526-E528 VanDerWaalsContact C-N 3.29Å; H526-E528 PolarHBondContact O-N 3.16Å; H526-D529 PolarHBondContact O-N 3.02Å; H526-M530 PolarHBondContact CE1-SD 3.03Å; H526-M530 WeakPolarHBondContact O-CG 3.4Å; H526-M530 PolarHBondContact O-N 3.17Å
527	L	86.8	Confident	82	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-60.9	-40.3	173.7	-79.8	170.2	0	0	0	111.3	L463 L466 Y467 A470 L507 T524 M530 F531	L463-L527 HydrophobicContact CD1-CD1 4.12Å; L466-L527 HydrophobicContact CB-CD1 4.33Å; Y467-L527 HydrophobicContact CD1-CD1 4.48Å; Y467-L527 HydrophobicContact CD1-CD2 3.46Å; Y467-L527 VanDerWaalsContact CD1-CD2 3.46Å; Y467-L527 HydrophobicContact CD1-CG 3.99Å; Y467-L527 HydrophobicContact CD2-CD1 4.21Å; Y467-L527 HydrophobicContact CD2-CG 4.48Å; Y467-L527 HydrophobicContact CE1-CD1 4.26Å; Y467-L527 HydrophobicContact CE1-CD2 3.39Å; Y467-L527 HydrophobicContact CE1-CG 3.5Å; Y467-L527 HydrophobicContact CE2-CD1 3.99Å; Y467-L527 HydrophobicContact CE2-CG 4.06Å; Y467-L527 HydrophobicContact CG-CD1 4.44Å; Y467-L527 HydrophobicContact CG-CD2 4.08Å; Y467-L527 HydrophobicContact CG-CG 4.44Å; A470-L527 HydrophobicContact CB-CD2 3.78Å; L507-L527 HydrophobicContact CD1-CB 4.35Å; L507-L527 HydrophobicContact CD1-CD1 3.99Å; T524-L527 WeakPolarHBondContact O-CB 3.29Å; T524-L527 PolarHBondContact O-N 3.05Å; L527-M530 HydrophobicContact CD2-SD 4.35Å; L527-M530 WeakPolarHBondContact O-CB 3.44Å; L527-M530 PolarHBondContact O-N 2.89Å; L527-F531 HydrophobicContact CB-CE2 4.36Å; L527-F531 WeakPolarHBondContact O-CD2 3.48Å; L527-F531 PolarHBondContact O-N 2.95Å
528	E	88.3	Confident	82.8	Confident	72 Å²	72	65 Å²	65	34%	0.336	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-43	176.1	-68.6	-175.6	145.9	0	0	112.3	L507 Q511 T524 G525 H526 M530 F531 Q532	L507-E528 HydrophobicContact CD2-CG 4.11Å; Q511-E528 PolarHBondContact NE2-OE1 2.83Å; T524-E528 PolarHBondContact O-N 3.24Å; G525-E528 PolarHBondContact O-N 3.24Å; H526-E528 VanDerWaalsContact C-N 3.29Å; H526-E528 PolarHBondContact O-N 3.16Å; E528-M530 VanDerWaalsContact C-N 3.34Å; E528-M530 PolarHBondContact O-N 3.29Å; E528-F531 PolarHBondContact O-N 3.23Å; E528-Q532 WeakPolarHBondContact O-CB 3.48Å; E528-Q532 PolarHBondContact O-N 3.25Å
529	D	90.9	Very high	84.2	Confident	81 Å²	81	60 Å²	60	43%	0.433	31%	0.313	S	S	.	.	H	α-helix	trans	-62.5	-42.3	175.2	-171.4	47.7	0	0	0	111	G525 H526 F531 Q532 K533	G525-D529 PolarHBondContact O-N 3.36Å; H526-D529 PolarHBondContact O-N 3.02Å; D529-F531 VanDerWaalsContact C-N 3.35Å; D529-F531 PolarHBondContact O-N 3.22Å; D529-Q532 PolarHBondContact O-N 3.14Å; D529-Q532 VanDerWaalsContact O-N 3.16Å; D529-K533 VanDerWaalsContact O-CG 3.27Å; D529-K533 WeakPolarHBondContact O-CG 3.47Å; D529-K533 PolarHBondContact O-N 2.9Å; D529-K533 WeakPolarHBondContact OD1-CE 3.38Å
530	M	91.4	Very high	85.4	Confident	60 Å²	60	61.6 Å²	61.6	30%	0.296	32%	0.321	S	S	.	.	H	α-helix	trans	-56.9	-45.8	175.2	-68.6	179.4	81.6	0	0	112.3	Y467 L474 H526 L527 E528 A534	Y467-M530 HydrophobicContact CE1-SD 4.37Å; L474-M530 HydrophobicContact CD1-CB 3.81Å; L474-M530 HydrophobicContact CD1-CE 3.59Å; L474-M530 HydrophobicContact CD1-SD 4.37Å; H526-M530 PolarHBondContact CE1-SD 3.03Å; H526-M530 WeakPolarHBondContact O-CG 3.4Å; H526-M530 PolarHBondContact O-N 3.17Å; L527-M530 HydrophobicContact CD2-SD 4.35Å; L527-M530 WeakPolarHBondContact O-CB 3.44Å; L527-M530 PolarHBondContact O-N 2.89Å; E528-M530 VanDerWaalsContact C-N 3.34Å; E528-M530 PolarHBondContact O-N 3.29Å; M530-A534 PolarHBondContact O-N 2.98Å
531	F	91.3	Very high	87	Confident	1 Å²	1	57.8 Å²	57.8	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-66.2	-42	175.8	-69.2	-58.2	0	0	0	111.8	A470 L474 L499 F502 L507 L527 E528 D529 K533 A534 Y535	A470-F531 HydrophobicContact CB-CE1 4.31Å; A470-F531 HydrophobicContact CB-CE2 4.37Å; A470-F531 HydrophobicContact CB-CZ 3.6Å; L474-F531 HydrophobicContact CD2-CD1 4.28Å; L474-F531 HydrophobicContact CG-CE1 4.43Å; L499-F531 HydrophobicContact CB-CD1 4.5Å; L499-F531 HydrophobicContact CD2-CD1 3.91Å; L499-F531 HydrophobicContact CD2-CE1 3.62Å; F502-F531 HydrophobicContact CD1-CE1 4.28Å; F502-F531 HydrophobicContact CD1-CE2 4.35Å; F502-F531 AromaticContact CD1-CZ 3.58Å; F502-F531 HydrophobicContact CD1-CZ 3.58Å; F502-F531 HydrophobicContact CE1-CE2 4.42Å; F502-F531 AromaticContact CE1-CZ 3.8Å; F502-F531 HydrophobicContact CE1-CZ 3.8Å; L507-F531 HydrophobicContact CD2-CD2 4.11Å; L507-F531 HydrophobicContact CD2-CE2 4Å; L527-F531 HydrophobicContact CB-CE2 4.36Å; L527-F531 WeakPolarHBondContact O-CD2 3.48Å; L527-F531 PolarHBondContact O-N 2.95Å; E528-F531 PolarHBondContact O-N 3.23Å; D529-F531 VanDerWaalsContact C-N 3.35Å; D529-F531 PolarHBondContact O-N 3.22Å; F531-K533 VanDerWaalsContact C-N 3.34Å; F531-K533 PolarHBondContact O-N 3.34Å; F531-A534 WeakPolarHBondContact O-CB 3.4Å; F531-A534 PolarHBondContact O-N 2.84Å; F531-A534 VanDerWaalsContact O-N 3.12Å; F531-Y535 HydrophobicContact CB-CD2 4.46Å; F531-Y535 HydrophobicContact CB-CE2 3.96Å; F531-Y535 WeakPolarHBondContact O-CD2 3.36Å; F531-Y535 PolarHBondContact O-N 3.45Å
532	Q	92.2	Very high	88.1	Confident	118 Å²	118	59.3 Å²	59.3	55%	0.551	29%	0.292	S	S	*	.	H	α-helix	trans	-62.9	-39	179.6	-171.5	62.3	10.7	0	0	112.2	E528 D529 Y535 S536	E528-Q532 WeakPolarHBondContact O-CB 3.48Å; E528-Q532 PolarHBondContact O-N 3.25Å; D529-Q532 PolarHBondContact O-N 3.14Å; D529-Q532 VanDerWaalsContact O-N 3.16Å; Q532-Y535 PolarHBondContact O-N 3.4Å; Q532-S536 WeakPolarHBondContact O-CB 3.44Å; Q532-S536 PolarHBondContact O-N 2.86Å
533	K	92.8	Very high	89	Confident	123 Å²	123	55.9 Å²	55.9	54%	0.535	28%	0.276	S	S	.	.	H	α-helix	trans	-63.2	-41.1	173.2	-65.3	-66.7	177.1	-175.2	0	111.8	D529 F531 S536 K537	D529-K533 VanDerWaalsContact O-CG 3.27Å; D529-K533 WeakPolarHBondContact O-CG 3.47Å; D529-K533 PolarHBondContact O-N 2.9Å; D529-K533 WeakPolarHBondContact OD1-CE 3.38Å; F531-K533 VanDerWaalsContact C-N 3.34Å; F531-K533 PolarHBondContact O-N 3.34Å; K533-S536 PolarHBondContact O-N 2.97Å; K533-K537 WeakPolarHBondContact O-CB 3.34Å; K533-K537 PolarHBondContact O-N 3.42Å
534	A	91.1	Very high	89.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.2	-46.3	175.5	0	0	0	0	0	111.5	L474 F477 W478 L499 M530 F531 K537 F538	L474-A534 HydrophobicContact CD2-CB 3.75Å; F477-A534 HydrophobicContact CD1-CB 3.91Å; F477-A534 HydrophobicContact CE1-CB 3.66Å; F477-A534 HydrophobicContact CZ-CB 4.12Å; F477-A534 VanDerWaalsContact CZ-O 3.24Å; F477-A534 WeakPolarHBondContact CZ-O 3.33Å; W478-A534 HydrophobicContact CZ2-CB 4.24Å; L499-A534 HydrophobicContact CD1-CB 4.25Å; M530-A534 PolarHBondContact O-N 2.98Å; F531-A534 WeakPolarHBondContact O-CB 3.4Å; F531-A534 PolarHBondContact O-N 2.84Å; F531-A534 VanDerWaalsContact O-N 3.12Å; A534-K537 PolarHBondContact O-N 3.08Å; A534-F538 PolarHBondContact O-N 3.48Å
535	Y	92.8	Very high	89.5	Confident	35 Å²	35	65.8 Å²	65.8	14%	0.137	31%	0.31	C	S	.	.	H	α-helix	trans	-63.5	-42.1	176.7	-62.7	-40.8	0	0	0	112.8	K496 L499 E500 Q503 F531 Q532 K537 F538 H539	K496-Y535 HydrophobicContact CG-CD1 4.26Å; K496-Y535 HydrophobicContact CG-CE1 4.31Å; L499-Y535 VanDerWaalsContact C-OH 3.31Å; L499-Y535 HydrophobicContact CB-CE1 4.08Å; L499-Y535 PolarHBondContact O-OH 2.69Å; E500-Y535 WeakPolarHBondContact CA-OH 3.4Å; E500-Y535 HydrophobicContact CG-CE1 3.9Å; E500-Y535 WeakPolarHBondContact CG-OH 3.4Å; E500-Y535 PolarHBondContact N-OH 3.48Å; Q503-Y535 PolarHBondContact OE1-OH 3.32Å; F531-Y535 HydrophobicContact CB-CD2 4.46Å; F531-Y535 HydrophobicContact CB-CE2 3.96Å; F531-Y535 WeakPolarHBondContact O-CD2 3.36Å; F531-Y535 PolarHBondContact O-N 3.45Å; Q532-Y535 PolarHBondContact O-N 3.4Å; Y535-K537 PolarHBondContact O-N 2.88Å; Y535-F538 PolarHBondContact O-N 3.43Å; Y535-H539 WeakPolarHBondContact O-CB 3.34Å; Y535-H539 PolarHBondContact O-N 3.44Å
536	S	92.8	Very high	89.2	Confident	59 Å²	59	70.6 Å²	70.6	41%	0.413	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-44.5	174.9	177.8	0	0	0	0	111.5	Q532 K533 F538 H539 I540	Q532-S536 WeakPolarHBondContact O-CB 3.44Å; Q532-S536 PolarHBondContact O-N 2.86Å; K533-S536 PolarHBondContact O-N 2.97Å; S536-F538 PolarHBondContact O-N 3.44Å; S536-H539 PolarHBondContact O-N 3.4Å; S536-I540 VanDerWaalsContact O-CG1 3.28Å; S536-I540 WeakPolarHBondContact O-CG1 3.17Å; S536-I540 PolarHBondContact O-N 2.91Å
537	K	91.7	Very high	88.5	Confident	89 Å²	89	71.6 Å²	71.6	39%	0.387	34%	0.336	S	S	.	.	H	α-helix	trans	-60.5	-45.2	175.3	-175.7	70.8	174.3	-172.1	0	112.1	W478 F481 K533 A534 Y535 I540 W541	W478-K537 HydrophobicContact CH2-CB 3.72Å; W478-K537 HydrophobicContact CH2-CG 3.95Å; W478-K537 HydrophobicContact CZ3-CB 3.96Å; W478-K537 HydrophobicContact CZ3-CD 4.18Å; W478-K537 HydrophobicContact CZ3-CG 3.62Å; F481-K537 HydrophobicContact CE1-CG 4.2Å; F481-K537 HydrophobicContact CZ-CG 4.18Å; K533-K537 WeakPolarHBondContact O-CB 3.34Å; K533-K537 PolarHBondContact O-N 3.42Å; A534-K537 PolarHBondContact O-N 3.08Å; Y535-K537 PolarHBondContact O-N 2.88Å; K537-I540 PolarHBondContact O-N 3.44Å; K537-W541 WeakPolarHBondContact O-CB 3.07Å; K537-W541 PolarHBondContact O-N 3.43Å
538	F	91.1	Very high	88	Confident	16 Å²	16	82.1 Å²	82.1	7%	0.07	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-46.5	177.1	-179.3	-98	0	0	0	111.3	F477 V492 K496 A534 Y535 S536 W541 Q542	F477-F538 HydrophobicContact CE2-CB 4.29Å; F477-F538 HydrophobicContact CE2-CD2 4.44Å; F477-F538 HydrophobicContact CZ-CB 4.03Å; V492-F538 HydrophobicContact CG1-CD2 3.51Å; V492-F538 HydrophobicContact CG1-CE2 3.7Å; K496-F538 HydrophobicContact CB-CD2 4.24Å; K496-F538 HydrophobicContact CB-CE2 4.26Å; K496-F538 HydrophobicContact CB-CG 4.41Å; K496-F538 HydrophobicContact CB-CZ 4.43Å; K496-F538 HydrophobicContact CD-CE1 4.33Å; K496-F538 HydrophobicContact CG-CD1 4Å; K496-F538 HydrophobicContact CG-CD2 4.49Å; K496-F538 HydrophobicContact CG-CE1 4.16Å; K496-F538 HydrophobicContact CG-CG 4.17Å; K496-F538 HydrophobicContact CG-CZ 4.46Å; A534-F538 PolarHBondContact O-N 3.48Å; Y535-F538 PolarHBondContact O-N 3.43Å; S536-F538 PolarHBondContact O-N 3.44Å; F538-W541 HydrophobicContact CD2-CE3 4.11Å; F538-W541 HydrophobicContact CD2-CZ3 4.33Å; F538-W541 AromaticContact CE2-CE3 3.96Å; F538-W541 HydrophobicContact CE2-CE3 3.96Å; F538-W541 AromaticContact CE2-CZ3 3.72Å; F538-W541 HydrophobicContact CE2-CZ3 3.72Å; F538-W541 HydrophobicContact CZ-CZ3 4.22Å; F538-W541 PolarHBondContact O-N 3.06Å; F538-Q542 WeakPolarHBondContact O-CB 3.41Å; F538-Q542 PolarHBondContact O-N 2.93Å
539	H	91.3	Very high	86.7	Confident	115 Å²	115	86 Å²	86	53%	0.532	39%	0.391	S	S	.	.	H	α-helix	trans	-61.2	-46.5	178.7	-174.3	71.7	0	0	0	111.7	Y535 S536 W541 Q542 T543	Y535-H539 WeakPolarHBondContact O-CB 3.34Å; Y535-H539 PolarHBondContact O-N 3.44Å; S536-H539 PolarHBondContact O-N 3.4Å; H539-W541 VanDerWaalsContact C-N 3.3Å; H539-W541 PolarHBondContact O-N 3.45Å; H539-Q542 PolarHBondContact O-N 2.87Å; H539-T543 PolarHBondContact O-N 3.02Å; H539-T543 PolarHBondContact O-OG1 3.25Å
540	I	90.9	Very high	84.6	Confident	73 Å²	73	90.2 Å²	90.2	37%	0.374	42%	0.42	S	S	.	.	H	α-helix	trans	-58.4	-43.3	175.7	-68	165	0	0	0	111.1	S536 K537 R544	S536-I540 VanDerWaalsContact O-CG1 3.28Å; S536-I540 WeakPolarHBondContact O-CG1 3.17Å; S536-I540 PolarHBondContact O-N 2.91Å; K537-I540 PolarHBondContact O-N 3.44Å; I540-R544 WeakPolarHBondContact O-CB 3.26Å; I540-R544 VanDerWaalsContact O-CG 3.29Å; I540-R544 WeakPolarHBondContact O-CG 3.3Å; I540-R544 PolarHBondContact O-N 3.45Å
541	W	88.9	Confident	84.3	Confident	40 Å²	40	91.8 Å²	91.8	15%	0.152	43%	0.426	C	S	.	.	H	α-helix	trans	-64.2	-44.7	176.4	170.2	82.4	0	0	0	112	F481 V483 E489 K537 F538 H539 T543 R544 R545	F481-W541 HydrophobicContact CE1-CB 4.08Å; F481-W541 HydrophobicContact CE1-CG 4.09Å; V483-W541 HydrophobicContact CG1-CZ2 4.09Å; E489-W541 HydrophobicContact CB-CH2 4.33Å; E489-W541 HydrophobicContact CB-CZ2 4.23Å; E489-W541 HydrophobicContact CG-CZ2 4.05Å; K537-W541 WeakPolarHBondContact O-CB 3.07Å; K537-W541 PolarHBondContact O-N 3.43Å; F538-W541 HydrophobicContact CD2-CE3 4.11Å; F538-W541 HydrophobicContact CD2-CZ3 4.33Å; F538-W541 AromaticContact CE2-CE3 3.96Å; F538-W541 HydrophobicContact CE2-CE3 3.96Å; F538-W541 AromaticContact CE2-CZ3 3.72Å; F538-W541 HydrophobicContact CE2-CZ3 3.72Å; F538-W541 HydrophobicContact CZ-CZ3 4.22Å; F538-W541 PolarHBondContact O-N 3.06Å; H539-W541 VanDerWaalsContact C-N 3.3Å; H539-W541 PolarHBondContact O-N 3.45Å; W541-T543 PolarHBondContact O-N 2.89Å; W541-R544 PolarHBondContact O-N 3.25Å; W541-R545 WeakPolarHBondContact O-CB 3.47Å; W541-R545 PolarHBondContact O-N 2.91Å
542	Q	87.2	Confident	83.9	Confident	74 Å²	74	96.5 Å²	96.5	35%	0.346	45%	0.448	S	S	.	.	H	α-helix	trans	-61.6	-45	179	-173.3	178.6	4.6	0	0	111.5	F538 H539 R545 M546	F538-Q542 WeakPolarHBondContact O-CB 3.41Å; F538-Q542 PolarHBondContact O-N 2.93Å; H539-Q542 PolarHBondContact O-N 2.87Å; Q542-R545 WeakPolarHBondContact O-CB 3.31Å; Q542-R545 PolarHBondContact O-N 3.3Å; Q542-M546 HydrophobicContact CG-CE 4.37Å; Q542-M546 WeakPolarHBondContact O-CG 3.45Å; Q542-M546 PolarHBondContact O-N 2.69Å
543	T	88.4	Confident	83.5	Confident	51 Å²	51	95.3 Å²	95.3	31%	0.313	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-45.7	176.8	-56.6	0	0	0	0	111.4	H539 W541 R545 M546 M547	H539-T543 PolarHBondContact O-N 3.02Å; H539-T543 PolarHBondContact O-OG1 3.25Å; W541-T543 PolarHBondContact O-N 2.89Å; T543-R545 VanDerWaalsContact C-N 3.28Å; T543-R545 PolarHBondContact O-N 2.87Å; T543-M546 PolarHBondContact O-N 2.9Å; T543-M547 HydrophobicContact CG2-CE 4.01Å; T543-M547 HydrophobicContact CG2-SD 4.45Å; T543-M547 WeakPolarHBondContact O-CG 3.45Å; T543-M547 PolarHBondContact O-N 2.84Å
544	R	86.1	Confident	82.9	Confident	166 Å²	166	93.7 Å²	93.7	63%	0.626	44%	0.437	S	S	*	.	H	α-helix	trans	-62.5	-34.2	175.3	-74	177.6	-177.3	-168	0.6	112.7	I540 W541 R548	I540-R544 WeakPolarHBondContact O-CB 3.26Å; I540-R544 VanDerWaalsContact O-CG 3.29Å; I540-R544 WeakPolarHBondContact O-CG 3.3Å; I540-R544 PolarHBondContact O-N 3.45Å; W541-R544 PolarHBondContact O-N 3.25Å; R544-R548 WeakPolarHBondContact O-CG 3.26Å; R544-R548 PolarHBondContact O-N 3.24Å; R544-R548 VanDerWaalsContact O-N 3.16Å
545	R	81.6	Confident	82.4	Confident	79 Å²	79	99.6 Å²	99.6	30%	0.298	46%	0.464	S	S	.	.	H	α-helix	trans	-69.2	-42.2	175.6	-174.6	-176.3	-177.3	-150.8	2.4	111.5	E489 W541 Q542 T543 M547 R548 K549	E489-R545 IonicContact OE1-NE 2.59Å; E489-R545 IonicContact OE2-CZ 3.19Å; E489-R545 VanDerWaalsContact OE2-CZ 3.22Å; E489-R545 IonicContact OE2-NE 2.75Å; E489-R545 PolarHBondContact OE2-NE 3.37Å; E489-R545 IonicContact OE2-NH2 3.01Å; E489-R545 PolarHBondContact OE2-NH2 3.22Å; W541-R545 WeakPolarHBondContact O-CB 3.47Å; W541-R545 PolarHBondContact O-N 2.91Å; Q542-R545 WeakPolarHBondContact O-CB 3.31Å; Q542-R545 PolarHBondContact O-N 3.3Å; T543-R545 VanDerWaalsContact C-N 3.28Å; T543-R545 PolarHBondContact O-N 2.87Å; R545-M547 VanDerWaalsContact C-N 3.33Å; R545-R548 PolarHBondContact O-N 3.42Å; R545-K549 PolarHBondContact O-N 3.44Å
546	M	76.8	Confident	81.7	Confident	120 Å²	120	103.9 Å²	103.9	59%	0.591	49%	0.486	S	S	*	.	H	α-helix	trans	-60.4	-44.7	174.7	-72.5	-172.1	175.6	0	0	111	Q542 T543 R548 K549 T550	Q542-M546 HydrophobicContact CG-CE 4.37Å; Q542-M546 WeakPolarHBondContact O-CG 3.45Å; Q542-M546 PolarHBondContact O-N 2.69Å; T543-M546 PolarHBondContact O-N 2.9Å; M546-R548 VanDerWaalsContact C-N 3.26Å; M546-R548 PolarHBondContact O-N 3.25Å; M546-K549 PolarHBondContact O-N 2.87Å; M546-K549 VanDerWaalsContact O-N 3.14Å; M546-T550 PolarHBondContact O-N 2.99Å; M546-T550 PolarHBondContact O-OG1 3.28Å
547	M	75.1	Confident	81	Confident	132 Å²	132	107.1 Å²	107.1	65%	0.65	49%	0.491	S	S	*	.	H	α-helix	trans	-64.5	-23	176.2	-70	176.6	172.1	0	0	114.7	T543 R545	T543-M547 HydrophobicContact CG2-CE 4.01Å; T543-M547 HydrophobicContact CG2-SD 4.45Å; T543-M547 WeakPolarHBondContact O-CG 3.45Å; T543-M547 PolarHBondContact O-N 2.84Å; R545-M547 VanDerWaalsContact C-N 3.33Å
548	R	75	Confident	80.1	Confident	221 Å²	221	108.5 Å²	108.5	83%	0.834	50%	0.499	S	S	*	.	H	α-helix	trans	-87.5	-15.8	175.5	-76.4	179.2	177.3	-171	-2.3	113.6	R544 R545 M546	R544-R548 WeakPolarHBondContact O-CG 3.26Å; R544-R548 PolarHBondContact O-N 3.24Å; R544-R548 VanDerWaalsContact O-N 3.16Å; R545-R548 PolarHBondContact O-N 3.42Å; M546-R548 VanDerWaalsContact C-N 3.26Å; M546-R548 PolarHBondContact O-N 3.25Å
549	K	61	Low	79.2	Confident	154 Å²	154	116.2 Å²	116.2	67%	0.67	54%	0.535	S	S	*	.	H	α-helix	trans	-93.9	-13.2	177.1	-74.4	-171.1	178.2	-171.4	0	112.7	R545 M546	R545-K549 PolarHBondContact O-N 3.44Å; M546-K549 PolarHBondContact O-N 2.87Å; M546-K549 VanDerWaalsContact O-N 3.14Å
550	T	48.2	Very low	78.1	Confident	169 Å²	169	116.3 Å²	116.3	100%	1.037	54%	0.536	S	S	*	.			trans	-90	0	165.9	-0.5	0	0	0	0	107.8	M546	M546-T550 PolarHBondContact O-N 2.99Å; M546-T550 PolarHBondContact O-OG1 3.28Å

Retrieved 550 of 550 residues in 824.5 ms (Link to these results)

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