A0A3Q0KTK9_SCHMA Loading...

Eukaryotic translation initiation factor 3 subunit E

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession A0A3Q0KTK9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 444 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	46.7	Very low	70	Confident	175 Å²	175	81.2 Å²	81.2	86%	0.862	40%	0.402	S	S	*	.				0	-50.1	0	-67.1	-174.9	-171.8	0	0	111.1
2	S	58.8	Low	70.9	Confident	62 Å²	62	79.5 Å²	79.5	43%	0.434	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-75.7	-17.5	178.4	50.4	0	0	0	0	115.9	F4 D5 Y32	S2-F4 VanDerWaalsContact C-N 3.32Å; S2-F4 PolarHBondContact O-N 2.86Å; S2-D5 PolarHBondContact O-N 3.48Å; S2-Y32 WeakPolarHBondContact CB-OH 3.34Å; S2-Y32 PolarHBondContact O-OH 3.27Å
3	E	65.9	Low	71.5	Confident	170 Å²	170	77.2 Å²	77.2	79%	0.794	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-70.9	-25.3	-173.3	-64.1	-176	164.8	0	0	114
4	F	66.3	Low	72.2	Confident	61 Å²	61	73.1 Å²	73.1	27%	0.268	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-99.9	7.2	-177.7	-60.5	-65.4	0	0	0	113.3	S2 L6 P294 V317 V321	S2-F4 VanDerWaalsContact C-N 3.32Å; S2-F4 PolarHBondContact O-N 2.86Å; F4-L6 PolarHBondContact O-N 3.29Å; F4-L6 VanDerWaalsContact O-N 3.09Å; F4-P294 HydrophobicContact CD1-CG 4.2Å; F4-P294 HydrophobicContact CD2-CG 4.41Å; F4-P294 HydrophobicContact CE1-CG 3.71Å; F4-P294 HydrophobicContact CE2-CG 3.92Å; F4-P294 HydrophobicContact CZ-CG 3.55Å; F4-V317 HydrophobicContact CE2-CG1 4.41Å; F4-V321 HydrophobicContact CB-CG1 3.63Å; F4-V321 HydrophobicContact CB-CG2 4.46Å; F4-V321 HydrophobicContact CD2-CG1 4.32Å; F4-V321 HydrophobicContact CD2-CG2 3.64Å; F4-V321 HydrophobicContact CE2-CG2 4.22Å; F4-V321 HydrophobicContact CG-CG1 4.13Å; F4-V321 HydrophobicContact CG-CG2 4.22Å
5	D	69.7	Low	72.7	Confident	46 Å²	46	71.6 Å²	71.6	25%	0.246	38%	0.376	C	S	.	.			trans	-69.3	111.4	177.4	-172.8	8.5	0	0	0	110.3	S2 T7 Y32	S2-D5 PolarHBondContact O-N 3.48Å; D5-T7 VanDerWaalsContact C-N 3.3Å; D5-T7 WeakPolarHBondContact OD1-CB 3.37Å; D5-T7 PolarHBondContact OD1-N 3.24Å; D5-T7 PolarHBondContact OD1-OG1 3.39Å; D5-Y32 WeakPolarHBondContact CB-OH 3.41Å; D5-Y32 WeakPolarHBondContact OD2-CE2 3.46Å
6	L	75.7	Confident	73.1	Confident	7 Å²	7	72.3 Å²	72.3	4%	0.037	38%	0.375	C	S	.	.			trans	-84.3	-7.2	178.2	-71.4	172.3	0	0	0	112.5	F4 K8 K9 I10 H256 Y260 Y291	F4-L6 PolarHBondContact O-N 3.29Å; F4-L6 VanDerWaalsContact O-N 3.09Å; L6-K8 VanDerWaalsContact C-N 3.26Å; L6-K8 PolarHBondContact O-N 3.3Å; L6-K9 HydrophobicContact CD2-CD 4.32Å; L6-K9 PolarHBondContact O-N 3.12Å; L6-I10 HydrophobicContact CB-CD1 3.79Å; L6-I10 HydrophobicContact CB-CG1 4.28Å; L6-I10 WeakPolarHBondContact O-CG1 3.34Å; L6-I10 PolarHBondContact O-N 3Å; L6-H256 HydrophobicContact CD1-CB 4.23Å; L6-H256 HydrophobicContact CD2-CB 3.57Å; L6-Y260 HydrophobicContact CD1-CE2 4.37Å; L6-Y291 HydrophobicContact CD2-CE2 4.22Å
7	T	74.4	Confident	73.5	Confident	28 Å²	28	68.2 Å²	68.2	17%	0.172	35%	0.354	C	S	.	.	H	α-helix	trans	-58.6	-39	-173	-54	0	0	0	0	111.8	D5 K9 I10 S11 L22 I26	D5-T7 VanDerWaalsContact C-N 3.3Å; D5-T7 WeakPolarHBondContact OD1-CB 3.37Å; D5-T7 PolarHBondContact OD1-N 3.24Å; D5-T7 PolarHBondContact OD1-OG1 3.39Å; T7-K9 VanDerWaalsContact C-N 3.33Å; T7-K9 PolarHBondContact O-N 3.45Å; T7-I10 PolarHBondContact O-N 3.45Å; T7-S11 WeakPolarHBondContact O-CB 3.44Å; T7-S11 PolarHBondContact O-N 3Å; T7-S11 PolarHBondContact O-OG 2.73Å; T7-S11 VanDerWaalsContact O-OG 3.11Å; T7-L22 HydrophobicContact CG2-CB 4.01Å; T7-L22 HydrophobicContact CG2-CD1 4.29Å; T7-I26 HydrophobicContact CG2-CD1 3.67Å; T7-I26 WeakPolarHBondContact OG1-CD1 3.45Å
8	K	76.2	Confident	73.9	Confident	182 Å²	182	64.4 Å²	64.4	79%	0.791	34%	0.335	S	S	*	.	H	α-helix	trans	-63.7	-34.6	176.1	-174.1	176.1	-178.8	178.1	0	113.7	L6 S11	L6-K8 VanDerWaalsContact C-N 3.26Å; L6-K8 PolarHBondContact O-N 3.3Å; K8-S11 PolarHBondContact O-OG 2.8Å
9	K	78.6	Confident	74.4	Confident	114 Å²	114	61.7 Å²	61.7	50%	0.496	32%	0.321	S	S	.	.	H	α-helix	trans	-78.9	-43.4	178.9	-70.9	-175.8	178.5	179.1	0	110.5	L6 T7 G12 F13	L6-K9 HydrophobicContact CD2-CD 4.32Å; L6-K9 PolarHBondContact O-N 3.12Å; T7-K9 VanDerWaalsContact C-N 3.33Å; T7-K9 PolarHBondContact O-N 3.45Å; K9-G12 PolarHBondContact O-N 3.1Å; K9-F13 WeakPolarHBondContact O-CD2 3.3Å; K9-F13 WeakPolarHBondContact O-CE2 3.37Å
10	I	80.5	Confident	74.8	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-65.8	-40.6	179.2	-66.9	171.1	0	0	0	110.3	L6 T7 G12 F13 L14 L22 Y260	L6-I10 HydrophobicContact CB-CD1 3.79Å; L6-I10 HydrophobicContact CB-CG1 4.28Å; L6-I10 WeakPolarHBondContact O-CG1 3.34Å; L6-I10 PolarHBondContact O-N 3Å; T7-I10 PolarHBondContact O-N 3.45Å; I10-G12 PolarHBondContact O-N 3.47Å; I10-G12 VanDerWaalsContact O-N 3.12Å; I10-F13 PolarHBondContact O-N 3.49Å; I10-L14 HydrophobicContact CG2-CD1 3.53Å; I10-L14 HydrophobicContact CG2-CG 3.92Å; I10-L14 WeakPolarHBondContact O-CG 3.32Å; I10-L14 PolarHBondContact O-N 2.95Å; I10-L22 HydrophobicContact CG2-CD1 4.35Å; I10-Y260 HydrophobicContact CD1-CE2 4.03Å; I10-Y260 WeakPolarHBondContact CD1-OH 3.44Å
11	S	76.9	Confident	75.1	Confident	44 Å²	44	58.5 Å²	58.5	31%	0.308	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-60	-26	-179.6	66.3	0	0	0	0	113.4	T7 K8 F13 L14	T7-S11 WeakPolarHBondContact O-CB 3.44Å; T7-S11 PolarHBondContact O-N 3Å; T7-S11 PolarHBondContact O-OG 2.73Å; T7-S11 VanDerWaalsContact O-OG 3.11Å; K8-S11 PolarHBondContact O-OG 2.8Å; S11-F13 PolarHBondContact O-N 2.82Å; S11-L14 PolarHBondContact O-N 3.47Å
12	G	81	Confident	76.7	Confident	61 Å²	61	50.4 Å²	50.4	63%	0.629	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-69.1	-15.9	174.8	0	0	0	0	0	114.4	K9 I10	K9-G12 PolarHBondContact O-N 3.1Å; I10-G12 PolarHBondContact O-N 3.47Å; I10-G12 VanDerWaalsContact O-N 3.12Å
13	F	79.2	Confident	77.8	Confident	50 Å²	50	48.4 Å²	48.4	22%	0.219	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-111.3	-0.1	-179.9	-59.3	-72.1	0	0	0	113	K9 I10 S11 T216 W217 H220 W221	K9-F13 WeakPolarHBondContact O-CD2 3.3Å; K9-F13 WeakPolarHBondContact O-CE2 3.37Å; I10-F13 PolarHBondContact O-N 3.49Å; S11-F13 PolarHBondContact O-N 2.82Å; F13-T216 HydrophobicContact CD1-CG2 3.89Å; F13-T216 HydrophobicContact CE1-CG2 3.8Å; F13-T216 HydrophobicContact CG-CG2 4.49Å; F13-T216 HydrophobicContact CZ-CG2 4.35Å; F13-W217 AromaticContact CD1-CD1 3.7Å; F13-W217 AromaticContact CD1-NE1 3.8Å; F13-H220 HydrophobicContact CB-CB 4.34Å; F13-H220 AromaticContact CD2-CE1 3.43Å; F13-H220 VanDerWaalsContact CD2-CE1 3.43Å; F13-H220 WeakPolarHBondContact CD2-CE1 3.21Å; F13-H220 AromaticContact CD2-NE2 3.41Å; F13-H220 WeakPolarHBondContact CD2-NE2 3.5Å; F13-H220 AromaticContact CE2-CE1 3.94Å; F13-H220 AromaticContact CE2-NE2 3.99Å; F13-H220 AromaticContact CG-CE1 3.62Å; F13-H220 AromaticContact CG-ND1 3.87Å; F13-H220 AromaticContact CG-NE2 3.97Å; F13-W221 PolarHBondContact O-NE1 3.45Å
14	L	81.2	Confident	78.4	Confident	20 Å²	20	44.1 Å²	44.1	11%	0.105	23%	0.231	C	C	.	.	S	Bend	trans	-107.1	155.5	-178.4	-65.6	-176.1	0	0	0	111.4	I10 S11 L18 T19 L22 H220 W221 F224	I10-L14 HydrophobicContact CG2-CD1 3.53Å; I10-L14 HydrophobicContact CG2-CG 3.92Å; I10-L14 WeakPolarHBondContact O-CG 3.32Å; I10-L14 PolarHBondContact O-N 2.95Å; S11-L14 PolarHBondContact O-N 3.47Å; L14-L18 HydrophobicContact CB-CB 4.34Å; L14-L18 HydrophobicContact CD1-CB 4.46Å; L14-L18 HydrophobicContact CD2-CD1 4.49Å; L14-T19 HydrophobicContact CB-CG2 4.16Å; L14-L22 HydrophobicContact CD1-CD1 3.62Å; L14-H220 HydrophobicContact CD2-CB 4.11Å; L14-W221 VanDerWaalsContact CD2-CD1 3.4Å; L14-W221 HydrophobicContact CD2-CG 4.36Å; L14-F224 HydrophobicContact CD1-CE2 3.61Å; L14-F224 HydrophobicContact CD1-CZ 3.69Å; L14-F224 HydrophobicContact CD2-CE2 3.72Å; L14-F224 HydrophobicContact CG-CE2 4.33Å
15	D	80.2	Confident	79.1	Confident	50 Å²	50	43.2 Å²	43.2	27%	0.267	23%	0.226	S	C	.	.			trans	-72.3	153.7	167.4	-174	31.8	0	0	0	111.2	H17 L18 T19 Y138 W221	D15-H17 VanDerWaalsContact C-N 3.27Å; D15-H17 PolarHBondContact O-N 3.42Å; D15-L18 PolarHBondContact O-N 2.94Å; D15-T19 PolarHBondContact O-N 2.84Å; D15-Y138 WeakPolarHBondContact OD2-CE1 3.47Å; D15-Y138 VanDerWaalsContact OD2-CZ 3.27Å; D15-Y138 PolarHBondContact OD2-OH 3.33Å; D15-W221 HydrophobicContact CB-CH2 4.28Å; D15-W221 HydrophobicContact CB-CZ2 3.91Å
16	K	78.9	Confident	79.6	Confident	82 Å²	82	41.5 Å²	41.5	36%	0.357	22%	0.217	S	C	.	.	H	α-helix	trans	-56.1	-41.1	-173.4	-57.2	-177.6	-167.6	-174	0	111.6	L18 T19 V44 E47 T48	K16-L18 PolarHBondContact O-N 2.81Å; K16-T19 PolarHBondContact O-N 3.27Å; K16-T19 PolarHBondContact O-OG1 3.05Å; K16-V44 HydrophobicContact CB-CG1 4.22Å; K16-E47 HydrophobicContact CD-CB 4.02Å; K16-E47 WeakPolarHBondContact CE-OE2 3.39Å; K16-E47 IonicContact NZ-OE2 3.39Å; K16-E47 PolarHBondContact NZ-OE2 3.39Å; K16-T48 HydrophobicContact CB-CG2 3.93Å; K16-T48 HydrophobicContact CD-CG2 4.43Å
17	H	80.2	Confident	79.7	Confident	3 Å²	3	43 Å²	43	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-65.8	-37	177.7	-71.1	-88.5	0	0	0	112.8	D15 T19 L20 P21 M50 Y138 Y143 L177	D15-H17 VanDerWaalsContact C-N 3.27Å; D15-H17 PolarHBondContact O-N 3.42Å; H17-T19 VanDerWaalsContact C-N 3.25Å; H17-T19 PolarHBondContact O-N 3.49Å; H17-L20 WeakPolarHBondContact O-CB 3.43Å; H17-L20 PolarHBondContact O-N 3.38Å; H17-P21 WeakPolarHBondContact O-CD 3.46Å; H17-M50 VanDerWaalsContact CE1-CE 3.43Å; H17-M50 WeakPolarHBondContact CE1-CE 3.38Å; H17-M50 VanDerWaalsContact ND1-CE 3.27Å; H17-M50 WeakPolarHBondContact ND1-CE 3.39Å; H17-Y138 AromaticContact CD2-CD1 3.98Å; H17-Y138 AromaticContact CD2-CE1 3.34Å; H17-Y138 WeakPolarHBondContact CD2-CE1 3.27Å; H17-Y138 AromaticContact CD2-CZ 3.86Å; H17-Y138 PolarHBondContact CE1-O 3.24Å; H17-Y138 AromaticContact NE2-CE1 3.99Å; H17-Y143 PolarHBondContact ND1-OH 3.14Å; H17-L177 HydrophobicContact CB-CD1 3.7Å
18	L	80.6	Confident	80	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-71.5	-19.4	177.7	-66.5	175.6	0	0	0	113.1	L14 D15 K16 L20 P21 I176 L177 W221	L14-L18 HydrophobicContact CB-CB 4.34Å; L14-L18 HydrophobicContact CD1-CB 4.46Å; L14-L18 HydrophobicContact CD2-CD1 4.49Å; D15-L18 PolarHBondContact O-N 2.94Å; K16-L18 PolarHBondContact O-N 2.81Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-P21 WeakPolarHBondContact O-CD 3.37Å; L18-I176 HydrophobicContact CD2-CB 4.07Å; L18-I176 HydrophobicContact CD2-CG2 3.49Å; L18-I176 VanDerWaalsContact CD2-CG2 3.49Å; L18-L177 HydrophobicContact CD2-CD2 3.97Å; L18-L177 HydrophobicContact CD2-CG 3.97Å; L18-W221 HydrophobicContact CD1-CD2 3.92Å; L18-W221 HydrophobicContact CD1-CE3 4.17Å; L18-W221 HydrophobicContact CD1-CG 4.43Å; L18-W221 HydrophobicContact CD1-CH2 4.37Å; L18-W221 HydrophobicContact CD1-CZ2 4.12Å; L18-W221 HydrophobicContact CD1-CZ3 4.39Å
19	T	82.7	Confident	79.9	Confident	12 Å²	12	42.2 Å²	42.2	7%	0.074	23%	0.232	C	C	.	.	H	α-helix	trans	-73.8	-22.6	172.7	69.7	0	0	0	0	112.9	L14 D15 K16 H17 L22 L23	L14-T19 HydrophobicContact CB-CG2 4.16Å; D15-T19 PolarHBondContact O-N 2.84Å; K16-T19 PolarHBondContact O-N 3.27Å; K16-T19 PolarHBondContact O-OG1 3.05Å; H17-T19 VanDerWaalsContact C-N 3.25Å; H17-T19 PolarHBondContact O-N 3.49Å; T19-L22 PolarHBondContact O-N 3.33Å; T19-L23 WeakPolarHBondContact O-CG 3.31Å; T19-L23 PolarHBondContact O-N 3.44Å
20	L	81.5	Confident	79.5	Confident	16 Å²	16	41.1 Å²	41.1	8%	0.084	23%	0.232	C	C	.	.	H	α-helix	trans	-66.3	-46.9	-176.3	-63.4	169.7	0	0	0	113	H17 L18 L22 L23 E24 K41 V44 L45 M50	H17-L20 WeakPolarHBondContact O-CB 3.43Å; H17-L20 PolarHBondContact O-N 3.38Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L20-L22 VanDerWaalsContact C-N 3.25Å; L20-L22 PolarHBondContact O-N 2.95Å; L20-L23 PolarHBondContact O-N 3.17Å; L20-E24 WeakPolarHBondContact O-CG 3.32Å; L20-E24 PolarHBondContact O-N 3.27Å; L20-K41 HydrophobicContact CD2-CG 4.16Å; L20-V44 HydrophobicContact CD2-CG1 3.98Å; L20-V44 HydrophobicContact CG-CG1 4.45Å; L20-L45 HydrophobicContact CD1-CD2 3.91Å; L20-L45 HydrophobicContact CD2-CD2 3.92Å; L20-L45 HydrophobicContact CD2-CG 4.06Å; L20-M50 HydrophobicContact CD1-CE 3.2Å
21	P	81.8	Confident	79	Confident	41 Å²	41	43.1 Å²	43.1	27%	0.266	24%	0.242	S	C	.	.	H	α-helix	trans	-57.1	-37.7	173.5	-26.4	34.1	0	0	0	113.4	H17 L18 E24 Y25 L177 F326	H17-P21 WeakPolarHBondContact O-CD 3.46Å; L18-P21 WeakPolarHBondContact O-CD 3.37Å; P21-E24 PolarHBondContact O-N 3.38Å; P21-Y25 WeakPolarHBondContact O-CB 3.18Å; P21-Y25 PolarHBondContact O-N 3.46Å; P21-L177 HydrophobicContact CG-CD2 4.41Å; P21-F326 HydrophobicContact CB-CZ 4.27Å
22	L	81.3	Confident	78.7	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-66.1	-44.4	177.2	-62.4	178.7	0	0	0	111.3	T7 I10 L14 T19 L20 Y25 I26 F224 F326 F327	T7-L22 HydrophobicContact CG2-CB 4.01Å; T7-L22 HydrophobicContact CG2-CD1 4.29Å; I10-L22 HydrophobicContact CG2-CD1 4.35Å; L14-L22 HydrophobicContact CD1-CD1 3.62Å; T19-L22 PolarHBondContact O-N 3.33Å; L20-L22 VanDerWaalsContact C-N 3.25Å; L20-L22 PolarHBondContact O-N 2.95Å; L22-Y25 PolarHBondContact O-N 2.87Å; L22-I26 WeakPolarHBondContact O-CG1 3.47Å; L22-I26 PolarHBondContact O-N 3.42Å; L22-I26 VanDerWaalsContact O-N 3.07Å; L22-F224 HydrophobicContact CD1-CZ 4.14Å; L22-F224 HydrophobicContact CD2-CE1 4.27Å; L22-F224 HydrophobicContact CD2-CZ 4.26Å; L22-F224 HydrophobicContact CG-CZ 4.24Å; L22-F326 HydrophobicContact CD2-CB 3.7Å; L22-F326 HydrophobicContact CD2-CD1 3.5Å; L22-F326 HydrophobicContact CD2-CD2 4.23Å; L22-F326 HydrophobicContact CD2-CE1 4.15Å; L22-F326 HydrophobicContact CD2-CG 3.55Å; L22-F327 HydrophobicContact CD2-CE2 4.44Å; L22-F327 HydrophobicContact CD2-CZ 4.38Å
23	L	80.5	Confident	78.4	Confident	21 Å²	21	47.1 Å²	47.1	11%	0.11	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-38.4	177.4	-70.4	174.4	0	0	0	112.2	T19 L20 Y25 I26 S27 T40 K41 V44	T19-L23 WeakPolarHBondContact O-CG 3.31Å; T19-L23 PolarHBondContact O-N 3.44Å; L20-L23 PolarHBondContact O-N 3.17Å; L23-Y25 VanDerWaalsContact C-N 3.35Å; L23-I26 PolarHBondContact O-N 2.83Å; L23-S27 WeakPolarHBondContact O-CB 3.47Å; L23-S27 PolarHBondContact O-N 2.86Å; L23-T40 HydrophobicContact CD1-CG2 4.49Å; L23-T40 HydrophobicContact CD2-CG2 4.37Å; L23-K41 HydrophobicContact CD1-CB 4.47Å; L23-V44 HydrophobicContact CD1-CG2 4.29Å
24	E	79.5	Confident	78.1	Confident	80 Å²	80	49.6 Å²	49.6	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-63.5	-41.5	174.8	-74.2	-176.1	170.1	0	0	111.7	L20 P21 I26 S27 V28 K41	L20-E24 WeakPolarHBondContact O-CG 3.32Å; L20-E24 PolarHBondContact O-N 3.27Å; P21-E24 PolarHBondContact O-N 3.38Å; E24-I26 PolarHBondContact O-N 3.28Å; E24-S27 WeakPolarHBondContact O-CB 3.4Å; E24-S27 PolarHBondContact O-N 2.89Å; E24-V28 WeakPolarHBondContact O-CG2 3.38Å; E24-V28 PolarHBondContact O-N 2.83Å; E24-K41 IonicContact OE1-NZ 3.82Å; E24-K41 PolarHBondContact OE1-NZ 2.77Å
25	Y	80.5	Confident	77.7	Confident	41 Å²	41	55.7 Å²	55.7	16%	0.161	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-43.5	175.6	-176.1	-104.4	0	0	0	113	P21 L22 L23 S27 V28 K29 P323 N324 F326 T329	P21-Y25 WeakPolarHBondContact O-CB 3.18Å; P21-Y25 PolarHBondContact O-N 3.46Å; L22-Y25 PolarHBondContact O-N 2.87Å; L23-Y25 VanDerWaalsContact C-N 3.35Å; Y25-S27 VanDerWaalsContact C-N 3.28Å; Y25-S27 PolarHBondContact O-N 3.48Å; Y25-V28 PolarHBondContact O-N 2.97Å; Y25-V28 VanDerWaalsContact O-N 3.16Å; Y25-K29 HydrophobicContact CD1-CG 4.39Å; Y25-K29 HydrophobicContact CE1-CG 4.01Å; Y25-K29 HydrophobicContact CE2-CG 4.48Å; Y25-K29 VanDerWaalsContact CZ-CE 3.46Å; Y25-K29 WeakPolarHBondContact O-CG 3.48Å; Y25-K29 PolarHBondContact O-N 3.18Å; Y25-K29 WeakPolarHBondContact OH-CE 3.23Å; Y25-K29 PolarHBondContact OH-NZ 3Å; Y25-P323 PolarHBondContact OH-O 3.28Å; Y25-P323 VanDerWaalsContact OH-O 3.07Å; Y25-N324 WeakPolarHBondContact CE1-O 3.43Å; Y25-F326 HydrophobicContact CD1-CB 3.98Å; Y25-F326 HydrophobicContact CD1-CD2 4.01Å; Y25-F326 AromaticContact CD2-CD2 3.84Å; Y25-F326 HydrophobicContact CD2-CD2 3.84Å; Y25-F326 HydrophobicContact CD2-CE2 4.41Å; Y25-F326 HydrophobicContact CE1-CB 4.28Å; Y25-F326 HydrophobicContact CG-CB 4.38Å; Y25-F326 AromaticContact CG-CD2 3.53Å; Y25-F326 HydrophobicContact CG-CD2 3.53Å; Y25-F326 HydrophobicContact CG-CE2 4.33Å; Y25-F326 HydrophobicContact CG-CG 4.44Å; Y25-T329 PolarHBondContact OH-OG1 2.78Å
26	I	80	Confident	77.6	Confident	10 Å²	10	56.5 Å²	56.5	5%	0.051	29%	0.287	C	S	.	.	H	α-helix	trans	-63.5	-38.5	175.7	-64.8	168.4	0	0	0	110.6	T7 L22 L23 E24 V28 K29 N30 Y32 I37	T7-I26 HydrophobicContact CG2-CD1 3.67Å; T7-I26 WeakPolarHBondContact OG1-CD1 3.45Å; L22-I26 WeakPolarHBondContact O-CG1 3.47Å; L22-I26 PolarHBondContact O-N 3.42Å; L22-I26 VanDerWaalsContact O-N 3.07Å; L23-I26 PolarHBondContact O-N 2.83Å; E24-I26 PolarHBondContact O-N 3.28Å; I26-V28 VanDerWaalsContact C-N 3.29Å; I26-V28 PolarHBondContact O-N 3.38Å; I26-K29 PolarHBondContact O-N 3.35Å; I26-N30 PolarHBondContact O-N 2.86Å; I26-N30 VanDerWaalsContact O-N 3.1Å; I26-Y32 HydrophobicContact CG2-CD2 3.85Å; I26-Y32 HydrophobicContact CG2-CE2 4.4Å; I26-I37 HydrophobicContact CG2-CD1 3.72Å; I26-I37 HydrophobicContact CG2-CG1 4.27Å
27	S	77.7	Confident	77.5	Confident	38 Å²	38	53.1 Å²	53.1	27%	0.266	27%	0.273	S	S	.	.	H	α-helix	trans	-63.4	-33.7	175.4	-167.4	0	0	0	0	112.4	L23 E24 Y25 N30	L23-S27 WeakPolarHBondContact O-CB 3.47Å; L23-S27 PolarHBondContact O-N 2.86Å; E24-S27 WeakPolarHBondContact O-CB 3.4Å; E24-S27 PolarHBondContact O-N 2.89Å; Y25-S27 VanDerWaalsContact C-N 3.28Å; Y25-S27 PolarHBondContact O-N 3.48Å; S27-N30 PolarHBondContact O-OD1 3.48Å
28	V	81.3	Confident	77.3	Confident	118 Å²	118	54 Å²	54	72%	0.715	28%	0.278	S	S	*	.	H	α-helix	trans	-75.1	-34.1	175.8	172.5	0	0	0	0	111.5	E24 Y25 I26 N30	E24-V28 WeakPolarHBondContact O-CG2 3.38Å; E24-V28 PolarHBondContact O-N 2.83Å; Y25-V28 PolarHBondContact O-N 2.97Å; Y25-V28 VanDerWaalsContact O-N 3.16Å; I26-V28 VanDerWaalsContact C-N 3.29Å; I26-V28 PolarHBondContact O-N 3.38Å; V28-N30 VanDerWaalsContact C-N 3.33Å
29	K	73.5	Confident	77.1	Confident	76 Å²	76	59 Å²	59	33%	0.33	30%	0.299	S	S	.	.	H	α-helix	trans	-78.9	-12.9	-179.5	-70.2	-73.5	179.6	158.7	0	114.1	Y25 I26 I31 P323	Y25-K29 HydrophobicContact CD1-CG 4.39Å; Y25-K29 HydrophobicContact CE1-CG 4.01Å; Y25-K29 HydrophobicContact CE2-CG 4.48Å; Y25-K29 VanDerWaalsContact CZ-CE 3.46Å; Y25-K29 WeakPolarHBondContact O-CG 3.48Å; Y25-K29 PolarHBondContact O-N 3.18Å; Y25-K29 WeakPolarHBondContact OH-CE 3.23Å; Y25-K29 PolarHBondContact OH-NZ 3Å; I26-K29 PolarHBondContact O-N 3.35Å; K29-I31 HydrophobicContact CB-CD1 4Å; K29-I31 HydrophobicContact CB-CG1 3.88Å; K29-I31 PolarHBondContact O-N 3.07Å; K29-P323 WeakPolarHBondContact CE-O 3.4Å; K29-P323 PolarHBondContact NZ-O 2.96Å
30	N	71.5	Confident	76.8	Confident	91 Å²	91	61.4 Å²	61.4	49%	0.487	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	39.5	177.6	-74.7	-20.8	0	0	0	113.8	I26 S27 V28 E34	I26-N30 PolarHBondContact O-N 2.86Å; I26-N30 VanDerWaalsContact O-N 3.1Å; S27-N30 PolarHBondContact O-OD1 3.48Å; V28-N30 VanDerWaalsContact C-N 3.33Å; N30-E34 PolarHBondContact OD1-OE1 2.77Å
31	I	69.2	Low	76.6	Confident	47 Å²	47	61.8 Å²	61.8	24%	0.241	32%	0.315	C	S	.	.			trans	-74.9	-31.9	179.2	-58.5	172.2	0	0	0	111.1	K29 N324	K29-I31 HydrophobicContact CB-CD1 4Å; K29-I31 HydrophobicContact CB-CG1 3.88Å; K29-I31 PolarHBondContact O-N 3.07Å; I31-N324 HydrophobicContact CD1-CB 3.83Å
32	Y	70.1	Confident	76.2	Confident	87 Å²	87	62.4 Å²	62.4	34%	0.341	31%	0.312	S	S	.	.	S	Bend	trans	-119.5	167.1	177.3	-60.5	-84.3	0	0	0	110.9	S2 D5 I26 E34	S2-Y32 WeakPolarHBondContact CB-OH 3.34Å; S2-Y32 PolarHBondContact O-OH 3.27Å; D5-Y32 WeakPolarHBondContact CB-OH 3.41Å; D5-Y32 WeakPolarHBondContact OD2-CE2 3.46Å; I26-Y32 HydrophobicContact CG2-CD2 3.85Å; I26-Y32 HydrophobicContact CG2-CE2 4.4Å; Y32-E34 PolarHBondContact O-N 3.23Å
33	D	75.2	Confident	76.1	Confident	102 Å²	102	66.7 Å²	66.7	55%	0.545	33%	0.332	S	S	.	.			trans	-56.9	122	171.1	-178.2	30.6	0	0	0	110.2	K35 S36 I37	D33-K35 PolarHBondContact O-N 2.78Å; D33-K35 VanDerWaalsContact O-N 3.08Å; D33-S36 PolarHBondContact O-N 3.16Å; D33-I37 PolarHBondContact O-N 3.19Å
34	E	72.2	Confident	76	Confident	101 Å²	101	67 Å²	67	47%	0.472	34%	0.335	S	S	.	.	H	α-helix	trans	-52.7	-35.6	-176.5	-70	-179.1	176.8	0	0	111.2	N30 Y32 S36 I37 L38	N30-E34 PolarHBondContact OD1-OE1 2.77Å; Y32-E34 PolarHBondContact O-N 3.23Å; E34-S36 VanDerWaalsContact C-N 3.34Å; E34-S36 PolarHBondContact O-N 3.46Å; E34-I37 PolarHBondContact O-N 3.09Å; E34-L38 VanDerWaalsContact O-CB 3.31Å; E34-L38 WeakPolarHBondContact O-CB 3.16Å; E34-L38 WeakPolarHBondContact O-CG 3.4Å; E34-L38 PolarHBondContact O-N 3.18Å
35	K	73.3	Confident	75.7	Confident	148 Å²	148	63.2 Å²	63.2	64%	0.643	32%	0.317	S	S	*	.	H	α-helix	trans	-63.7	-36.6	179.3	-66.2	179.8	179	176.2	0	113.3	D33 K39	D33-K35 PolarHBondContact O-N 2.78Å; D33-K35 VanDerWaalsContact O-N 3.08Å; K35-K39 WeakPolarHBondContact O-CB 3.28Å; K35-K39 PolarHBondContact O-N 3.14Å
36	S	77.4	Confident	75.2	Confident	68 Å²	68	63.8 Å²	63.8	48%	0.476	32%	0.322	S	S	.	.	H	α-helix	trans	-74.7	-38.3	179.5	-67.2	0	0	0	0	111.5	D33 E34 T40	D33-S36 PolarHBondContact O-N 3.16Å; E34-S36 VanDerWaalsContact C-N 3.34Å; E34-S36 PolarHBondContact O-N 3.46Å; S36-T40 PolarHBondContact O-N 2.98Å; S36-T40 PolarHBondContact O-OG1 2.91Å
37	I	77.3	Confident	74.8	Confident	10 Å²	10	69.6 Å²	69.6	5%	0.051	35%	0.349	C	S	.	.	H	α-helix	trans	-64.8	-47.2	173.8	-60.5	164.5	0	0	0	109.9	I26 D33 E34 K39 T40 K41	I26-I37 HydrophobicContact CG2-CD1 3.72Å; I26-I37 HydrophobicContact CG2-CG1 4.27Å; D33-I37 PolarHBondContact O-N 3.19Å; E34-I37 PolarHBondContact O-N 3.09Å; I37-K39 VanDerWaalsContact C-N 3.34Å; I37-K39 PolarHBondContact O-N 2.87Å; I37-T40 CarbonylContact O-C 3.51Å; I37-T40 WeakPolarHBondContact O-CB 3.13Å; I37-T40 PolarHBondContact O-N 3.4Å; I37-T40 VanDerWaalsContact O-N 3.12Å; I37-K41 WeakPolarHBondContact O-CB 3.43Å; I37-K41 PolarHBondContact O-N 2.85Å
38	L	75.4	Confident	74.4	Confident	23 Å²	23	68.3 Å²	68.3	12%	0.12	34%	0.34	C	S	.	.	H	α-helix	trans	-64.2	-38.1	179.9	-72.1	170.6	0	0	0	112.1	E34 T40 K41 W42 I60 I61	E34-L38 VanDerWaalsContact O-CB 3.31Å; E34-L38 WeakPolarHBondContact O-CB 3.16Å; E34-L38 WeakPolarHBondContact O-CG 3.4Å; E34-L38 PolarHBondContact O-N 3.18Å; L38-T40 VanDerWaalsContact C-N 3.34Å; L38-K41 PolarHBondContact O-N 3.34Å; L38-W42 WeakPolarHBondContact O-CB 3.38Å; L38-W42 PolarHBondContact O-N 2.82Å; L38-I60 HydrophobicContact CD1-CG2 3.77Å; L38-I61 HydrophobicContact CB-CD1 3.84Å; L38-I61 HydrophobicContact CB-CG1 3.61Å; L38-I61 HydrophobicContact CD1-CG1 4.22Å; L38-I61 HydrophobicContact CG-CG1 4.49Å
39	K	77.9	Confident	73.7	Confident	105 Å²	105	64.1 Å²	64.1	46%	0.457	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-42.7	172.1	-173.8	-178.5	176	-170.9	0	111.7	K35 I37 W42 E43	K35-K39 WeakPolarHBondContact O-CB 3.28Å; K35-K39 PolarHBondContact O-N 3.14Å; I37-K39 VanDerWaalsContact C-N 3.34Å; I37-K39 PolarHBondContact O-N 2.87Å; K39-W42 WeakPolarHBondContact O-CB 3.37Å; K39-W42 PolarHBondContact O-N 3.16Å; K39-E43 VanDerWaalsContact CE-OE1 3.27Å; K39-E43 WeakPolarHBondContact CE-OE1 3.39Å; K39-E43 WeakPolarHBondContact O-CG 3.49Å; K39-E43 PolarHBondContact O-N 3.46Å
40	T	76.4	Confident	73.4	Confident	62 Å²	62	61.7 Å²	61.7	38%	0.38	31%	0.306	S	S	.	.	H	α-helix	trans	-64.5	-43.6	176.3	-51.8	0	0	0	0	111	L23 S36 I37 L38 W42 E43 V44	L23-T40 HydrophobicContact CD1-CG2 4.49Å; L23-T40 HydrophobicContact CD2-CG2 4.37Å; S36-T40 PolarHBondContact O-N 2.98Å; S36-T40 PolarHBondContact O-OG1 2.91Å; I37-T40 CarbonylContact O-C 3.51Å; I37-T40 WeakPolarHBondContact O-CB 3.13Å; I37-T40 PolarHBondContact O-N 3.4Å; I37-T40 VanDerWaalsContact O-N 3.12Å; L38-T40 VanDerWaalsContact C-N 3.34Å; T40-W42 VanDerWaalsContact C-N 3.27Å; T40-W42 PolarHBondContact O-N 3.27Å; T40-E43 PolarHBondContact O-N 3.41Å; T40-V44 WeakPolarHBondContact O-CG2 3.49Å; T40-V44 PolarHBondContact O-N 3.25Å
41	K	76.4	Confident	73.2	Confident	25 Å²	25	58 Å²	58	11%	0.109	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-42	174.2	-169.8	176.6	-176.2	173.7	0	110.6	L20 L23 E24 I37 L38 V44 L45 T57	L20-K41 HydrophobicContact CD2-CG 4.16Å; L23-K41 HydrophobicContact CD1-CB 4.47Å; E24-K41 IonicContact OE1-NZ 3.82Å; E24-K41 PolarHBondContact OE1-NZ 2.77Å; I37-K41 WeakPolarHBondContact O-CB 3.43Å; I37-K41 PolarHBondContact O-N 2.85Å; L38-K41 PolarHBondContact O-N 3.34Å; K41-V44 PolarHBondContact O-N 3.37Å; K41-L45 HydrophobicContact CG-CD1 3.88Å; K41-L45 HydrophobicContact CG-CG 4.38Å; K41-L45 VanDerWaalsContact O-CB 3.25Å; K41-L45 WeakPolarHBondContact O-CB 3.49Å; K41-L45 WeakPolarHBondContact O-CG 3.35Å; K41-L45 PolarHBondContact O-N 3.38Å; K41-T57 HydrophobicContact CD-CG2 3.83Å; K41-T57 HydrophobicContact CG-CG2 4.24Å
42	W	74.6	Confident	73.4	Confident	54 Å²	54	59.6 Å²	59.6	21%	0.205	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-43.4	176.7	-178.6	71	0	0	0	112.6	L38 K39 T40 V44 L45 L46 Y58 I61	L38-W42 WeakPolarHBondContact O-CB 3.38Å; L38-W42 PolarHBondContact O-N 2.82Å; K39-W42 WeakPolarHBondContact O-CB 3.37Å; K39-W42 PolarHBondContact O-N 3.16Å; T40-W42 VanDerWaalsContact C-N 3.27Å; T40-W42 PolarHBondContact O-N 3.27Å; W42-V44 PolarHBondContact O-N 2.95Å; W42-L45 PolarHBondContact O-N 2.88Å; W42-L46 HydrophobicContact CD2-CD1 3.71Å; W42-L46 HydrophobicContact CD2-CG 4.13Å; W42-L46 HydrophobicContact CE3-CD1 3.74Å; W42-L46 HydrophobicContact CH2-CD1 3.64Å; W42-L46 HydrophobicContact CZ2-CD1 3.59Å; W42-L46 HydrophobicContact CZ2-CD2 4.18Å; W42-L46 HydrophobicContact CZ2-CG 4.2Å; W42-L46 HydrophobicContact CZ3-CD1 3.71Å; W42-L46 WeakPolarHBondContact O-CB 3.43Å; W42-L46 VanDerWaalsContact O-CG 3.27Å; W42-L46 WeakPolarHBondContact O-CG 3.39Å; W42-L46 PolarHBondContact O-N 3.15Å; W42-Y58 HydrophobicContact CZ2-CD2 4.17Å; W42-Y58 HydrophobicContact CZ2-CE2 4.41Å; W42-Y58 AromaticContact NE1-CD2 3.83Å; W42-I61 HydrophobicContact CB-CD1 4.14Å
43	E	78.6	Confident	73.5	Confident	94 Å²	94	62 Å²	62	44%	0.439	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-43.6	175.6	-74.7	173.6	-173	0	0	111.9	K39 T40 L46	K39-E43 VanDerWaalsContact CE-OE1 3.27Å; K39-E43 WeakPolarHBondContact CE-OE1 3.39Å; K39-E43 WeakPolarHBondContact O-CG 3.49Å; K39-E43 PolarHBondContact O-N 3.46Å; T40-E43 PolarHBondContact O-N 3.41Å; E43-L46 PolarHBondContact O-N 2.9Å
44	V	78.4	Confident	73.3	Confident	27 Å²	27	57.2 Å²	57.2	16%	0.164	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-45.7	174.1	174	0	0	0	0	110.8	K16 L20 L23 T40 K41 W42 L46 E47 T48	K16-V44 HydrophobicContact CB-CG1 4.22Å; L20-V44 HydrophobicContact CD2-CG1 3.98Å; L20-V44 HydrophobicContact CG-CG1 4.45Å; L23-V44 HydrophobicContact CD1-CG2 4.29Å; T40-V44 WeakPolarHBondContact O-CG2 3.49Å; T40-V44 PolarHBondContact O-N 3.25Å; K41-V44 PolarHBondContact O-N 3.37Å; W42-V44 PolarHBondContact O-N 2.95Å; V44-L46 VanDerWaalsContact C-N 3.32Å; V44-L46 PolarHBondContact O-N 3.36Å; V44-E47 PolarHBondContact O-N 2.88Å; V44-T48 PolarHBondContact O-N 3.01Å
45	L	73	Confident	73.2	Confident	1 Å²	1	53 Å²	53	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-32.4	-178.9	-74.9	171.9	0	0	0	112.7	L20 K41 W42 E47 T48 M50 A54 T57	L20-L45 HydrophobicContact CD1-CD2 3.91Å; L20-L45 HydrophobicContact CD2-CD2 3.92Å; L20-L45 HydrophobicContact CD2-CG 4.06Å; K41-L45 HydrophobicContact CG-CD1 3.88Å; K41-L45 HydrophobicContact CG-CG 4.38Å; K41-L45 VanDerWaalsContact O-CB 3.25Å; K41-L45 WeakPolarHBondContact O-CB 3.49Å; K41-L45 WeakPolarHBondContact O-CG 3.35Å; K41-L45 PolarHBondContact O-N 3.38Å; W42-L45 PolarHBondContact O-N 2.88Å; L45-E47 PolarHBondContact O-N 3.49Å; L45-T48 WeakPolarHBondContact CA-OG1 3.39Å; L45-T48 CarbonylContact O-C 3.46Å; L45-T48 PolarHBondContact O-N 3.39Å; L45-T48 VanDerWaalsContact O-N 3.1Å; L45-T48 PolarHBondContact O-OG1 3.32Å; L45-M50 HydrophobicContact CD2-CB 4.25Å; L45-M50 HydrophobicContact CD2-CE 3.75Å; L45-A54 HydrophobicContact CB-CB 3.97Å; L45-T57 HydrophobicContact CD1-CG2 3.8Å
46	L	70.9	Confident	73.4	Confident	52 Å²	52	49.5 Å²	49.5	27%	0.272	25%	0.251	S	S	.	.	H	α-helix	trans	-64.1	-28.7	176.6	-82	173.8	0	0	0	113.4	W42 E43 V44 L70	W42-L46 HydrophobicContact CD2-CD1 3.71Å; W42-L46 HydrophobicContact CD2-CG 4.13Å; W42-L46 HydrophobicContact CE3-CD1 3.74Å; W42-L46 HydrophobicContact CH2-CD1 3.64Å; W42-L46 HydrophobicContact CZ2-CD1 3.59Å; W42-L46 HydrophobicContact CZ2-CD2 4.18Å; W42-L46 HydrophobicContact CZ2-CG 4.2Å; W42-L46 HydrophobicContact CZ3-CD1 3.71Å; W42-L46 WeakPolarHBondContact O-CB 3.43Å; W42-L46 VanDerWaalsContact O-CG 3.27Å; W42-L46 WeakPolarHBondContact O-CG 3.39Å; W42-L46 PolarHBondContact O-N 3.15Å; E43-L46 PolarHBondContact O-N 2.9Å; V44-L46 VanDerWaalsContact C-N 3.32Å; V44-L46 PolarHBondContact O-N 3.36Å; L46-L70 HydrophobicContact CD2-CD2 4.19Å
47	E	70.5	Confident	72.9	Confident	132 Å²	132	46.5 Å²	46.5	62%	0.617	23%	0.23	S	C	*	.	H	α-helix	trans	-83.7	-16.4	175.7	-64.6	-171.1	170.4	0	0	112.9	K16 V44 L45	K16-E47 HydrophobicContact CD-CB 4.02Å; K16-E47 WeakPolarHBondContact CE-OE2 3.39Å; K16-E47 IonicContact NZ-OE2 3.39Å; K16-E47 PolarHBondContact NZ-OE2 3.39Å; V44-E47 PolarHBondContact O-N 2.88Å; L45-E47 PolarHBondContact O-N 3.49Å
48	T	70.1	Confident	72.7	Confident	12 Å²	12	47.9 Å²	47.9	7%	0.074	24%	0.235	C	C	.	.	S	Bend	trans	-98.1	159.5	172.2	65.4	0	0	0	0	110.7	K16 V44 L45 M50	K16-T48 HydrophobicContact CB-CG2 3.93Å; K16-T48 HydrophobicContact CD-CG2 4.43Å; V44-T48 PolarHBondContact O-N 3.01Å; L45-T48 WeakPolarHBondContact CA-OG1 3.39Å; L45-T48 CarbonylContact O-C 3.46Å; L45-T48 PolarHBondContact O-N 3.39Å; L45-T48 VanDerWaalsContact O-N 3.1Å; L45-T48 PolarHBondContact O-OG1 3.32Å; T48-M50 VanDerWaalsContact C-N 3.26Å; T48-M50 PolarHBondContact O-N 2.9Å
49	S	66.7	Low	72.8	Confident	30 Å²	30	53 Å²	53	21%	0.21	25%	0.252	C	S	.	.	S	Bend	trans	-88.5	19.7	176.1	60.7	0	0	0	0	114.4	V51 D139 A140	S49-V51 WeakPolarHBondContact O-CG2 3.36Å; S49-V51 PolarHBondContact O-N 2.77Å; S49-D139 CarbonylContact C-O 3.57Å; S49-D139 PolarHBondContact N-O 3.05Å; S49-D139 WeakPolarHBondContact OG-CB 3.41Å; S49-D139 PolarHBondContact OG-O 3.47Å; S49-A140 PolarHBondContact OG-N 3.42Å
50	M	66.6	Low	72.6	Confident	25 Å²	25	52.7 Å²	52.7	12%	0.123	25%	0.254	C	S	.	.			trans	-79.9	66.7	172.3	-68.9	-173.1	-63.1	0	0	111.1	H17 L20 L45 T48 D52 Y53 A54	H17-M50 VanDerWaalsContact CE1-CE 3.43Å; H17-M50 WeakPolarHBondContact CE1-CE 3.38Å; H17-M50 VanDerWaalsContact ND1-CE 3.27Å; H17-M50 WeakPolarHBondContact ND1-CE 3.39Å; L20-M50 HydrophobicContact CD1-CE 3.2Å; L45-M50 HydrophobicContact CD2-CB 4.25Å; L45-M50 HydrophobicContact CD2-CE 3.75Å; T48-M50 VanDerWaalsContact C-N 3.26Å; T48-M50 PolarHBondContact O-N 2.9Å; M50-D52 VanDerWaalsContact C-N 3.28Å; M50-D52 PolarHBondContact O-N 3.45Å; M50-Y53 PolarHBondContact O-N 3.42Å; M50-A54 PolarHBondContact O-N 3.03Å
51	V	67.7	Low	72.2	Confident	13 Å²	13	51.3 Å²	51.3	8%	0.079	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-31.3	-170.3	-170	0	0	0	0	112.4	S49 A54 A55 L70 K73 R74 V77	S49-V51 WeakPolarHBondContact O-CG2 3.36Å; S49-V51 PolarHBondContact O-N 2.77Å; V51-A54 PolarHBondContact O-N 2.92Å; V51-A55 WeakPolarHBondContact O-CB 3.42Å; V51-A55 PolarHBondContact O-N 2.78Å; V51-L70 HydrophobicContact CG1-CB 4.32Å; V51-L70 HydrophobicContact CG1-CD2 4.08Å; V51-L70 VanDerWaalsContact CG1-O 3.27Å; V51-L70 WeakPolarHBondContact CG1-O 3.45Å; V51-K73 HydrophobicContact CG2-CB 4.45Å; V51-R74 HydrophobicContact CB-CB 4.23Å; V51-R74 HydrophobicContact CG1-CB 3.83Å; V51-V77 HydrophobicContact CG2-CG2 4.19Å
52	D	73.4	Confident	71.7	Confident	81 Å²	81	55.4 Å²	55.4	43%	0.433	26%	0.26	S	S	.	.	H	α-helix	trans	-70	-44.5	179.3	-68.5	-26.7	0	0	0	111.7	M50 A54 A55 D56 R74	M50-D52 VanDerWaalsContact C-N 3.28Å; M50-D52 PolarHBondContact O-N 3.45Å; D52-A54 VanDerWaalsContact C-N 3.32Å; D52-A54 PolarHBondContact O-N 2.95Å; D52-A55 WeakPolarHBondContact O-CB 3.37Å; D52-A55 PolarHBondContact O-N 2.72Å; D52-A55 VanDerWaalsContact O-N 3.17Å; D52-D56 PolarHBondContact O-N 3.28Å; D52-R74 IonicContact OD1-CZ 3.88Å; D52-R74 VanDerWaalsContact OD1-CZ 3.26Å; D52-R74 IonicContact OD1-NE 2.66Å; D52-R74 IonicContact OD1-NH1 3.95Å; D52-R74 PolarHBondContact OD1-NH1 3.44Å
53	Y	72.6	Confident	71	Confident	136 Å²	136	63 Å²	63	53%	0.533	29%	0.29	S	S	.	.	H	α-helix	trans	-64.2	-36.7	172.3	-103.7	-97.8	0	0	0	112.1	M50 A55 D56 T57	M50-Y53 PolarHBondContact O-N 3.42Å; Y53-A55 VanDerWaalsContact C-N 3.33Å; Y53-D56 PolarHBondContact O-N 3.41Å; Y53-T57 WeakPolarHBondContact O-CB 3.32Å; Y53-T57 WeakPolarHBondContact O-CG2 3.49Å; Y53-T57 PolarHBondContact O-N 2.79Å; Y53-T57 PolarHBondContact O-OG1 3.34Å
54	A	70.6	Confident	70.4	Confident	2 Å²	2	62.5 Å²	62.5	2%	0.017	29%	0.293	C	S	.	.	H	α-helix	trans	-64.2	-38.3	173.7	0	0	0	0	0	111.9	L45 M50 V51 D52 T57 Y58 L70	L45-A54 HydrophobicContact CB-CB 3.97Å; M50-A54 PolarHBondContact O-N 3.03Å; V51-A54 PolarHBondContact O-N 2.92Å; D52-A54 VanDerWaalsContact C-N 3.32Å; D52-A54 PolarHBondContact O-N 2.95Å; A54-T57 WeakPolarHBondContact CA-OG1 3.35Å; A54-T57 PolarHBondContact O-OG1 3.38Å; A54-Y58 WeakPolarHBondContact O-CB 3.26Å; A54-Y58 PolarHBondContact O-N 3.47Å; A54-L70 HydrophobicContact CB-CD2 4.22Å
55	A	69.7	Low	69.4	Low	12 Å²	12	69.1 Å²	69.1	10%	0.099	32%	0.323	C	S	.	.	H	α-helix	trans	-68.7	-41.3	177.1	0	0	0	0	0	111.7	V51 D52 Y53 Y58 R59 P66	V51-A55 WeakPolarHBondContact O-CB 3.42Å; V51-A55 PolarHBondContact O-N 2.78Å; D52-A55 WeakPolarHBondContact O-CB 3.37Å; D52-A55 PolarHBondContact O-N 2.72Å; D52-A55 VanDerWaalsContact O-N 3.17Å; Y53-A55 VanDerWaalsContact C-N 3.33Å; A55-Y58 PolarHBondContact O-N 2.96Å; A55-R59 VanDerWaalsContact O-CG 3.28Å; A55-R59 WeakPolarHBondContact O-CG 3.49Å; A55-R59 PolarHBondContact O-N 3.45Å; A55-P66 HydrophobicContact CB-CB 4.21Å; A55-P66 HydrophobicContact CB-CG 4.44Å
56	D	76.9	Confident	68.8	Low	76 Å²	76	70.1 Å²	70.1	41%	0.406	33%	0.329	S	S	.	.	H	α-helix	trans	-69.8	-40.7	178.3	-71	-23.5	0	0	0	112	D52 Y53 Y58 R59 I60	D52-D56 PolarHBondContact O-N 3.28Å; Y53-D56 PolarHBondContact O-N 3.41Å; D56-Y58 VanDerWaalsContact C-N 3.32Å; D56-Y58 PolarHBondContact O-N 3.26Å; D56-R59 WeakPolarHBondContact O-CB 3.34Å; D56-R59 PolarHBondContact O-N 3.45Å; D56-R59 IonicContact OD1-CZ 2.61Å; D56-R59 IonicContact OD1-NH1 2.86Å; D56-R59 PolarHBondContact OD1-NH1 3.5Å; D56-I60 WeakPolarHBondContact O-CD1 3.4Å; D56-I60 VanDerWaalsContact O-CG1 3.25Å; D56-I60 WeakPolarHBondContact O-CG1 3.36Å; D56-I60 PolarHBondContact O-N 3Å
57	T	67.9	Low	68.5	Low	5 Å²	5	70.2 Å²	70.2	3%	0.031	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-39.7	172.1	49.7	0	0	0	0	112	K41 L45 Y53 A54 I60 I61	K41-T57 HydrophobicContact CD-CG2 3.83Å; K41-T57 HydrophobicContact CG-CG2 4.24Å; L45-T57 HydrophobicContact CD1-CG2 3.8Å; Y53-T57 WeakPolarHBondContact O-CB 3.32Å; Y53-T57 WeakPolarHBondContact O-CG2 3.49Å; Y53-T57 PolarHBondContact O-N 2.79Å; Y53-T57 PolarHBondContact O-OG1 3.34Å; A54-T57 WeakPolarHBondContact CA-OG1 3.35Å; A54-T57 PolarHBondContact O-OG1 3.38Å; T57-I60 PolarHBondContact O-N 3.27Å; T57-I61 WeakPolarHBondContact O-CD1 3.48Å; T57-I61 VanDerWaalsContact O-CG1 3.23Å; T57-I61 WeakPolarHBondContact O-CG1 3.29Å; T57-I61 PolarHBondContact O-N 3.07Å
58	Y	72	Confident	68.2	Low	39 Å²	39	72.7 Å²	72.7	15%	0.153	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-42.3	174.4	-173.7	-89	0	0	0	112.5	W42 A54 A55 D56 I60 I61 Y62 P67	W42-Y58 HydrophobicContact CZ2-CD2 4.17Å; W42-Y58 HydrophobicContact CZ2-CE2 4.41Å; W42-Y58 AromaticContact NE1-CD2 3.83Å; A54-Y58 WeakPolarHBondContact O-CB 3.26Å; A54-Y58 PolarHBondContact O-N 3.47Å; A55-Y58 PolarHBondContact O-N 2.96Å; D56-Y58 VanDerWaalsContact C-N 3.32Å; D56-Y58 PolarHBondContact O-N 3.26Å; Y58-I60 VanDerWaalsContact C-N 3.28Å; Y58-I60 PolarHBondContact O-N 3.22Å; Y58-I61 PolarHBondContact O-N 3.26Å; Y58-Y62 HydrophobicContact CD1-CD2 4.34Å; Y58-Y62 AromaticContact CD2-CD2 3.55Å; Y58-Y62 HydrophobicContact CD2-CD2 3.55Å; Y58-Y62 AromaticContact CD2-CE2 3.82Å; Y58-Y62 HydrophobicContact CD2-CE2 3.82Å; Y58-Y62 HydrophobicContact CE1-CD2 4.11Å; Y58-Y62 HydrophobicContact CE1-CG 4.48Å; Y58-Y62 AromaticContact CE2-CD2 3.27Å; Y58-Y62 HydrophobicContact CE2-CD2 3.27Å; Y58-Y62 AromaticContact CE2-CE2 3.52Å; Y58-Y62 HydrophobicContact CE2-CE2 3.52Å; Y58-Y62 HydrophobicContact CE2-CG 4.2Å; Y58-Y62 HydrophobicContact CG-CD2 4.08Å; Y58-Y62 AromaticContact CZ-CD2 3.58Å; Y58-Y62 PolarHBondContact O-N 3.12Å; Y58-P67 VanDerWaalsContact CE1-CD 3.44Å; Y58-P67 HydrophobicContact CE2-CG 4.34Å
59	R	77.2	Confident	68.1	Low	130 Å²	130	74.3 Å²	74.3	49%	0.491	36%	0.361	S	S	.	.	H	α-helix	trans	-59.6	-40	175.3	-76	167.5	172.1	173.9	-5.3	111.7	A55 D56 Y63	A55-R59 VanDerWaalsContact O-CG 3.28Å; A55-R59 WeakPolarHBondContact O-CG 3.49Å; A55-R59 PolarHBondContact O-N 3.45Å; D56-R59 WeakPolarHBondContact O-CB 3.34Å; D56-R59 PolarHBondContact O-N 3.45Å; D56-R59 IonicContact OD1-CZ 2.61Å; D56-R59 IonicContact OD1-NH1 2.86Å; D56-R59 PolarHBondContact OD1-NH1 3.5Å; R59-Y63 VanDerWaalsContact O-CA 3.26Å; R59-Y63 WeakPolarHBondContact O-CA 3.19Å; R59-Y63 PolarHBondContact O-N 3.34Å
60	I	74.5	Confident	67.9	Low	98 Å²	98	73.4 Å²	73.4	50%	0.503	35%	0.353	S	S	.	.	H	α-helix	trans	-67	-39.6	177.3	-65.6	163.1	0	0	0	111.2	L38 D56 T57 Y58	L38-I60 HydrophobicContact CD1-CG2 3.77Å; D56-I60 WeakPolarHBondContact O-CD1 3.4Å; D56-I60 VanDerWaalsContact O-CG1 3.25Å; D56-I60 WeakPolarHBondContact O-CG1 3.36Å; D56-I60 PolarHBondContact O-N 3Å; T57-I60 PolarHBondContact O-N 3.27Å; Y58-I60 VanDerWaalsContact C-N 3.28Å; Y58-I60 PolarHBondContact O-N 3.22Å
61	I	67.9	Low	68	Low	33 Å²	33	76.3 Å²	76.3	17%	0.169	37%	0.369	C	S	.	.	H	α-helix	trans	-73.4	-47.6	-176.9	-63.9	161.3	0	0	0	111.9	L38 W42 T57 Y58	L38-I61 HydrophobicContact CB-CD1 3.84Å; L38-I61 HydrophobicContact CB-CG1 3.61Å; L38-I61 HydrophobicContact CD1-CG1 4.22Å; L38-I61 HydrophobicContact CG-CG1 4.49Å; W42-I61 HydrophobicContact CB-CD1 4.14Å; T57-I61 WeakPolarHBondContact O-CD1 3.48Å; T57-I61 VanDerWaalsContact O-CG1 3.23Å; T57-I61 WeakPolarHBondContact O-CG1 3.29Å; T57-I61 PolarHBondContact O-N 3.07Å; Y58-I61 PolarHBondContact O-N 3.26Å
62	Y	65.6	Low	68.3	Low	111 Å²	111	79.3 Å²	79.3	44%	0.435	38%	0.384	S	S	.	.	H	α-helix	trans	-108.4	-4.6	-167	-66.6	-74.4	0	0	0	114.2	Y58 T64	Y58-Y62 HydrophobicContact CD1-CD2 4.34Å; Y58-Y62 AromaticContact CD2-CD2 3.55Å; Y58-Y62 HydrophobicContact CD2-CD2 3.55Å; Y58-Y62 AromaticContact CD2-CE2 3.82Å; Y58-Y62 HydrophobicContact CD2-CE2 3.82Å; Y58-Y62 HydrophobicContact CE1-CD2 4.11Å; Y58-Y62 HydrophobicContact CE1-CG 4.48Å; Y58-Y62 AromaticContact CE2-CD2 3.27Å; Y58-Y62 HydrophobicContact CE2-CD2 3.27Å; Y58-Y62 AromaticContact CE2-CE2 3.52Å; Y58-Y62 HydrophobicContact CE2-CE2 3.52Å; Y58-Y62 HydrophobicContact CE2-CG 4.2Å; Y58-Y62 HydrophobicContact CG-CD2 4.08Å; Y58-Y62 AromaticContact CZ-CD2 3.58Å; Y58-Y62 PolarHBondContact O-N 3.12Å; Y62-T64 PolarHBondContact O-N 3.34Å; Y62-T64 PolarHBondContact O-OG1 2.83Å
63	Y	61.3	Low	68.2	Low	215 Å²	215	80.1 Å²	80.1	84%	0.843	38%	0.384	S	S	*	.	S	Bend	trans	49.4	23.9	-173.1	-58.7	-83.1	0	0	0	113.3	R59	R59-Y63 VanDerWaalsContact O-CA 3.26Å; R59-Y63 WeakPolarHBondContact O-CA 3.19Å; R59-Y63 PolarHBondContact O-N 3.34Å
64	T	65.1	Low	68.3	Low	82 Å²	82	78.8 Å²	78.8	50%	0.503	38%	0.378	S	S	.	.	S	Bend	trans	-125	149.3	-172.2	-55.4	0	0	0	0	108.7	Y62	Y62-T64 PolarHBondContact O-N 3.34Å; Y62-T64 PolarHBondContact O-OG1 2.83Å
65	E	57.6	Low	68.6	Low	167 Å²	167	84.5 Å²	84.5	78%	0.78	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-57	145.1	175.4	-70.3	-175.6	170.4	0	0	111.8
66	P	60	Low	69.1	Low	22 Å²	22	89 Å²	89	14%	0.143	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-59.4	138	-177.7	24.3	-33.9	0	0	0	110.9	A55 L70	A55-P66 HydrophobicContact CB-CB 4.21Å; A55-P66 HydrophobicContact CB-CG 4.44Å; P66-L70 HydrophobicContact CB-CB 4.49Å; P66-L70 HydrophobicContact CB-CD1 3.97Å
67	P	65.4	Low	68.9	Low	54 Å²	54	86.9 Å²	86.9	35%	0.351	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-56.2	142.8	176.5	18.3	-31.7	0	0	0	111.3	Y58 G69 L70	Y58-P67 VanDerWaalsContact CE1-CD 3.44Å; Y58-P67 HydrophobicContact CE2-CG 4.34Å; P67-G69 PolarHBondContact O-N 3.12Å; P67-L70 HydrophobicContact CG-CD1 3.83Å; P67-L70 HydrophobicContact CG-CG 4.36Å; P67-L70 WeakPolarHBondContact O-CB 3.38Å; P67-L70 PolarHBondContact O-N 2.82Å
68	K	63.4	Low	69.4	Low	184 Å²	184	90.5 Å²	90.5	80%	0.8	43%	0.43	S	S	*	.	H	α-helix	trans	-51.3	-25.3	179.6	-66	-176.7	179.1	-178	0	113.8	L70 L71 D72	K68-L70 VanDerWaalsContact C-N 3.32Å; K68-L70 PolarHBondContact O-N 2.96Å; K68-L71 PolarHBondContact O-N 3Å; K68-D72 PolarHBondContact O-N 2.81Å; K68-D72 VanDerWaalsContact O-N 3.14Å
69	G	68	Low	69.8	Low	46 Å²	46	94 Å²	94	47%	0.474	45%	0.448	S	S	.	.	H	α-helix	trans	-65.1	-27.5	174.1	0	0	0	0	0	114.9	P67 K73	P67-G69 PolarHBondContact O-N 3.12Å; G69-K73 WeakPolarHBondContact O-CG 3.32Å; G69-K73 PolarHBondContact O-N 3.45Å; G69-K73 VanDerWaalsContact O-N 3.17Å
70	L	63	Low	69.6	Low	10 Å²	10	90.2 Å²	90.2	5%	0.052	44%	0.441	C	S	.	.	H	α-helix	trans	-73.9	-34	172.2	-77.2	161.6	0	0	0	111.3	L46 V51 A54 P66 P67 K68 K73 R74	L46-L70 HydrophobicContact CD2-CD2 4.19Å; V51-L70 HydrophobicContact CG1-CB 4.32Å; V51-L70 HydrophobicContact CG1-CD2 4.08Å; V51-L70 VanDerWaalsContact CG1-O 3.27Å; V51-L70 WeakPolarHBondContact CG1-O 3.45Å; A54-L70 HydrophobicContact CB-CD2 4.22Å; P66-L70 HydrophobicContact CB-CB 4.49Å; P66-L70 HydrophobicContact CB-CD1 3.97Å; P67-L70 HydrophobicContact CG-CD1 3.83Å; P67-L70 HydrophobicContact CG-CG 4.36Å; P67-L70 WeakPolarHBondContact O-CB 3.38Å; P67-L70 PolarHBondContact O-N 2.82Å; K68-L70 VanDerWaalsContact C-N 3.32Å; K68-L70 PolarHBondContact O-N 2.96Å; L70-K73 PolarHBondContact O-N 2.97Å; L70-R74 WeakPolarHBondContact O-CB 3.31Å; L70-R74 PolarHBondContact O-N 3.13Å
71	L	67.7	Low	69.5	Low	86 Å²	86	87.1 Å²	87.1	45%	0.45	43%	0.426	S	S	.	.	H	α-helix	trans	-67.8	-42.9	176.5	-65.2	174.4	0	0	0	111.5	K68 K73 R74 E75	K68-L71 PolarHBondContact O-N 3Å; L71-K73 VanDerWaalsContact C-N 3.34Å; L71-K73 PolarHBondContact O-N 3.01Å; L71-R74 WeakPolarHBondContact O-CB 3.39Å; L71-R74 PolarHBondContact O-N 3.42Å; L71-R74 VanDerWaalsContact O-N 3.14Å; L71-E75 PolarHBondContact O-N 2.78Å
72	D	75	Confident	70	Confident	76 Å²	76	91.5 Å²	91.5	41%	0.406	45%	0.445	S	S	.	.	H	α-helix	trans	-62.9	-40	173.9	177.9	40.7	0	0	0	111.8	K68 R74 E75 K76	K68-D72 PolarHBondContact O-N 2.81Å; K68-D72 VanDerWaalsContact O-N 3.14Å; D72-R74 VanDerWaalsContact C-N 3.34Å; D72-R74 PolarHBondContact O-N 3.34Å; D72-E75 PolarHBondContact O-N 3.08Å; D72-K76 VanDerWaalsContact CG-NZ 3.35Å; D72-K76 WeakPolarHBondContact O-CG 3.34Å; D72-K76 PolarHBondContact O-N 2.96Å; D72-K76 VanDerWaalsContact OD1-CE 3.31Å; D72-K76 WeakPolarHBondContact OD1-CE 3.44Å; D72-K76 IonicContact OD1-NZ 2.73Å; D72-K76 PolarHBondContact OD1-NZ 3.18Å; D72-K76 IonicContact OD2-NZ 2.92Å; D72-K76 PolarHBondContact OD2-NZ 3.41Å
73	K	71.1	Confident	70.6	Confident	98 Å²	98	91.9 Å²	91.9	43%	0.426	45%	0.451	S	S	.	.	H	α-helix	trans	-62.4	-40.8	171.8	-79.1	-175.3	174.9	-169.1	0	112.1	V51 G69 L70 L71 K76 V77	V51-K73 HydrophobicContact CG2-CB 4.45Å; G69-K73 WeakPolarHBondContact O-CG 3.32Å; G69-K73 PolarHBondContact O-N 3.45Å; G69-K73 VanDerWaalsContact O-N 3.17Å; L70-K73 PolarHBondContact O-N 2.97Å; L71-K73 VanDerWaalsContact C-N 3.34Å; L71-K73 PolarHBondContact O-N 3.01Å; K73-K76 PolarHBondContact O-N 2.77Å; K73-V77 WeakPolarHBondContact O-CB 3.38Å; K73-V77 WeakPolarHBondContact O-CG2 3.46Å; K73-V77 PolarHBondContact O-N 3.23Å
74	R	73.7	Confident	71.1	Confident	108 Å²	108	82.3 Å²	82.3	41%	0.408	42%	0.415	S	S	.	.	H	α-helix	trans	-61.7	-46.2	177.5	-177.3	176.5	165.1	159.7	-5.8	111.1	V51 D52 L70 L71 D72 V77 L78	V51-R74 HydrophobicContact CB-CB 4.23Å; V51-R74 HydrophobicContact CG1-CB 3.83Å; D52-R74 IonicContact OD1-CZ 3.88Å; D52-R74 VanDerWaalsContact OD1-CZ 3.26Å; D52-R74 IonicContact OD1-NE 2.66Å; D52-R74 IonicContact OD1-NH1 3.95Å; D52-R74 PolarHBondContact OD1-NH1 3.44Å; L70-R74 WeakPolarHBondContact O-CB 3.31Å; L70-R74 PolarHBondContact O-N 3.13Å; L71-R74 WeakPolarHBondContact O-CB 3.39Å; L71-R74 PolarHBondContact O-N 3.42Å; L71-R74 VanDerWaalsContact O-N 3.14Å; D72-R74 VanDerWaalsContact C-N 3.34Å; D72-R74 PolarHBondContact O-N 3.34Å; R74-V77 PolarHBondContact O-N 3.3Å; R74-L78 HydrophobicContact CG-CD1 4.04Å; R74-L78 HydrophobicContact CG-CG 4.46Å; R74-L78 WeakPolarHBondContact O-CB 3.33Å; R74-L78 VanDerWaalsContact O-CG 3.3Å; R74-L78 WeakPolarHBondContact O-CG 3.44Å; R74-L78 PolarHBondContact O-N 3.34Å
75	E	77.8	Confident	71.3	Confident	123 Å²	123	82 Å²	82	58%	0.575	41%	0.408	S	S	*	.	H	α-helix	trans	-60.6	-47.2	177.5	-73.7	178.1	178.6	0	0	111.2	L71 D72 V77 L78 E79	L71-E75 PolarHBondContact O-N 2.78Å; D72-E75 PolarHBondContact O-N 3.08Å; E75-V77 VanDerWaalsContact C-N 3.32Å; E75-V77 PolarHBondContact O-N 3.19Å; E75-L78 PolarHBondContact O-N 3.49Å; E75-L78 VanDerWaalsContact O-N 3.17Å; E75-E79 WeakPolarHBondContact O-CB 3.45Å; E75-E79 WeakPolarHBondContact O-CG 3.21Å; E75-E79 PolarHBondContact O-N 3.17Å
76	K	79.1	Confident	72.1	Confident	107 Å²	107	78.2 Å²	78.2	47%	0.465	40%	0.396	S	S	.	.	H	α-helix	trans	-59.4	-39.7	176	-74	168.1	178.9	158.9	0	113.7	D72 K73 S80	D72-K76 VanDerWaalsContact CG-NZ 3.35Å; D72-K76 WeakPolarHBondContact O-CG 3.34Å; D72-K76 PolarHBondContact O-N 2.96Å; D72-K76 VanDerWaalsContact OD1-CE 3.31Å; D72-K76 WeakPolarHBondContact OD1-CE 3.44Å; D72-K76 IonicContact OD1-NZ 2.73Å; D72-K76 PolarHBondContact OD1-NZ 3.18Å; D72-K76 IonicContact OD2-NZ 2.92Å; D72-K76 PolarHBondContact OD2-NZ 3.41Å; K73-K76 PolarHBondContact O-N 2.77Å; K76-S80 WeakPolarHBondContact O-CB 3.49Å; K76-S80 PolarHBondContact O-N 3Å; K76-S80 PolarHBondContact O-OG 2.93Å
77	V	73.7	Confident	72.4	Confident	31 Å²	31	82.6 Å²	82.6	19%	0.188	41%	0.413	C	S	.	.	H	α-helix	trans	-68.6	-42.5	177.4	171.3	0	0	0	0	110.2	V51 K73 R74 E75 S80 I81	V51-V77 HydrophobicContact CG2-CG2 4.19Å; K73-V77 WeakPolarHBondContact O-CB 3.38Å; K73-V77 WeakPolarHBondContact O-CG2 3.46Å; K73-V77 PolarHBondContact O-N 3.23Å; R74-V77 PolarHBondContact O-N 3.3Å; E75-V77 VanDerWaalsContact C-N 3.32Å; E75-V77 PolarHBondContact O-N 3.19Å; V77-S80 PolarHBondContact O-N 3.11Å; V77-I81 HydrophobicContact CG1-CD1 3.91Å; V77-I81 VanDerWaalsContact O-CG1 3.27Å; V77-I81 WeakPolarHBondContact O-CG1 3.35Å; V77-I81 PolarHBondContact O-N 3.07Å
78	L	77.4	Confident	72.2	Confident	80 Å²	80	80.2 Å²	80.2	42%	0.419	40%	0.397	S	S	.	.	H	α-helix	trans	-64.2	-41.3	175.8	-71.7	172.8	0	0	0	112.1	R74 E75 I81 Q82	R74-L78 HydrophobicContact CG-CD1 4.04Å; R74-L78 HydrophobicContact CG-CG 4.46Å; R74-L78 WeakPolarHBondContact O-CB 3.33Å; R74-L78 VanDerWaalsContact O-CG 3.3Å; R74-L78 WeakPolarHBondContact O-CG 3.44Å; R74-L78 PolarHBondContact O-N 3.34Å; E75-L78 PolarHBondContact O-N 3.49Å; E75-L78 VanDerWaalsContact O-N 3.17Å; L78-I81 PolarHBondContact O-N 2.62Å; L78-Q82 WeakPolarHBondContact O-CB 3.44Å; L78-Q82 VanDerWaalsContact O-CG 3.32Å; L78-Q82 WeakPolarHBondContact O-CG 3.48Å; L78-Q82 PolarHBondContact O-N 3.43Å
79	E	80.8	Confident	72.2	Confident	113 Å²	113	77.5 Å²	77.5	53%	0.528	39%	0.385	S	S	.	.	H	α-helix	trans	-59.6	-46.7	172.5	-74.5	176.7	170.7	0	0	110.8	E75 I81 Q82 E83	E75-E79 WeakPolarHBondContact O-CB 3.45Å; E75-E79 WeakPolarHBondContact O-CG 3.21Å; E75-E79 PolarHBondContact O-N 3.17Å; E79-I81 VanDerWaalsContact C-N 3.33Å; E79-I81 PolarHBondContact O-N 2.94Å; E79-Q82 PolarHBondContact O-N 2.89Å; E79-Q82 VanDerWaalsContact O-N 3.15Å; E79-E83 WeakPolarHBondContact O-CG 3.47Å; E79-E83 PolarHBondContact O-N 3.45Å
80	S	73.2	Confident	71.8	Confident	50 Å²	50	78.5 Å²	78.5	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-60.9	-40.9	177.6	-58.5	0	0	0	0	112	K76 V77 T84	K76-S80 WeakPolarHBondContact O-CB 3.49Å; K76-S80 PolarHBondContact O-N 3Å; K76-S80 PolarHBondContact O-OG 2.93Å; V77-S80 PolarHBondContact O-N 3.11Å; S80-T84 WeakPolarHBondContact O-CB 3.35Å; S80-T84 PolarHBondContact O-N 2.82Å; S80-T84 PolarHBondContact O-OG1 3.47Å
81	I	73.8	Confident	71.5	Confident	34 Å²	34	78.3 Å²	78.3	17%	0.174	38%	0.382	C	S	.	.	H	α-helix	trans	-64.6	-44.5	175.1	-68.3	164	0	0	0	110.3	V77 L78 E79 T84 E85 V136 A140	V77-I81 HydrophobicContact CG1-CD1 3.91Å; V77-I81 VanDerWaalsContact O-CG1 3.27Å; V77-I81 WeakPolarHBondContact O-CG1 3.35Å; V77-I81 PolarHBondContact O-N 3.07Å; L78-I81 PolarHBondContact O-N 2.62Å; E79-I81 VanDerWaalsContact C-N 3.33Å; E79-I81 PolarHBondContact O-N 2.94Å; I81-T84 WeakPolarHBondContact O-CB 3.42Å; I81-T84 PolarHBondContact O-N 3.33Å; I81-E85 HydrophobicContact CG2-CG 4.4Å; I81-E85 WeakPolarHBondContact O-CB 3.46Å; I81-E85 WeakPolarHBondContact O-CG 3.46Å; I81-E85 PolarHBondContact O-N 3.27Å; I81-V136 HydrophobicContact CG1-CG1 3.75Å; I81-A140 HydrophobicContact CD1-CB 3.83Å; I81-A140 HydrophobicContact CG1-CB 4.44Å
82	Q	76.7	Confident	70.9	Confident	124 Å²	124	78.8 Å²	78.8	58%	0.579	38%	0.381	S	S	*	.	H	α-helix	trans	-65.7	-43.9	179.5	-73.9	179.3	8.4	0	0	112.4	L78 E79 T84 E85 V86	L78-Q82 WeakPolarHBondContact O-CB 3.44Å; L78-Q82 VanDerWaalsContact O-CG 3.32Å; L78-Q82 WeakPolarHBondContact O-CG 3.48Å; L78-Q82 PolarHBondContact O-N 3.43Å; E79-Q82 PolarHBondContact O-N 2.89Å; E79-Q82 VanDerWaalsContact O-N 3.15Å; Q82-T84 VanDerWaalsContact C-N 3.28Å; Q82-T84 PolarHBondContact O-N 2.9Å; Q82-E85 PolarHBondContact O-N 2.63Å; Q82-V86 VanDerWaalsContact O-CG2 3.25Å; Q82-V86 WeakPolarHBondContact O-CG2 3.33Å; Q82-V86 PolarHBondContact O-N 3.49Å
83	E	79.4	Confident	69.8	Low	119 Å²	119	80.6 Å²	80.6	56%	0.556	40%	0.395	S	S	*	.	H	α-helix	trans	-58.8	-44.4	174.2	-74.4	-174.8	177.6	0	0	111.1	E79 V86 K87	E79-E83 WeakPolarHBondContact O-CG 3.47Å; E79-E83 PolarHBondContact O-N 3.45Å; E83-V86 PolarHBondContact O-N 2.91Å; E83-K87 WeakPolarHBondContact O-CG 3.3Å; E83-K87 PolarHBondContact O-N 3.27Å
84	T	70.7	Confident	68.8	Low	15 Å²	15	76.8 Å²	76.8	9%	0.092	38%	0.379	C	S	.	.	H	α-helix	trans	-62.4	-47.1	177	-63.1	0	0	0	0	111.2	S80 I81 Q82 V86 K87 L88 A133 F137	S80-T84 WeakPolarHBondContact O-CB 3.35Å; S80-T84 PolarHBondContact O-N 2.82Å; S80-T84 PolarHBondContact O-OG1 3.47Å; I81-T84 WeakPolarHBondContact O-CB 3.42Å; I81-T84 PolarHBondContact O-N 3.33Å; Q82-T84 VanDerWaalsContact C-N 3.28Å; Q82-T84 PolarHBondContact O-N 2.9Å; T84-V86 VanDerWaalsContact C-N 3.31Å; T84-V86 PolarHBondContact O-N 3.33Å; T84-K87 PolarHBondContact O-N 3.15Å; T84-L88 HydrophobicContact CG2-CD1 3.75Å; T84-L88 HydrophobicContact CG2-CG 4.45Å; T84-L88 WeakPolarHBondContact O-CB 3.15Å; T84-L88 WeakPolarHBondContact O-CD1 3.23Å; T84-L88 WeakPolarHBondContact O-CG 3.43Å; T84-L88 PolarHBondContact O-N 3.46Å; T84-A133 HydrophobicContact CG2-CB 3.35Å; T84-F137 HydrophobicContact CG2-CE2 4.15Å; T84-F137 HydrophobicContact CG2-CZ 4.28Å
85	E	70.5	Confident	67.7	Low	76 Å²	76	73.2 Å²	73.2	36%	0.355	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-38.6	176	-77.1	-169.3	160.9	0	0	112.4	I81 Q82 L88 K89 F137	I81-E85 HydrophobicContact CG2-CG 4.4Å; I81-E85 WeakPolarHBondContact O-CB 3.46Å; I81-E85 WeakPolarHBondContact O-CG 3.46Å; I81-E85 PolarHBondContact O-N 3.27Å; Q82-E85 PolarHBondContact O-N 2.63Å; E85-L88 CarbonylContact O-C 3.44Å; E85-L88 PolarHBondContact O-N 2.87Å; E85-K89 WeakPolarHBondContact O-CG 3.33Å; E85-K89 PolarHBondContact O-N 3.41Å; E85-F137 HydrophobicContact CG-CZ 4.27Å
86	V	73.4	Confident	66.2	Low	87 Å²	87	70 Å²	70	53%	0.527	36%	0.357	S	S	.	.	H	α-helix	trans	-64.1	-43.3	175.7	171.3	0	0	0	0	110.8	Q82 E83 T84 L88 K89 P90	Q82-V86 VanDerWaalsContact O-CG2 3.25Å; Q82-V86 WeakPolarHBondContact O-CG2 3.33Å; Q82-V86 PolarHBondContact O-N 3.49Å; E83-V86 PolarHBondContact O-N 2.91Å; T84-V86 VanDerWaalsContact C-N 3.31Å; T84-V86 PolarHBondContact O-N 3.33Å; V86-L88 VanDerWaalsContact C-N 3.25Å; V86-L88 PolarHBondContact O-N 3.01Å; V86-K89 PolarHBondContact O-N 2.97Å; V86-P90 WeakPolarHBondContact O-CD 3.43Å
87	K	66	Low	64.7	Low	114 Å²	114	72.9 Å²	72.9	50%	0.496	37%	0.372	S	S	.	.	H	α-helix	trans	-65	-28.4	174.2	-70.4	176.2	-176.7	-178.9	0	112.9	E83 T84 P90	E83-K87 WeakPolarHBondContact O-CG 3.3Å; E83-K87 PolarHBondContact O-N 3.27Å; T84-K87 PolarHBondContact O-N 3.15Å; K87-P90 VanDerWaalsContact O-CD 3.32Å; K87-P90 WeakPolarHBondContact O-CD 3.3Å
88	L	62	Low	63.3	Low	3 Å²	3	78.4 Å²	78.4	2%	0.016	40%	0.396	C	S	.	.	H	α-helix	trans	-87.8	-15.3	178.7	-69	164	0	0	0	114.4	T84 E85 V86 P90 V91 K92 A133 F137 Y149	T84-L88 HydrophobicContact CG2-CD1 3.75Å; T84-L88 HydrophobicContact CG2-CG 4.45Å; T84-L88 WeakPolarHBondContact O-CB 3.15Å; T84-L88 WeakPolarHBondContact O-CD1 3.23Å; T84-L88 WeakPolarHBondContact O-CG 3.43Å; T84-L88 PolarHBondContact O-N 3.46Å; E85-L88 CarbonylContact O-C 3.44Å; E85-L88 PolarHBondContact O-N 2.87Å; V86-L88 VanDerWaalsContact C-N 3.25Å; V86-L88 PolarHBondContact O-N 3.01Å; L88-P90 VanDerWaalsContact C-CD 3.45Å; L88-V91 HydrophobicContact CD2-CB 4.33Å; L88-V91 HydrophobicContact CD2-CG1 4.38Å; L88-V91 CarbonylContact O-C 3.58Å; L88-V91 WeakPolarHBondContact O-CA 3.41Å; L88-V91 WeakPolarHBondContact O-CB 3.26Å; L88-V91 PolarHBondContact O-N 2.92Å; L88-K92 PolarHBondContact O-N 3.19Å; L88-A133 HydrophobicContact CD1-CB 3.7Å; L88-A133 HydrophobicContact CD2-CB 3.93Å; L88-A133 HydrophobicContact CG-CB 4.09Å; L88-F137 HydrophobicContact CD1-CE2 3.41Å; L88-F137 VanDerWaalsContact CD1-CE2 3.41Å; L88-F137 HydrophobicContact CD1-CZ 3.72Å; L88-Y149 HydrophobicContact CD1-CE2 4.41Å; L88-Y149 HydrophobicContact CD2-CE1 4.1Å
89	K	62.7	Low	62	Low	128 Å²	128	74.7 Å²	74.7	56%	0.557	38%	0.377	S	S	*	.	H	α-helix	trans	-54.1	-43.9	176.6	-80.8	169.8	-170.6	176.4	0	113.1	E85 V86 V91 V93	E85-K89 WeakPolarHBondContact O-CG 3.33Å; E85-K89 PolarHBondContact O-N 3.41Å; V86-K89 PolarHBondContact O-N 2.97Å; K89-V91 VanDerWaalsContact C-N 3.31Å; K89-V91 PolarHBondContact O-N 2.96Å; K89-V93 VanDerWaalsContact O-CG2 3.3Å; K89-V93 WeakPolarHBondContact O-CG2 3.36Å; K89-V93 PolarHBondContact O-N 2.98Å
90	P	59.2	Low	60.3	Low	67 Å²	67	75 Å²	75	44%	0.435	38%	0.38	S	S	.	.	H	α-helix	trans	-61.2	-41	172.2	-17.4	29.1	0	0	0	111.8	V86 K87 L88 V93 I94	V86-P90 WeakPolarHBondContact O-CD 3.43Å; K87-P90 VanDerWaalsContact O-CD 3.32Å; K87-P90 WeakPolarHBondContact O-CD 3.3Å; L88-P90 VanDerWaalsContact C-CD 3.45Å; P90-V93 PolarHBondContact O-N 3.35Å; P90-I94 WeakPolarHBondContact O-CD1 3.36Å; P90-I94 VanDerWaalsContact O-CG1 3.22Å; P90-I94 WeakPolarHBondContact O-CG1 3.47Å; P90-I94 PolarHBondContact O-N 2.9Å; P90-I94 VanDerWaalsContact O-N 3.12Å
91	V	58.3	Low	59.2	Low	5 Å²	5	79.6 Å²	79.6	3%	0.03	39%	0.393	C	S	.	.	H	α-helix	trans	-66.9	-43	-178.8	174.1	0	0	0	0	112.1	L88 K89 V93 I94 F95 M130	L88-V91 HydrophobicContact CD2-CB 4.33Å; L88-V91 HydrophobicContact CD2-CG1 4.38Å; L88-V91 CarbonylContact O-C 3.58Å; L88-V91 WeakPolarHBondContact O-CA 3.41Å; L88-V91 WeakPolarHBondContact O-CB 3.26Å; L88-V91 PolarHBondContact O-N 2.92Å; K89-V91 VanDerWaalsContact C-N 3.31Å; K89-V91 PolarHBondContact O-N 2.96Å; V91-V93 VanDerWaalsContact C-N 3.28Å; V91-V93 PolarHBondContact O-N 3.3Å; V91-I94 WeakPolarHBondContact O-CB 3.34Å; V91-I94 PolarHBondContact O-N 3.27Å; V91-I94 VanDerWaalsContact O-N 3.13Å; V91-F95 HydrophobicContact CG1-CD2 3.92Å; V91-F95 HydrophobicContact CG1-CE2 4.35Å; V91-F95 WeakPolarHBondContact O-CD2 3.38Å; V91-F95 PolarHBondContact O-N 3.01Å; V91-M130 HydrophobicContact CB-CE 4.36Å; V91-M130 HydrophobicContact CG1-CE 3.13Å; V91-M130 HydrophobicContact CG1-CG 4.42Å; V91-M130 HydrophobicContact CG2-CE 4.34Å
92	K	53.9	Low	57.7	Low	96 Å²	96	81.7 Å²	81.7	42%	0.417	40%	0.402	S	S	.	.	H	α-helix	trans	-64.4	-32.6	176.4	-74.3	-176.3	178.2	-179.5	0	112.3	L88 I94 F95 Y149	L88-K92 PolarHBondContact O-N 3.19Å; K92-I94 VanDerWaalsContact C-N 3.34Å; K92-F95 CarbonylContact O-C 3.14Å; K92-F95 PolarHBondContact O-N 2.91Å; K92-Y149 WeakPolarHBondContact CE-OH 3.12Å
93	V	53	Low	56.5	Low	115 Å²	115	76.5 Å²	76.5	70%	0.697	38%	0.379	S	S	*	.	H	α-helix	trans	-71	-33.3	174.6	173.8	0	0	0	0	111.1	K89 P90 V91	K89-V93 VanDerWaalsContact O-CG2 3.3Å; K89-V93 WeakPolarHBondContact O-CG2 3.36Å; K89-V93 PolarHBondContact O-N 2.98Å; P90-V93 PolarHBondContact O-N 3.35Å; V91-V93 VanDerWaalsContact C-N 3.28Å; V91-V93 PolarHBondContact O-N 3.3Å
94	I	49.1	Very low	55.1	Low	17 Å²	17	74.7 Å²	74.7	9%	0.087	38%	0.384	C	S	.	.	H	α-helix	trans	-72.2	-35.3	173.7	-63.5	165.5	0	0	0	110.9	P90 V91 K92 S96 T99 Y120	P90-I94 WeakPolarHBondContact O-CD1 3.36Å; P90-I94 VanDerWaalsContact O-CG1 3.22Å; P90-I94 WeakPolarHBondContact O-CG1 3.47Å; P90-I94 PolarHBondContact O-N 2.9Å; P90-I94 VanDerWaalsContact O-N 3.12Å; V91-I94 WeakPolarHBondContact O-CB 3.34Å; V91-I94 PolarHBondContact O-N 3.27Å; V91-I94 VanDerWaalsContact O-N 3.13Å; K92-I94 VanDerWaalsContact C-N 3.34Å; I94-S96 VanDerWaalsContact C-N 3.3Å; I94-S96 PolarHBondContact O-N 2.82Å; I94-T99 VanDerWaalsContact O-CG2 3.25Å; I94-T99 WeakPolarHBondContact O-CG2 3.15Å; I94-T99 PolarHBondContact O-OG1 3.46Å; I94-Y120 HydrophobicContact CB-CD1 4.15Å; I94-Y120 HydrophobicContact CB-CE1 4.25Å; I94-Y120 HydrophobicContact CD1-CD1 4.18Å; I94-Y120 HydrophobicContact CD1-CG 4.45Å; I94-Y120 HydrophobicContact CG1-CD1 3.58Å; I94-Y120 HydrophobicContact CG1-CE1 3.99Å; I94-Y120 HydrophobicContact CG1-CG 4.17Å; I94-Y120 HydrophobicContact CG2-CD1 3.72Å; I94-Y120 HydrophobicContact CG2-CD2 3.82Å; I94-Y120 HydrophobicContact CG2-CE1 3.91Å; I94-Y120 HydrophobicContact CG2-CE2 4.03Å; I94-Y120 HydrophobicContact CG2-CG 3.64Å
95	F	51.5	Low	53.9	Low	34 Å²	34	81.6 Å²	81.6	15%	0.149	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	43.3	177.2	-81.9	-82.8	0	0	0	114.5	V91 K92 T99 M130 I152 L156	V91-F95 HydrophobicContact CG1-CD2 3.92Å; V91-F95 HydrophobicContact CG1-CE2 4.35Å; V91-F95 WeakPolarHBondContact O-CD2 3.38Å; V91-F95 PolarHBondContact O-N 3.01Å; K92-F95 CarbonylContact O-C 3.14Å; K92-F95 PolarHBondContact O-N 2.91Å; F95-T99 VanDerWaalsContact CA-OG1 3.3Å; F95-T99 WeakPolarHBondContact CA-OG1 3.32Å; F95-M130 HydrophobicContact CD2-CE 4.19Å; F95-M130 HydrophobicContact CE2-CE 3.59Å; F95-M130 HydrophobicContact CZ-CE 4.43Å; F95-I152 HydrophobicContact CD1-CD1 3.62Å; F95-I152 HydrophobicContact CD1-CG1 4.15Å; F95-I152 HydrophobicContact CD1-CG2 4.43Å; F95-I152 HydrophobicContact CE1-CB 4.3Å; F95-I152 HydrophobicContact CE1-CD1 3.75Å; F95-I152 HydrophobicContact CE1-CG1 3.8Å; F95-I152 HydrophobicContact CE1-CG2 3.51Å; F95-I152 HydrophobicContact CE2-CG2 3.85Å; F95-I152 HydrophobicContact CG-CD1 4.04Å; F95-I152 HydrophobicContact CZ-CB 4.37Å; F95-I152 HydrophobicContact CZ-CD1 4.29Å; F95-I152 HydrophobicContact CZ-CG1 4.34Å; F95-I152 HydrophobicContact CZ-CG2 3.18Å; F95-L156 HydrophobicContact CZ-CD1 4.43Å
96	S	45.5	Very low	52.2	Low	54 Å²	54	80.7 Å²	80.7	38%	0.378	42%	0.417	S	S	.	.	S	Bend	trans	-73.6	160.1	166.9	59.2	0	0	0	0	110.9	I94 E98 T99	I94-S96 VanDerWaalsContact C-N 3.3Å; I94-S96 PolarHBondContact O-N 2.82Å; S96-E98 PolarHBondContact O-N 3.29Å; S96-T99 PolarHBondContact O-N 3.05Å; S96-T99 PolarHBondContact O-OG1 3.03Å
97	Q	47.8	Very low	51.2	Low	169 Å²	169	86.5 Å²	86.5	79%	0.79	44%	0.435	S	S	*	.	H	α-helix	trans	-48	-17	-171.7	-71.1	-179.9	-14.9	0	0	116.1
98	E	44	Very low	50	Low	147 Å²	147	85.6 Å²	85.6	69%	0.687	44%	0.436	S	S	*	.	H	α-helix	trans	-75.6	-41.1	176.8	-62.9	-175.7	160.7	0	0	112.8	S96 K101 E102	S96-E98 PolarHBondContact O-N 3.29Å; E98-K101 PolarHBondContact O-N 2.57Å; E98-E102 PolarHBondContact O-N 3.49Å; E98-E102 VanDerWaalsContact O-N 3.11Å
99	T	50.4	Low	49.5	Very low	2 Å²	2	86.4 Å²	86.4	1%	0.012	44%	0.443	C	S	.	.	H	α-helix	trans	-72.1	-30.4	176.9	39.6	0	0	0	0	112.1	I94 F95 S96 K101 E102 V103 Y120	I94-T99 VanDerWaalsContact O-CG2 3.25Å; I94-T99 WeakPolarHBondContact O-CG2 3.15Å; I94-T99 PolarHBondContact O-OG1 3.46Å; F95-T99 VanDerWaalsContact CA-OG1 3.3Å; F95-T99 WeakPolarHBondContact CA-OG1 3.32Å; S96-T99 PolarHBondContact O-N 3.05Å; S96-T99 PolarHBondContact O-OG1 3.03Å; T99-K101 PolarHBondContact O-N 3.31Å; T99-E102 PolarHBondContact O-N 2.65Å; T99-V103 WeakPolarHBondContact O-CB 3.47Å; T99-V103 WeakPolarHBondContact O-CG2 3.47Å; T99-V103 PolarHBondContact O-N 3.05Å; T99-Y120 HydrophobicContact CG2-CE2 3.92Å
100	M	46	Very low	49.1	Very low	119 Å²	119	87.8 Å²	87.8	59%	0.586	45%	0.449	S	S	*	.	H	α-helix	trans	-60.2	-32.8	171.1	-79.2	-101.5	-112.1	0	0	112.7	A104	M100-A104 WeakPolarHBondContact O-CB 3.46Å; M100-A104 PolarHBondContact O-N 3.31Å; M100-A104 VanDerWaalsContact O-N 3.17Å
101	K	49.1	Very low	48.7	Very low	146 Å²	146	88.9 Å²	88.9	64%	0.635	45%	0.451	S	S	*	.	H	α-helix	trans	-78.6	-39.6	175.3	-70.4	-179.9	-178.6	175.4	0	112.3	E98 T99 V103 A104 Q105	E98-K101 PolarHBondContact O-N 2.57Å; T99-K101 PolarHBondContact O-N 3.31Å; K101-V103 VanDerWaalsContact C-N 3.31Å; K101-A104 PolarHBondContact O-N 2.89Å; K101-Q105 WeakPolarHBondContact O-CG 3.48Å; K101-Q105 PolarHBondContact O-N 3.47Å
102	E	41.8	Very low	48.3	Very low	79 Å²	79	89 Å²	89	37%	0.369	45%	0.452	S	S	.	.	H	α-helix	trans	-65.5	-36.2	174.4	-67.9	-167.8	164.2	0	0	111.6	E98 T99 Q105 C106 K119	E98-E102 PolarHBondContact O-N 3.49Å; E98-E102 VanDerWaalsContact O-N 3.11Å; T99-E102 PolarHBondContact O-N 2.65Å; E102-Q105 PolarHBondContact O-N 3.43Å; E102-C106 PolarHBondContact O-N 3.49Å; E102-K119 IonicContact OE1-NZ 3.26Å; E102-K119 PolarHBondContact OE1-NZ 2.8Å; E102-K119 IonicContact OE2-NZ 2.71Å; E102-K119 PolarHBondContact OE2-NZ 2.93Å
103	V	51.3	Low	48.2	Very low	14 Å²	14	86.4 Å²	86.4	9%	0.085	44%	0.442	C	S	.	.	H	α-helix	trans	-69.9	-34.4	176.4	171.7	0	0	0	0	112.3	T99 K101 L112 Q155	T99-V103 WeakPolarHBondContact O-CB 3.47Å; T99-V103 WeakPolarHBondContact O-CG2 3.47Å; T99-V103 PolarHBondContact O-N 3.05Å; K101-V103 VanDerWaalsContact C-N 3.31Å; V103-L112 HydrophobicContact CB-CD2 4.44Å; V103-L112 HydrophobicContact CG2-CD2 3.78Å; V103-Q155 HydrophobicContact CG1-CB 4.39Å
104	A	51.8	Low	48.4	Very low	81 Å²	81	83.1 Å²	83.1	67%	0.669	43%	0.427	S	S	*	.	H	α-helix	trans	-74.5	-24.3	175	0	0	0	0	0	113.6	M100 K101	M100-A104 WeakPolarHBondContact O-CB 3.46Å; M100-A104 PolarHBondContact O-N 3.31Å; M100-A104 VanDerWaalsContact O-N 3.17Å; K101-A104 PolarHBondContact O-N 2.89Å
105	Q	45.2	Very low	48.3	Very low	160 Å²	160	83.8 Å²	83.8	75%	0.748	43%	0.433	S	S	*	.	H	α-helix	trans	-90.4	-23.3	-176.9	-72.9	178.8	-1.3	0	0	113.6	K101 E102	K101-Q105 WeakPolarHBondContact O-CG 3.48Å; K101-Q105 PolarHBondContact O-N 3.47Å; E102-Q105 PolarHBondContact O-N 3.43Å
106	C	34.7	Very low	48.3	Very low	58 Å²	58	82.4 Å²	82.4	39%	0.392	43%	0.427	S	S	.	.			trans	-98.7	106.9	-178.4	-74	0	0	0	0	112.1	E102 N108 L112	E102-C106 PolarHBondContact O-N 3.49Å; C106-N108 VanDerWaalsContact C-N 3.27Å; C106-N108 PolarHBondContact O-N 2.9Å; C106-L112 HydrophobicContact CB-CD1 3.98Å; C106-L112 HydrophobicContact CB-CD2 4.47Å; C106-L112 HydrophobicContact CB-CG 3.83Å; C106-L112 WeakPolarHBondContact O-CD1 3.4Å
107	K	51	Low	48.9	Very low	208 Å²	208	84.7 Å²	84.7	90%	0.904	43%	0.432	S	S	*	.			trans	-73.3	-11.2	177.6	-69.8	-176.8	177.1	-178.7	0	114.7
108	N	42.4	Very low	49.3	Very low	95 Å²	95	82.2 Å²	82.2	51%	0.508	43%	0.428	S	S	.	.			trans	-107.7	111.6	-173.5	-66.1	-17.8	0	0	0	111	C106 K110 D111 L112	C106-N108 VanDerWaalsContact C-N 3.27Å; C106-N108 PolarHBondContact O-N 2.9Å; N108-K110 PolarHBondContact O-N 3.38Å; N108-K110 VanDerWaalsContact O-N 3.16Å; N108-D111 HydrophobicContact CB-CB 4.12Å; N108-D111 WeakPolarHBondContact CB-OD2 3.37Å; N108-D111 PolarHBondContact ND2-OD2 2.93Å; N108-D111 PolarHBondContact O-N 2.99Å; N108-D111 VanDerWaalsContact O-N 3.09Å; N108-L112 PolarHBondContact O-N 3.4Å; N108-L112 VanDerWaalsContact O-N 3.11Å
109	A	50.8	Low	49.6	Very low	21 Å²	21	80.7 Å²	80.7	17%	0.174	42%	0.42	C	S	.	.	H	α-helix	trans	-56.5	-30.3	178.3	0	0	0	0	0	113.6	L113	A109-L113 WeakPolarHBondContact O-CG 3.46Å; A109-L113 PolarHBondContact O-N 2.79Å
110	K	54.3	Low	49.4	Very low	157 Å²	157	84.5 Å²	84.5	68%	0.683	43%	0.434	S	S	*	.	H	α-helix	trans	-71.7	-37.1	177.7	-67.6	-175.6	179.7	178.1	0	112.9	N108 A114	N108-K110 PolarHBondContact O-N 3.38Å; N108-K110 VanDerWaalsContact O-N 3.16Å; K110-A114 WeakPolarHBondContact O-CB 3.27Å; K110-A114 PolarHBondContact O-N 3.01Å
111	D	51.1	Low	49.6	Very low	89 Å²	89	85.4 Å²	85.4	48%	0.476	44%	0.442	S	S	.	.	H	α-helix	trans	-73.9	-34.1	177.5	-62.3	-30.7	0	0	0	110.3	N108 S115	N108-D111 HydrophobicContact CB-CB 4.12Å; N108-D111 WeakPolarHBondContact CB-OD2 3.37Å; N108-D111 PolarHBondContact ND2-OD2 2.93Å; N108-D111 PolarHBondContact O-N 2.99Å; N108-D111 VanDerWaalsContact O-N 3.09Å; D111-S115 WeakPolarHBondContact O-CB 3.3Å; D111-S115 PolarHBondContact O-N 2.86Å; D111-S115 PolarHBondContact O-OG 3.2Å
112	L	50.3	Low	49.7	Very low	7 Å²	7	79 Å²	79	4%	0.037	41%	0.414	C	S	.	.	H	α-helix	trans	-64	-49.1	171.5	-95	162.2	0	0	0	111.7	V103 C106 N108 A114 S115 L116	V103-L112 HydrophobicContact CB-CD2 4.44Å; V103-L112 HydrophobicContact CG2-CD2 3.78Å; C106-L112 HydrophobicContact CB-CD1 3.98Å; C106-L112 HydrophobicContact CB-CD2 4.47Å; C106-L112 HydrophobicContact CB-CG 3.83Å; C106-L112 WeakPolarHBondContact O-CD1 3.4Å; N108-L112 PolarHBondContact O-N 3.4Å; N108-L112 VanDerWaalsContact O-N 3.11Å; L112-A114 PolarHBondContact O-N 3.36Å; L112-S115 WeakPolarHBondContact CA-OG 3.41Å; L112-S115 PolarHBondContact O-N 3.28Å; L112-S115 PolarHBondContact O-OG 3.35Å; L112-L116 HydrophobicContact CD2-CD1 4.36Å; L112-L116 WeakPolarHBondContact O-CB 3.48Å; L112-L116 WeakPolarHBondContact O-CD1 3.3Å; L112-L116 WeakPolarHBondContact O-CG 3.42Å; L112-L116 PolarHBondContact O-N 2.89Å
113	L	52	Low	50.3	Low	43 Å²	43	81.3 Å²	81.3	23%	0.225	42%	0.423	C	S	.	.	H	α-helix	trans	-59.1	-46.1	175.1	-75.7	171.4	0	0	0	111.6	A109 S115 L116 E117	A109-L113 WeakPolarHBondContact O-CG 3.46Å; A109-L113 PolarHBondContact O-N 2.79Å; L113-S115 VanDerWaalsContact C-N 3.34Å; L113-S115 PolarHBondContact O-N 3.24Å; L113-L116 PolarHBondContact O-N 3.03Å; L113-E117 VanDerWaalsContact O-CB 3.26Å; L113-E117 WeakPolarHBondContact O-CB 3.35Å; L113-E117 VanDerWaalsContact O-CG 3.24Å; L113-E117 WeakPolarHBondContact O-CG 3.34Å; L113-E117 PolarHBondContact O-N 2.95Å
114	A	55.4	Low	50.8	Low	45 Å²	45	85.4 Å²	85.4	37%	0.372	45%	0.448	S	S	.	.	H	α-helix	trans	-64.1	-37.9	177.2	0	0	0	0	0	112.4	K110 L112 T118	K110-A114 WeakPolarHBondContact O-CB 3.27Å; K110-A114 PolarHBondContact O-N 3.01Å; L112-A114 PolarHBondContact O-N 3.36Å; A114-T118 WeakPolarHBondContact O-CB 3.4Å; A114-T118 VanDerWaalsContact O-CG2 3.32Å; A114-T118 WeakPolarHBondContact O-CG2 3.29Å; A114-T118 PolarHBondContact O-N 3.05Å; A114-T118 PolarHBondContact O-OG1 2.69Å
115	S	47.6	Very low	51.4	Low	31 Å²	31	87.2 Å²	87.2	22%	0.217	44%	0.442	C	S	.	.	H	α-helix	trans	-69.5	-33.3	176.6	72.4	0	0	0	0	112.8	D111 L112 L113 T118 K119	D111-S115 WeakPolarHBondContact O-CB 3.3Å; D111-S115 PolarHBondContact O-N 2.86Å; D111-S115 PolarHBondContact O-OG 3.2Å; L112-S115 WeakPolarHBondContact CA-OG 3.41Å; L112-S115 PolarHBondContact O-N 3.28Å; L112-S115 PolarHBondContact O-OG 3.35Å; L113-S115 VanDerWaalsContact C-N 3.34Å; L113-S115 PolarHBondContact O-N 3.24Å; S115-T118 WeakPolarHBondContact CA-OG1 3.13Å; S115-T118 PolarHBondContact O-OG1 3.39Å; S115-K119 WeakPolarHBondContact O-CB 3.46Å; S115-K119 VanDerWaalsContact O-CG 3.31Å; S115-K119 WeakPolarHBondContact O-CG 2.99Å; S115-K119 PolarHBondContact O-N 2.98Å
116	L	52.7	Low	52.2	Low	6 Å²	6	82.2 Å²	82.2	3%	0.031	42%	0.42	C	S	.	.	H	α-helix	trans	-80.9	-35	177.8	-69.5	165.1	0	0	0	111.5	L112 L113 Y120 N121 F122 L156	L112-L116 HydrophobicContact CD2-CD1 4.36Å; L112-L116 WeakPolarHBondContact O-CB 3.48Å; L112-L116 WeakPolarHBondContact O-CD1 3.3Å; L112-L116 WeakPolarHBondContact O-CG 3.42Å; L112-L116 PolarHBondContact O-N 2.89Å; L113-L116 PolarHBondContact O-N 3.03Å; L116-Y120 HydrophobicContact CD2-CD2 3.96Å; L116-Y120 HydrophobicContact CD2-CE2 4.46Å; L116-Y120 CarbonylContact O-C 3.53Å; L116-Y120 WeakPolarHBondContact O-CA 3.19Å; L116-Y120 WeakPolarHBondContact O-CB 3.47Å; L116-Y120 PolarHBondContact O-N 3.49Å; L116-N121 PolarHBondContact O-N 2.97Å; L116-F122 HydrophobicContact CB-CB 4.09Å; L116-F122 HydrophobicContact CB-CD2 4.5Å; L116-F122 HydrophobicContact CB-CG 4.36Å; L116-F122 PolarHBondContact O-N 3.28Å; L116-L156 HydrophobicContact CD1-CD2 3.19Å
117	E	56.4	Low	53.7	Low	102 Å²	102	80.2 Å²	80.2	48%	0.477	41%	0.405	S	S	.	.	H	α-helix	trans	-62.9	-44.7	169.8	-77.7	175.5	-179.6	0	0	110.5	L113 N121	L113-E117 VanDerWaalsContact O-CB 3.26Å; L113-E117 WeakPolarHBondContact O-CB 3.35Å; L113-E117 VanDerWaalsContact O-CG 3.24Å; L113-E117 WeakPolarHBondContact O-CG 3.34Å; L113-E117 PolarHBondContact O-N 2.95Å; E117-N121 WeakPolarHBondContact O-CA 3.39Å; E117-N121 PolarHBondContact O-N 2.77Å
118	T	56.6	Low	54.7	Low	116 Å²	116	72.8 Å²	72.8	71%	0.712	38%	0.375	S	S	*	.	H	α-helix	trans	-75.6	-35.5	-178.9	48	0	0	0	0	114.2	A114 S115	A114-T118 WeakPolarHBondContact O-CB 3.4Å; A114-T118 VanDerWaalsContact O-CG2 3.32Å; A114-T118 WeakPolarHBondContact O-CG2 3.29Å; A114-T118 PolarHBondContact O-N 3.05Å; A114-T118 PolarHBondContact O-OG1 2.69Å; S115-T118 WeakPolarHBondContact CA-OG1 3.13Å; S115-T118 PolarHBondContact O-OG1 3.39Å
119	K	51.2	Low	56.1	Low	115 Å²	115	70.8 Å²	70.8	50%	0.5	37%	0.365	S	S	.	.	H	α-helix	trans	-89.8	-30.1	-179.5	-67.6	-177.6	-178.5	-179.7	0	113.9	E102 S115	E102-K119 IonicContact OE1-NZ 3.26Å; E102-K119 PolarHBondContact OE1-NZ 2.8Å; E102-K119 IonicContact OE2-NZ 2.71Å; E102-K119 PolarHBondContact OE2-NZ 2.93Å; S115-K119 WeakPolarHBondContact O-CB 3.46Å; S115-K119 VanDerWaalsContact O-CG 3.31Å; S115-K119 WeakPolarHBondContact O-CG 2.99Å; S115-K119 PolarHBondContact O-N 2.98Å
120	Y	46.6	Very low	57.2	Low	82 Å²	82	69.9 Å²	69.9	32%	0.322	36%	0.357	S	S	.	.	H	α-helix	trans	-129.9	7.1	-168.1	-66	-75.3	0	0	0	115.2	I94 T99 L116 F122	I94-Y120 HydrophobicContact CB-CD1 4.15Å; I94-Y120 HydrophobicContact CB-CE1 4.25Å; I94-Y120 HydrophobicContact CD1-CD1 4.18Å; I94-Y120 HydrophobicContact CD1-CG 4.45Å; I94-Y120 HydrophobicContact CG1-CD1 3.58Å; I94-Y120 HydrophobicContact CG1-CE1 3.99Å; I94-Y120 HydrophobicContact CG1-CG 4.17Å; I94-Y120 HydrophobicContact CG2-CD1 3.72Å; I94-Y120 HydrophobicContact CG2-CD2 3.82Å; I94-Y120 HydrophobicContact CG2-CE1 3.91Å; I94-Y120 HydrophobicContact CG2-CE2 4.03Å; I94-Y120 HydrophobicContact CG2-CG 3.64Å; T99-Y120 HydrophobicContact CG2-CE2 3.92Å; L116-Y120 HydrophobicContact CD2-CD2 3.96Å; L116-Y120 HydrophobicContact CD2-CE2 4.46Å; L116-Y120 CarbonylContact O-C 3.53Å; L116-Y120 WeakPolarHBondContact O-CA 3.19Å; L116-Y120 WeakPolarHBondContact O-CB 3.47Å; L116-Y120 PolarHBondContact O-N 3.49Å; Y120-F122 PolarHBondContact O-N 2.68Å
121	N	49.7	Very low	58.2	Low	138 Å²	138	64 Å²	64	74%	0.738	33%	0.331	S	S	*	.			trans	49.9	41	-175.1	-81.8	-17.5	0	0	0	112.1	L116 E117 K123	L116-N121 PolarHBondContact O-N 2.97Å; E117-N121 WeakPolarHBondContact O-CA 3.39Å; E117-N121 PolarHBondContact O-N 2.77Å; N121-K123 PolarHBondContact O-N 3.28Å
122	F	51.3	Low	59.4	Low	13 Å²	13	64.1 Å²	64.1	6%	0.057	33%	0.332	C	S	.	.			trans	-64.3	118.7	-176.8	-142.7	-89.5	0	0	0	110.1	L116 Y120 M126 M130	L116-F122 HydrophobicContact CB-CB 4.09Å; L116-F122 HydrophobicContact CB-CD2 4.5Å; L116-F122 HydrophobicContact CB-CG 4.36Å; L116-F122 PolarHBondContact O-N 3.28Å; Y120-F122 PolarHBondContact O-N 2.68Å; F122-M126 HydrophobicContact CD1-CB 4.42Å; F122-M126 HydrophobicContact CD2-SD 4.34Å; F122-M126 HydrophobicContact CE1-CB 3.95Å; F122-M126 HydrophobicContact CE2-SD 4.38Å; F122-M126 HydrophobicContact CZ-CB 4.05Å; F122-M130 HydrophobicContact CE2-CE 4.32Å; F122-M130 HydrophobicContact CZ-CE 3.64Å; F122-M130 HydrophobicContact CZ-SD 4.29Å
123	K	53.7	Low	60.6	Low	127 Å²	127	63.9 Å²	63.9	55%	0.552	33%	0.331	S	S	*	.			trans	-97.5	149.5	173.1	-72.4	-176.6	178.1	-179.4	0	110.1	N121 E125 M126	N121-K123 PolarHBondContact O-N 3.28Å; K123-E125 HydrophobicContact CB-CB 4.22Å; K123-E125 PolarHBondContact O-N 3.1Å; K123-M126 WeakPolarHBondContact O-CB 3.45Å; K123-M126 PolarHBondContact O-N 2.97Å
124	T	62.1	Low	61.9	Low	100 Å²	100	62 Å²	62	61%	0.613	32%	0.321	S	S	*	.	H	α-helix	trans	-51.7	-22.7	168.2	-34.2	0	0	0	0	112.9	L127 N128	T124-L127 PolarHBondContact O-N 2.88Å; T124-N128 PolarHBondContact O-N 3.04Å
125	E	64.6	Low	63.1	Low	118 Å²	118	67.9 Å²	67.9	55%	0.551	33%	0.334	S	S	*	.	H	α-helix	trans	-64.4	-42.6	173.1	-66.1	174.2	167.8	0	0	112.4	K123 L127 N128 D129	K123-E125 HydrophobicContact CB-CB 4.22Å; K123-E125 PolarHBondContact O-N 3.1Å; E125-L127 PolarHBondContact O-N 3.46Å; E125-N128 WeakPolarHBondContact O-CB 3.48Å; E125-N128 PolarHBondContact O-N 3.44Å; E125-D129 PolarHBondContact O-N 3.42Å
126	M	61.4	Low	64.5	Low	56 Å²	56	68 Å²	68	28%	0.276	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-28.7	177.3	-69.5	-178.2	168.2	0	0	112.2	F122 K123 D129 M130	F122-M126 HydrophobicContact CD1-CB 4.42Å; F122-M126 HydrophobicContact CD2-SD 4.34Å; F122-M126 HydrophobicContact CE1-CB 3.95Å; F122-M126 HydrophobicContact CE2-SD 4.38Å; F122-M126 HydrophobicContact CZ-CB 4.05Å; K123-M126 WeakPolarHBondContact O-CB 3.45Å; K123-M126 PolarHBondContact O-N 2.97Å; M126-D129 PolarHBondContact O-N 2.98Å; M126-M130 VanDerWaalsContact O-CG 3.31Å; M126-M130 WeakPolarHBondContact O-CG 3.33Å; M126-M130 PolarHBondContact O-N 2.78Å
127	L	67.4	Low	65.8	Low	16 Å²	16	68 Å²	68	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-70.7	-38.1	173.6	-173.2	141.8	0	0	0	111.3	T124 E125 M130 F131 L156 V157	T124-L127 PolarHBondContact O-N 2.88Å; E125-L127 PolarHBondContact O-N 3.46Å; L127-M130 PolarHBondContact O-N 2.99Å; L127-F131 HydrophobicContact CD2-CD2 3.81Å; L127-F131 HydrophobicContact CD2-CE2 3.68Å; L127-F131 HydrophobicContact CG-CD2 4.44Å; L127-F131 HydrophobicContact CG-CE2 4.42Å; L127-F131 WeakPolarHBondContact O-CD2 3.41Å; L127-F131 PolarHBondContact O-N 3.06Å; L127-F131 VanDerWaalsContact O-N 3.1Å; L127-L156 HydrophobicContact CD1-CB 4.21Å; L127-V157 HydrophobicContact CD1-CG2 3.8Å; L127-V157 HydrophobicContact CD2-CG2 4.12Å; L127-V157 HydrophobicContact CG-CG2 4.41Å
128	N	72	Confident	67	Low	51 Å²	51	64.1 Å²	64.1	27%	0.273	31%	0.314	S	S	.	.	H	α-helix	trans	-64.5	-44.3	171.4	-62.8	-28	0	0	0	110.8	T124 E125 M130 F131 D132 R163	T124-N128 PolarHBondContact O-N 3.04Å; E125-N128 WeakPolarHBondContact O-CB 3.48Å; E125-N128 PolarHBondContact O-N 3.44Å; N128-M130 VanDerWaalsContact C-N 3.26Å; N128-M130 PolarHBondContact O-N 3.49Å; N128-F131 WeakPolarHBondContact O-CB 3.48Å; N128-F131 PolarHBondContact O-N 2.82Å; N128-D132 PolarHBondContact O-N 3.38Å; N128-R163 PolarHBondContact OD1-NH1 3.35Å; N128-R163 PolarHBondContact OD1-NH2 3.36Å
129	D	70.4	Confident	68.1	Low	54 Å²	54	61 Å²	61	29%	0.289	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-35.1	177.2	-68.8	-42.2	0	0	0	111.8	E125 M126 A133	E125-D129 PolarHBondContact O-N 3.42Å; M126-D129 PolarHBondContact O-N 2.98Å; D129-A133 WeakPolarHBondContact O-CB 3.41Å; D129-A133 PolarHBondContact O-N 3.22Å
130	M	73.4	Confident	69.3	Low	1 Å²	1	57.1 Å²	57.1	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-38.4	172.2	-77.6	176.9	172.8	0	0	113.1	V91 F95 F122 M126 L127 N128 A133 A134 I152 V153	V91-M130 HydrophobicContact CB-CE 4.36Å; V91-M130 HydrophobicContact CG1-CE 3.13Å; V91-M130 HydrophobicContact CG1-CG 4.42Å; V91-M130 HydrophobicContact CG2-CE 4.34Å; F95-M130 HydrophobicContact CD2-CE 4.19Å; F95-M130 HydrophobicContact CE2-CE 3.59Å; F95-M130 HydrophobicContact CZ-CE 4.43Å; F122-M130 HydrophobicContact CE2-CE 4.32Å; F122-M130 HydrophobicContact CZ-CE 3.64Å; F122-M130 HydrophobicContact CZ-SD 4.29Å; M126-M130 VanDerWaalsContact O-CG 3.31Å; M126-M130 WeakPolarHBondContact O-CG 3.33Å; M126-M130 PolarHBondContact O-N 2.78Å; L127-M130 PolarHBondContact O-N 2.99Å; N128-M130 VanDerWaalsContact C-N 3.26Å; N128-M130 PolarHBondContact O-N 3.49Å; M130-A133 WeakPolarHBondContact O-CB 3.15Å; M130-A134 WeakPolarHBondContact O-CB 3.37Å; M130-A134 PolarHBondContact O-N 3.31Å; M130-I152 HydrophobicContact CE-CG2 4.33Å; M130-I152 HydrophobicContact SD-CG2 4.46Å; M130-V153 HydrophobicContact CB-CG2 3.82Å; M130-V153 HydrophobicContact SD-CG2 4.01Å
131	F	75.7	Confident	70.7	Confident	34 Å²	34	54.4 Å²	54.4	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-66.8	-46.4	175.6	-94.7	-77.3	0	0	0	111.3	L127 N128 A133 A134 R135 V153 V157 R163 A167	L127-F131 HydrophobicContact CD2-CD2 3.81Å; L127-F131 HydrophobicContact CD2-CE2 3.68Å; L127-F131 HydrophobicContact CG-CD2 4.44Å; L127-F131 HydrophobicContact CG-CE2 4.42Å; L127-F131 WeakPolarHBondContact O-CD2 3.41Å; L127-F131 PolarHBondContact O-N 3.06Å; L127-F131 VanDerWaalsContact O-N 3.1Å; N128-F131 WeakPolarHBondContact O-CB 3.48Å; N128-F131 PolarHBondContact O-N 2.82Å; F131-A133 VanDerWaalsContact C-N 3.26Å; F131-A133 PolarHBondContact O-N 3.33Å; F131-A134 PolarHBondContact O-N 3.5Å; F131-R135 WeakPolarHBondContact O-CB 3.48Å; F131-R135 PolarHBondContact O-N 3.06Å; F131-V153 HydrophobicContact CD2-CG1 3.84Å; F131-V153 HydrophobicContact CE1-CG1 3.94Å; F131-V153 HydrophobicContact CE2-CG1 3.15Å; F131-V153 HydrophobicContact CG-CG1 4.48Å; F131-V153 HydrophobicContact CZ-CG1 3.22Å; F131-V157 HydrophobicContact CE2-CG2 4.2Å; F131-R163 HydrophobicContact CE2-CB 4.17Å; F131-R163 HydrophobicContact CZ-CB 3.87Å; F131-R163 VanDerWaalsContact CZ-O 3.25Å; F131-R163 WeakPolarHBondContact CZ-O 3.08Å; F131-A167 HydrophobicContact CE1-CB 3.67Å; F131-A167 HydrophobicContact CZ-CB 3.75Å
132	D	76.7	Confident	72.2	Confident	92 Å²	92	51 Å²	51	49%	0.492	26%	0.261	S	S	.	.	H	α-helix	trans	-63.4	-39.1	176.9	-69.9	-25.3	0	0	0	110.2	N128 R135 V136	N128-D132 PolarHBondContact O-N 3.38Å; D132-R135 PolarHBondContact O-N 3.08Å; D132-V136 VanDerWaalsContact O-CG2 3.31Å; D132-V136 WeakPolarHBondContact O-CG2 3.23Å; D132-V136 PolarHBondContact O-N 2.98Å
133	A	76.8	Confident	73.6	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-60.7	-51	172.2	0	0	0	0	0	113.4	T84 L88 D129 M130 F131 R135 V136 F137	T84-A133 HydrophobicContact CG2-CB 3.35Å; L88-A133 HydrophobicContact CD1-CB 3.7Å; L88-A133 HydrophobicContact CD2-CB 3.93Å; L88-A133 HydrophobicContact CG-CB 4.09Å; D129-A133 WeakPolarHBondContact O-CB 3.41Å; D129-A133 PolarHBondContact O-N 3.22Å; M130-A133 WeakPolarHBondContact O-CB 3.15Å; F131-A133 VanDerWaalsContact C-N 3.26Å; F131-A133 PolarHBondContact O-N 3.33Å; A133-R135 PolarHBondContact O-N 2.98Å; A133-V136 PolarHBondContact O-N 2.96Å; A133-V136 VanDerWaalsContact O-N 3.15Å; A133-F137 HydrophobicContact CB-CD2 4.38Å; A133-F137 HydrophobicContact CB-CE2 4.13Å; A133-F137 WeakPolarHBondContact O-CD2 3.43Å; A133-F137 PolarHBondContact O-N 2.84Å
134	A	78.3	Confident	75	Confident	3 Å²	3	50.5 Å²	50.5	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-59.3	-39	179.5	0	0	0	0	0	111.1	M130 F131 F137 Y138 L150	M130-A134 WeakPolarHBondContact O-CB 3.37Å; M130-A134 PolarHBondContact O-N 3.31Å; F131-A134 PolarHBondContact O-N 3.5Å; A134-F137 PolarHBondContact O-N 3.05Å; A134-Y138 WeakPolarHBondContact O-CB 3.29Å; A134-Y138 PolarHBondContact O-N 3.16Å; A134-L150 HydrophobicContact CB-CD1 4.46Å; A134-L150 HydrophobicContact CB-CD2 3.72Å; A134-L150 HydrophobicContact CB-CG 3.85Å
135	R	80.4	Confident	75.8	Confident	169 Å²	169	48 Å²	48	64%	0.638	25%	0.245	S	C	*	.	H	α-helix	trans	-62.4	-48.6	173.8	-176.8	179.3	179.2	176.5	3.1	111.8	F131 D132 A133 F137 Y138 D139	F131-R135 WeakPolarHBondContact O-CB 3.48Å; F131-R135 PolarHBondContact O-N 3.06Å; D132-R135 PolarHBondContact O-N 3.08Å; A133-R135 PolarHBondContact O-N 2.98Å; R135-F137 VanDerWaalsContact C-N 3.34Å; R135-F137 PolarHBondContact O-N 3.19Å; R135-Y138 PolarHBondContact O-N 3.47Å; R135-D139 IonicContact NE-OD2 3.26Å; R135-D139 WeakPolarHBondContact O-CB 3.49Å; R135-D139 VanDerWaalsContact O-CG 3.22Å; R135-D139 PolarHBondContact O-N 2.97Å
136	V	77.7	Confident	76.5	Confident	33 Å²	33	42.3 Å²	42.3	20%	0.2	22%	0.219	C	C	.	.	H	α-helix	trans	-61.8	-41.7	178	171.6	0	0	0	0	111.3	I81 D132 A133 A140	I81-V136 HydrophobicContact CG1-CG1 3.75Å; D132-V136 VanDerWaalsContact O-CG2 3.31Å; D132-V136 WeakPolarHBondContact O-CG2 3.23Å; D132-V136 PolarHBondContact O-N 2.98Å; A133-V136 PolarHBondContact O-N 2.96Å; A133-V136 VanDerWaalsContact O-N 3.15Å; V136-A140 WeakPolarHBondContact O-CB 3.27Å; V136-A140 PolarHBondContact O-N 3.33Å
137	F	78.7	Confident	77.4	Confident	6 Å²	6	40.2 Å²	40.2	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-67.1	-38.7	176.3	-70.2	-57.3	0	0	0	112.9	T84 E85 L88 A133 A134 R135 A140 G141 N142 A146 Y149	T84-F137 HydrophobicContact CG2-CE2 4.15Å; T84-F137 HydrophobicContact CG2-CZ 4.28Å; E85-F137 HydrophobicContact CG-CZ 4.27Å; L88-F137 HydrophobicContact CD1-CE2 3.41Å; L88-F137 VanDerWaalsContact CD1-CE2 3.41Å; L88-F137 HydrophobicContact CD1-CZ 3.72Å; A133-F137 HydrophobicContact CB-CD2 4.38Å; A133-F137 HydrophobicContact CB-CE2 4.13Å; A133-F137 WeakPolarHBondContact O-CD2 3.43Å; A133-F137 PolarHBondContact O-N 2.84Å; A134-F137 PolarHBondContact O-N 3.05Å; R135-F137 VanDerWaalsContact C-N 3.34Å; R135-F137 PolarHBondContact O-N 3.19Å; F137-A140 PolarHBondContact O-N 3.44Å; F137-G141 PolarHBondContact O-N 2.95Å; F137-G141 VanDerWaalsContact O-N 3.12Å; F137-N142 PolarHBondContact O-N 3.35Å; F137-A146 HydrophobicContact CB-CB 4.25Å; F137-Y149 AromaticContact CD2-CD2 3.83Å; F137-Y149 HydrophobicContact CD2-CD2 3.83Å; F137-Y149 AromaticContact CD2-CE2 3.61Å; F137-Y149 HydrophobicContact CD2-CE2 3.61Å; F137-Y149 AromaticContact CE2-CD2 3.98Å; F137-Y149 HydrophobicContact CE2-CD2 3.98Å; F137-Y149 AromaticContact CE2-CE2 3.34Å; F137-Y149 HydrophobicContact CE2-CE2 3.34Å; F137-Y149 HydrophobicContact CZ-CE2 4.22Å
138	Y	82.2	Confident	77.8	Confident	22 Å²	22	44.6 Å²	44.6	9%	0.086	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-48.6	175.8	-177.4	-96.3	0	0	0	111.2	D15 H17 A134 R135 A140 G141 Y143 A173 L177	D15-Y138 WeakPolarHBondContact OD2-CE1 3.47Å; D15-Y138 VanDerWaalsContact OD2-CZ 3.27Å; D15-Y138 PolarHBondContact OD2-OH 3.33Å; H17-Y138 AromaticContact CD2-CD1 3.98Å; H17-Y138 AromaticContact CD2-CE1 3.34Å; H17-Y138 WeakPolarHBondContact CD2-CE1 3.27Å; H17-Y138 AromaticContact CD2-CZ 3.86Å; H17-Y138 PolarHBondContact CE1-O 3.24Å; H17-Y138 AromaticContact NE2-CE1 3.99Å; A134-Y138 WeakPolarHBondContact O-CB 3.29Å; A134-Y138 PolarHBondContact O-N 3.16Å; R135-Y138 PolarHBondContact O-N 3.47Å; Y138-A140 PolarHBondContact O-N 2.86Å; Y138-G141 PolarHBondContact O-N 3.46Å; Y138-Y143 AromaticContact CD2-CD1 3.85Å; Y138-Y143 HydrophobicContact CD2-CD1 3.85Å; Y138-Y143 HydrophobicContact CD2-CE1 4.03Å; Y138-Y143 HydrophobicContact CE2-CD1 4Å; Y138-Y143 HydrophobicContact CE2-CE1 4Å; Y138-A173 HydrophobicContact CE2-CB 3.77Å; Y138-A173 WeakPolarHBondContact OH-CB 3.43Å; Y138-L177 HydrophobicContact CE2-CD1 3.93Å
139	D	79.8	Confident	78	Confident	50 Å²	50	43 Å²	43	27%	0.267	22%	0.219	S	C	.	.	H	α-helix	trans	-63.8	-29.3	177.9	-67	-23.2	0	0	0	111.4	S49 R135	S49-D139 CarbonylContact C-O 3.57Å; S49-D139 PolarHBondContact N-O 3.05Å; S49-D139 WeakPolarHBondContact OG-CB 3.41Å; S49-D139 PolarHBondContact OG-O 3.47Å; R135-D139 IonicContact NE-OD2 3.26Å; R135-D139 WeakPolarHBondContact O-CB 3.49Å; R135-D139 VanDerWaalsContact O-CG 3.22Å; R135-D139 PolarHBondContact O-N 2.97Å
140	A	76.1	Confident	78.3	Confident	33 Å²	33	40.8 Å²	40.8	27%	0.273	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.2	176.2	0	0	0	0	0	114	S49 I81 V136 F137 Y138	S49-A140 PolarHBondContact OG-N 3.42Å; I81-A140 HydrophobicContact CD1-CB 3.83Å; I81-A140 HydrophobicContact CG1-CB 4.44Å; V136-A140 WeakPolarHBondContact O-CB 3.27Å; V136-A140 PolarHBondContact O-N 3.33Å; F137-A140 PolarHBondContact O-N 3.44Å; Y138-A140 PolarHBondContact O-N 2.86Å
141	G	76.3	Confident	78.4	Confident	26 Å²	26	44.1 Å²	44.1	27%	0.268	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	13.1	178.2	0	0	0	0	0	115.6	F137 Y138 Y143	F137-G141 PolarHBondContact O-N 2.95Å; F137-G141 VanDerWaalsContact O-N 3.12Å; Y138-G141 PolarHBondContact O-N 3.46Å; G141-Y143 PolarHBondContact O-N 3.3Å
142	N	81.3	Confident	78.3	Confident	66 Å²	66	43.5 Å²	43.5	35%	0.353	22%	0.22	S	C	.	.			trans	-96.1	81.7	173	-164.7	-17	0	0	0	111.2	F137 L145 A146	F137-N142 PolarHBondContact O-N 3.35Å; N142-L145 VanDerWaalsContact ND2-CD1 3.28Å; N142-L145 WeakPolarHBondContact ND2-CD1 3.36Å; N142-A146 PolarHBondContact O-N 3.49Å
143	Y	80.7	Confident	78	Confident	40 Å²	40	39.1 Å²	39.1	16%	0.157	20%	0.197	C	C	.	.	H	α-helix	trans	-70.7	-32.9	-173	-52.8	-57.6	0	0	0	113.9	H17 Y138 G141 A146 S147 L177	H17-Y143 PolarHBondContact ND1-OH 3.14Å; Y138-Y143 AromaticContact CD2-CD1 3.85Å; Y138-Y143 HydrophobicContact CD2-CD1 3.85Å; Y138-Y143 HydrophobicContact CD2-CE1 4.03Å; Y138-Y143 HydrophobicContact CE2-CD1 4Å; Y138-Y143 HydrophobicContact CE2-CE1 4Å; G141-Y143 PolarHBondContact O-N 3.3Å; Y143-A146 PolarHBondContact O-N 3.14Å; Y143-S147 WeakPolarHBondContact O-CB 3.16Å; Y143-S147 PolarHBondContact O-N 3.11Å; Y143-L177 HydrophobicContact CD1-CB 4.21Å; Y143-L177 HydrophobicContact CD1-CD1 3.73Å; Y143-L177 HydrophobicContact CD2-CB 3.72Å; Y143-L177 HydrophobicContact CD2-CD1 4.44Å; Y143-L177 HydrophobicContact CE1-CB 4.41Å; Y143-L177 HydrophobicContact CE1-CD1 3.36Å; Y143-L177 HydrophobicContact CE1-CG 4.45Å; Y143-L177 HydrophobicContact CE2-CB 3.92Å; Y143-L177 HydrophobicContact CE2-CD1 4.11Å; Y143-L177 HydrophobicContact CE2-CG 4.46Å; Y143-L177 HydrophobicContact CG-CB 3.88Å; Y143-L177 HydrophobicContact CG-CD1 4.27Å
144	N	82	Confident	77.5	Confident	89 Å²	89	40.5 Å²	40.5	48%	0.476	20%	0.202	S	C	.	.	H	α-helix	trans	-64.3	-48.5	-179.4	-70.7	-33.1	0	0	0	111.9	A146 S147 E148 V178	N144-A146 VanDerWaalsContact C-N 3.32Å; N144-A146 PolarHBondContact O-N 2.93Å; N144-S147 PolarHBondContact O-N 3.21Å; N144-S147 PolarHBondContact O-OG 3.28Å; N144-E148 PolarHBondContact O-N 3.48Å; N144-E148 VanDerWaalsContact O-N 3.1Å; N144-V178 VanDerWaalsContact OD1-CG1 3.29Å; N144-V178 WeakPolarHBondContact OD1-CG1 3.25Å; N144-V178 WeakPolarHBondContact OD1-CG2 3.2Å
145	L	79.2	Confident	77	Confident	47 Å²	47	44 Å²	44	25%	0.246	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-40.4	177.5	-67.1	-176	0	0	0	110.8	N142 S147 E148 Y149	N142-L145 VanDerWaalsContact ND2-CD1 3.28Å; N142-L145 WeakPolarHBondContact ND2-CD1 3.36Å; L145-S147 VanDerWaalsContact C-N 3.31Å; L145-S147 PolarHBondContact O-N 3.1Å; L145-E148 PolarHBondContact O-N 3.44Å; L145-Y149 HydrophobicContact CB-CD2 4.41Å; L145-Y149 HydrophobicContact CB-CE2 4.03Å; L145-Y149 WeakPolarHBondContact O-CD2 3.37Å; L145-Y149 PolarHBondContact O-N 2.97Å
146	A	80.8	Confident	76	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.1	-42.7	175.7	0	0	0	0	0	111.5	F137 N142 Y143 N144 Y149 L150	F137-A146 HydrophobicContact CB-CB 4.25Å; N142-A146 PolarHBondContact O-N 3.49Å; Y143-A146 PolarHBondContact O-N 3.14Å; N144-A146 VanDerWaalsContact C-N 3.32Å; N144-A146 PolarHBondContact O-N 2.93Å; A146-Y149 PolarHBondContact O-N 3.11Å; A146-L150 VanDerWaalsContact O-CB 3.32Å; A146-L150 WeakPolarHBondContact O-CB 3.3Å; A146-L150 WeakPolarHBondContact O-CG 3.26Å; A146-L150 PolarHBondContact O-N 3.31Å
147	S	79.1	Confident	75.3	Confident	11 Å²	11	35.2 Å²	35.2	8%	0.077	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-40.1	-179.9	89.2	0	0	0	0	112.3	Y143 N144 L145 L150 K151 S174 E175	Y143-S147 WeakPolarHBondContact O-CB 3.16Å; Y143-S147 PolarHBondContact O-N 3.11Å; N144-S147 PolarHBondContact O-N 3.21Å; N144-S147 PolarHBondContact O-OG 3.28Å; L145-S147 VanDerWaalsContact C-N 3.31Å; L145-S147 PolarHBondContact O-N 3.1Å; S147-L150 PolarHBondContact O-N 3.35Å; S147-K151 WeakPolarHBondContact O-CB 3.38Å; S147-K151 PolarHBondContact O-N 3.01Å; S147-S174 VanDerWaalsContact CB-OG 3.26Å; S147-S174 WeakPolarHBondContact CB-OG 3.4Å; S147-E175 WeakPolarHBondContact CB-OE1 3.37Å; S147-E175 PolarHBondContact OG-OE1 3.15Å
148	E	76.2	Confident	74.3	Confident	108 Å²	108	37.8 Å²	37.8	51%	0.505	20%	0.199	S	C	.	.	H	α-helix	trans	-61.5	-47.8	173.9	-72.2	-177.6	174.4	0	0	112	N144 L145 L150 K151 I152	N144-E148 PolarHBondContact O-N 3.48Å; N144-E148 VanDerWaalsContact O-N 3.1Å; L145-E148 PolarHBondContact O-N 3.44Å; E148-L150 PolarHBondContact O-N 2.85Å; E148-K151 WeakPolarHBondContact O-CB 3.42Å; E148-K151 PolarHBondContact O-N 2.99Å; E148-I152 WeakPolarHBondContact O-CG1 3.45Å; E148-I152 PolarHBondContact O-N 3.34Å
149	Y	75.9	Confident	73.1	Confident	17 Å²	17	41.7 Å²	41.7	7%	0.067	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-43.1	176.7	-68.7	-57.1	0	0	0	111.6	L88 K92 F137 L145 A146 K151 I152 V153	L88-Y149 HydrophobicContact CD1-CE2 4.41Å; L88-Y149 HydrophobicContact CD2-CE1 4.1Å; K92-Y149 WeakPolarHBondContact CE-OH 3.12Å; F137-Y149 AromaticContact CD2-CD2 3.83Å; F137-Y149 HydrophobicContact CD2-CD2 3.83Å; F137-Y149 AromaticContact CD2-CE2 3.61Å; F137-Y149 HydrophobicContact CD2-CE2 3.61Å; F137-Y149 AromaticContact CE2-CD2 3.98Å; F137-Y149 HydrophobicContact CE2-CD2 3.98Å; F137-Y149 AromaticContact CE2-CE2 3.34Å; F137-Y149 HydrophobicContact CE2-CE2 3.34Å; F137-Y149 HydrophobicContact CZ-CE2 4.22Å; L145-Y149 HydrophobicContact CB-CD2 4.41Å; L145-Y149 HydrophobicContact CB-CE2 4.03Å; L145-Y149 WeakPolarHBondContact O-CD2 3.37Å; L145-Y149 PolarHBondContact O-N 2.97Å; A146-Y149 PolarHBondContact O-N 3.11Å; Y149-K151 VanDerWaalsContact C-N 3.33Å; Y149-K151 PolarHBondContact O-N 3.07Å; Y149-I152 WeakPolarHBondContact O-CB 3.07Å; Y149-I152 PolarHBondContact O-N 2.81Å; Y149-V153 WeakPolarHBondContact O-CB 3.05Å; Y149-V153 WeakPolarHBondContact O-CG2 3.38Å; Y149-V153 PolarHBondContact O-N 3.46Å
150	L	77.7	Confident	71.9	Confident	9 Å²	9	42.5 Å²	42.5	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-69.6	-30.8	179.3	-69.1	174.7	0	0	0	112.3	A134 A146 S147 E148 V153 R154 A167 R171	A134-L150 HydrophobicContact CB-CD1 4.46Å; A134-L150 HydrophobicContact CB-CD2 3.72Å; A134-L150 HydrophobicContact CB-CG 3.85Å; A146-L150 VanDerWaalsContact O-CB 3.32Å; A146-L150 WeakPolarHBondContact O-CB 3.3Å; A146-L150 WeakPolarHBondContact O-CG 3.26Å; A146-L150 PolarHBondContact O-N 3.31Å; S147-L150 PolarHBondContact O-N 3.35Å; E148-L150 PolarHBondContact O-N 2.85Å; L150-V153 PolarHBondContact O-N 3.36Å; L150-R154 WeakPolarHBondContact O-CB 3.42Å; L150-R154 PolarHBondContact O-N 3.42Å; L150-A167 HydrophobicContact CD2-CB 4.28Å; L150-R171 HydrophobicContact CB-CB 4.04Å; L150-R171 HydrophobicContact CD1-CB 4.37Å
151	K	76.1	Confident	71.2	Confident	70 Å²	70	44.2 Å²	44.2	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-63.6	-45	172.1	-176.9	165.2	-167.5	165	0	111.1	S147 E148 Y149 R154 Q155 E183	S147-K151 WeakPolarHBondContact O-CB 3.38Å; S147-K151 PolarHBondContact O-N 3.01Å; E148-K151 WeakPolarHBondContact O-CB 3.42Å; E148-K151 PolarHBondContact O-N 2.99Å; Y149-K151 VanDerWaalsContact C-N 3.33Å; Y149-K151 PolarHBondContact O-N 3.07Å; K151-R154 PolarHBondContact O-N 3.28Å; K151-Q155 WeakPolarHBondContact O-CG 3.29Å; K151-Q155 PolarHBondContact O-N 3.43Å; K151-E183 IonicContact NZ-OE1 2.97Å; K151-E183 PolarHBondContact NZ-OE1 2.89Å; K151-E183 IonicContact NZ-OE2 2.96Å; K151-E183 PolarHBondContact NZ-OE2 3.47Å
152	I	72.7	Confident	70.9	Confident	22 Å²	22	50.4 Å²	50.4	11%	0.113	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-51.4	173.8	-69.4	164.7	0	0	0	110.3	F95 M130 E148 Y149 R154 Q155 L156	F95-I152 HydrophobicContact CD1-CD1 3.62Å; F95-I152 HydrophobicContact CD1-CG1 4.15Å; F95-I152 HydrophobicContact CD1-CG2 4.43Å; F95-I152 HydrophobicContact CE1-CB 4.3Å; F95-I152 HydrophobicContact CE1-CD1 3.75Å; F95-I152 HydrophobicContact CE1-CG1 3.8Å; F95-I152 HydrophobicContact CE1-CG2 3.51Å; F95-I152 HydrophobicContact CE2-CG2 3.85Å; F95-I152 HydrophobicContact CG-CD1 4.04Å; F95-I152 HydrophobicContact CZ-CB 4.37Å; F95-I152 HydrophobicContact CZ-CD1 4.29Å; F95-I152 HydrophobicContact CZ-CG1 4.34Å; F95-I152 HydrophobicContact CZ-CG2 3.18Å; M130-I152 HydrophobicContact CE-CG2 4.33Å; M130-I152 HydrophobicContact SD-CG2 4.46Å; E148-I152 WeakPolarHBondContact O-CG1 3.45Å; E148-I152 PolarHBondContact O-N 3.34Å; Y149-I152 WeakPolarHBondContact O-CB 3.07Å; Y149-I152 PolarHBondContact O-N 2.81Å; I152-R154 VanDerWaalsContact C-N 3.29Å; I152-R154 PolarHBondContact O-N 3.21Å; I152-Q155 PolarHBondContact O-N 2.93Å; I152-Q155 VanDerWaalsContact O-N 3.09Å; I152-L156 HydrophobicContact CG2-CD1 3.66Å; I152-L156 HydrophobicContact CG2-CG 4.39Å; I152-L156 VanDerWaalsContact O-CG 3.29Å; I152-L156 WeakPolarHBondContact O-CG 3.22Å; I152-L156 PolarHBondContact O-N 2.8Å; I152-L156 VanDerWaalsContact O-N 3.1Å
153	V	71	Confident	70.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.2	-42.2	-180	166.8	0	0	0	0	111.3	M130 F131 Y149 L150 Q155 L156 V157 A167	M130-V153 HydrophobicContact CB-CG2 3.82Å; M130-V153 HydrophobicContact SD-CG2 4.01Å; F131-V153 HydrophobicContact CD2-CG1 3.84Å; F131-V153 HydrophobicContact CE1-CG1 3.94Å; F131-V153 HydrophobicContact CE2-CG1 3.15Å; F131-V153 HydrophobicContact CG-CG1 4.48Å; F131-V153 HydrophobicContact CZ-CG1 3.22Å; Y149-V153 WeakPolarHBondContact O-CB 3.05Å; Y149-V153 WeakPolarHBondContact O-CG2 3.38Å; Y149-V153 PolarHBondContact O-N 3.46Å; L150-V153 PolarHBondContact O-N 3.36Å; V153-Q155 VanDerWaalsContact C-N 3.29Å; V153-Q155 PolarHBondContact O-N 2.9Å; V153-L156 PolarHBondContact O-N 3.46Å; V153-L156 VanDerWaalsContact O-N 3.13Å; V153-V157 HydrophobicContact CG1-CG2 3.97Å; V153-V157 VanDerWaalsContact O-CG2 3.26Å; V153-V157 WeakPolarHBondContact O-CG2 3.43Å; V153-V157 PolarHBondContact O-N 3.33Å; V153-A167 HydrophobicContact CG1-CB 4.16Å
154	R	66.4	Low	69.7	Low	29 Å²	29	51.2 Å²	51.2	11%	0.109	28%	0.275	C	S	.	.	H	α-helix	trans	-60.4	-36.8	177.9	-178.5	-168.6	171	126.7	48.1	112.7	L150 K151 I152 D187 K190	L150-R154 WeakPolarHBondContact O-CB 3.42Å; L150-R154 PolarHBondContact O-N 3.42Å; K151-R154 PolarHBondContact O-N 3.28Å; I152-R154 VanDerWaalsContact C-N 3.29Å; I152-R154 PolarHBondContact O-N 3.21Å; R154-D187 IonicContact CZ-OD1 2.81Å; R154-D187 IonicContact NH1-OD1 2.81Å; R154-D187 PolarHBondContact NH1-OD1 3.32Å; R154-K190 VanDerWaalsContact NH1-CD 3.3Å
155	Q	66.7	Low	69.4	Low	78 Å²	78	47.4 Å²	47.4	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-75.2	-28.2	177.7	-71.4	168.2	-26.9	0	0	112.3	V103 K151 I152 V153	V103-Q155 HydrophobicContact CG1-CB 4.39Å; K151-Q155 WeakPolarHBondContact O-CG 3.29Å; K151-Q155 PolarHBondContact O-N 3.43Å; I152-Q155 PolarHBondContact O-N 2.93Å; I152-Q155 VanDerWaalsContact O-N 3.09Å; V153-Q155 VanDerWaalsContact C-N 3.29Å; V153-Q155 PolarHBondContact O-N 2.9Å
156	L	58.8	Low	69.4	Low	3 Å²	3	49.7 Å²	49.7	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-85.5	-27.7	-179.8	-64.1	173.1	0	0	0	113.5	F95 L116 L127 I152 V153	F95-L156 HydrophobicContact CZ-CD1 4.43Å; L116-L156 HydrophobicContact CD1-CD2 3.19Å; L127-L156 HydrophobicContact CD1-CB 4.21Å; I152-L156 HydrophobicContact CG2-CD1 3.66Å; I152-L156 HydrophobicContact CG2-CG 4.39Å; I152-L156 VanDerWaalsContact O-CG 3.29Å; I152-L156 WeakPolarHBondContact O-CG 3.22Å; I152-L156 PolarHBondContact O-N 2.8Å; I152-L156 VanDerWaalsContact O-N 3.1Å; V153-L156 PolarHBondContact O-N 3.46Å; V153-L156 VanDerWaalsContact O-N 3.13Å
157	V	64.1	Low	69.3	Low	14 Å²	14	49.7 Å²	49.7	9%	0.085	27%	0.267	C	S	.	.	S	Bend	trans	-88.2	125.5	-178.2	179.5	0	0	0	0	110.9	L127 F131 V153 H164	L127-V157 HydrophobicContact CD1-CG2 3.8Å; L127-V157 HydrophobicContact CD2-CG2 4.12Å; L127-V157 HydrophobicContact CG-CG2 4.41Å; F131-V157 HydrophobicContact CE2-CG2 4.2Å; V153-V157 HydrophobicContact CG1-CG2 3.97Å; V153-V157 VanDerWaalsContact O-CG2 3.26Å; V153-V157 WeakPolarHBondContact O-CG2 3.43Å; V153-V157 PolarHBondContact O-N 3.33Å; V157-H164 HydrophobicContact CG1-CB 3.9Å
158	T	58.4	Low	69.4	Low	60 Å²	60	49.2 Å²	49.2	37%	0.368	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-53	130.8	174	-33.2	0	0	0	0	111.2	G160	T158-G160 PolarHBondContact O-N 3.19Å
159	P	55.1	Low	69.8	Low	104 Å²	104	45.2 Å²	45.2	68%	0.675	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	124.4	176.5	23.9	-32	0	0	0	109.4
160	G	55.8	Low	70.2	Confident	66 Å²	66	45.5 Å²	45.5	68%	0.68	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.3	-15.8	177.9	0	0	0	0	0	115.9	T158	T158-G160 PolarHBondContact O-N 3.19Å
161	T	62	Low	70.4	Confident	70 Å²	70	45.5 Å²	45.5	43%	0.429	25%	0.251	S	S	.	.	S	Bend	trans	-81.6	143.3	176.3	-51.3	0	0	0	0	110.6	R163 H164	T161-R163 HydrophobicContact CG2-CB 4.19Å; T161-R163 HydrophobicContact CG2-CG 4.35Å; T161-R163 PolarHBondContact O-N 3.24Å; T161-H164 WeakPolarHBondContact O-CA 3.49Å; T161-H164 VanDerWaalsContact O-CB 3.27Å; T161-H164 WeakPolarHBondContact O-CB 3.32Å; T161-H164 PolarHBondContact O-N 3.37Å
162	Q	68.5	Low	70.8	Confident	156 Å²	156	42.2 Å²	42.2	73%	0.729	24%	0.237	S	C	*	.	H	α-helix	trans	-47.6	-38	174.2	-73.3	-179.4	-18.6	0	0	112.7	H164 L165 D166	Q162-H164 VanDerWaalsContact C-N 3.29Å; Q162-H164 PolarHBondContact O-N 3.49Å; Q162-L165 WeakPolarHBondContact O-CB 3.35Å; Q162-L165 PolarHBondContact O-N 3.12Å; Q162-D166 PolarHBondContact O-N 3.13Å
163	R	66.8	Low	71.5	Confident	104 Å²	104	41.2 Å²	41.2	39%	0.392	23%	0.232	S	C	.	.	H	α-helix	trans	-60	-32.1	175.3	-65.5	-179.5	177.7	-169.5	-11.8	114.3	N128 F131 T161 L165 A167	N128-R163 PolarHBondContact OD1-NH1 3.35Å; N128-R163 PolarHBondContact OD1-NH2 3.36Å; F131-R163 HydrophobicContact CE2-CB 4.17Å; F131-R163 HydrophobicContact CZ-CB 3.87Å; F131-R163 VanDerWaalsContact CZ-O 3.25Å; F131-R163 WeakPolarHBondContact CZ-O 3.08Å; T161-R163 HydrophobicContact CG2-CB 4.19Å; T161-R163 HydrophobicContact CG2-CG 4.35Å; T161-R163 PolarHBondContact O-N 3.24Å; R163-L165 VanDerWaalsContact C-N 3.34Å; R163-A167 VanDerWaalsContact O-CB 3.31Å; R163-A167 WeakPolarHBondContact O-CB 3.47Å; R163-A167 PolarHBondContact O-N 2.93Å
164	H	70.4	Confident	72.1	Confident	19 Å²	19	41.2 Å²	41.2	9%	0.088	23%	0.232	C	C	.	.	H	α-helix	trans	-67.6	-39	174.9	-173.6	86.9	0	0	0	111.1	V157 T161 Q162 S168	V157-H164 HydrophobicContact CG1-CB 3.9Å; T161-H164 WeakPolarHBondContact O-CA 3.49Å; T161-H164 VanDerWaalsContact O-CB 3.27Å; T161-H164 WeakPolarHBondContact O-CB 3.32Å; T161-H164 PolarHBondContact O-N 3.37Å; Q162-H164 VanDerWaalsContact C-N 3.29Å; Q162-H164 PolarHBondContact O-N 3.49Å; H164-S168 WeakPolarHBondContact O-CB 3.2Å; H164-S168 PolarHBondContact O-N 3.31Å; H164-S168 PolarHBondContact O-OG 3.42Å
165	L	76.5	Confident	72.9	Confident	9 Å²	9	40 Å²	40	5%	0.047	23%	0.228	C	C	.	.	H	α-helix	trans	-66.6	-46.8	175.7	-178.2	135.3	0	0	0	110.1	Q162 R163 A167 S168 W169 I195	Q162-L165 WeakPolarHBondContact O-CB 3.35Å; Q162-L165 PolarHBondContact O-N 3.12Å; R163-L165 VanDerWaalsContact C-N 3.34Å; L165-A167 PolarHBondContact O-N 3.38Å; L165-S168 WeakPolarHBondContact O-CB 3.1Å; L165-S168 PolarHBondContact O-N 3.14Å; L165-S168 VanDerWaalsContact O-N 3.12Å; L165-W169 VanDerWaalsContact CD2-CD1 3.41Å; L165-W169 VanDerWaalsContact CD2-NE1 3.31Å; L165-W169 PolarHBondContact O-N 3.16Å; L165-I195 HydrophobicContact CD1-CD1 4.37Å; L165-I195 HydrophobicContact CD1-CG1 3.69Å
166	D	78.1	Confident	73.8	Confident	94 Å²	94	36.7 Å²	36.7	50%	0.503	21%	0.212	S	C	.	.	H	α-helix	trans	-61.1	-42.1	177.1	-60.4	-27.2	0	0	0	112.1	Q162 S168 W169 G170	Q162-D166 PolarHBondContact O-N 3.13Å; D166-S168 VanDerWaalsContact C-N 3.32Å; D166-S168 PolarHBondContact O-N 2.87Å; D166-W169 PolarHBondContact O-N 3.48Å; D166-G170 PolarHBondContact O-N 2.82Å
167	A	79.5	Confident	75	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-40	173.9	0	0	0	0	0	112.4	F131 L150 V153 R163 L165 G170 R171	F131-A167 HydrophobicContact CE1-CB 3.67Å; F131-A167 HydrophobicContact CZ-CB 3.75Å; L150-A167 HydrophobicContact CD2-CB 4.28Å; V153-A167 HydrophobicContact CG1-CB 4.16Å; R163-A167 VanDerWaalsContact O-CB 3.31Å; R163-A167 WeakPolarHBondContact O-CB 3.47Å; R163-A167 PolarHBondContact O-N 2.93Å; L165-A167 PolarHBondContact O-N 3.38Å; A167-G170 PolarHBondContact O-N 3Å; A167-R171 WeakPolarHBondContact O-CB 3.29Å; A167-R171 PolarHBondContact O-N 2.89Å
168	S	81.7	Confident	76	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.007	23%	0.23	C	C	.	.	H	α-helix	trans	-67.6	-39.2	179.5	-60.3	0	0	0	0	111.4	H164 L165 D166 L172	H164-S168 WeakPolarHBondContact O-CB 3.2Å; H164-S168 PolarHBondContact O-N 3.31Å; H164-S168 PolarHBondContact O-OG 3.42Å; L165-S168 WeakPolarHBondContact O-CB 3.1Å; L165-S168 PolarHBondContact O-N 3.14Å; L165-S168 VanDerWaalsContact O-N 3.12Å; D166-S168 VanDerWaalsContact C-N 3.32Å; D166-S168 PolarHBondContact O-N 2.87Å; S168-L172 WeakPolarHBondContact O-CB 3.06Å; S168-L172 PolarHBondContact O-N 2.87Å
169	W	84.7	Confident	77.2	Confident	24 Å²	24	43.8 Å²	43.8	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-49.4	172.2	-76.1	112.9	0	0	0	112.1	L165 D166 R171 L172 A173 L191 I195 Q214 W217 M218 W221	L165-W169 VanDerWaalsContact CD2-CD1 3.41Å; L165-W169 VanDerWaalsContact CD2-NE1 3.31Å; L165-W169 PolarHBondContact O-N 3.16Å; D166-W169 PolarHBondContact O-N 3.48Å; W169-R171 PolarHBondContact O-N 3.44Å; W169-L172 PolarHBondContact O-N 2.74Å; W169-A173 PolarHBondContact O-N 3.45Å; W169-L191 HydrophobicContact CD2-CD1 4.24Å; W169-L191 HydrophobicContact CD2-CD2 3.94Å; W169-L191 HydrophobicContact CE3-CD2 3.82Å; W169-L191 HydrophobicContact CG-CD1 4.42Å; W169-L191 HydrophobicContact CH2-CD2 3.88Å; W169-L191 HydrophobicContact CZ2-CD1 4.4Å; W169-L191 HydrophobicContact CZ2-CD2 3.98Å; W169-L191 HydrophobicContact CZ3-CD2 3.8Å; W169-I195 HydrophobicContact CZ2-CD1 3.87Å; W169-Q214 HydrophobicContact CZ2-CB 4.35Å; W169-W217 HydrophobicContact CH2-CB 3.76Å; W169-W217 HydrophobicContact CZ2-CB 4.44Å; W169-W217 HydrophobicContact CZ3-CB 4.28Å; W169-M218 HydrophobicContact CH2-CB 3.8Å; W169-M218 HydrophobicContact CZ2-CB 4.5Å; W169-W221 AromaticContact CE3-CD2 3.99Å; W169-W221 HydrophobicContact CE3-CD2 3.99Å; W169-W221 AromaticContact CE3-CE3 3.64Å; W169-W221 HydrophobicContact CE3-CE3 3.64Å; W169-W221 AromaticContact CE3-CH2 3.77Å; W169-W221 HydrophobicContact CE3-CH2 3.77Å; W169-W221 HydrophobicContact CE3-CZ2 4.12Å; W169-W221 AromaticContact CE3-CZ3 3.52Å; W169-W221 HydrophobicContact CE3-CZ3 3.52Å; W169-W221 AromaticContact CZ3-CD2 3.69Å; W169-W221 HydrophobicContact CZ3-CD2 3.69Å; W169-W221 AromaticContact CZ3-CE3 3.75Å; W169-W221 HydrophobicContact CZ3-CE3 3.75Å; W169-W221 HydrophobicContact CZ3-CG 4.11Å; W169-W221 HydrophobicContact CZ3-CH2 4.39Å; W169-W221 HydrophobicContact CZ3-CZ2 4.35Å; W169-W221 HydrophobicContact CZ3-CZ3 4.1Å; W169-W221 WeakPolarHBondContact O-CZ3 3.42Å
170	G	83	Confident	78.5	Confident	22 Å²	22	41.3 Å²	41.3	23%	0.227	23%	0.226	C	C	.	.	H	α-helix	trans	-58.5	-40.1	178.2	0	0	0	0	0	111.9	D166 A167 A173 S174	D166-G170 PolarHBondContact O-N 2.82Å; A167-G170 PolarHBondContact O-N 3Å; G170-A173 PolarHBondContact O-N 3.29Å; G170-S174 PolarHBondContact O-N 3.2Å; G170-S174 PolarHBondContact O-OG 2.79Å
171	R	83.2	Confident	79.8	Confident	10 Å²	10	40.6 Å²	40.6	4%	0.038	20%	0.202	C	C	.	.	H	α-helix	trans	-66.8	-48.4	178	-174.3	173.3	166.2	-171.2	-13.8	111.4	L150 A167 W169 A173 S174 E175 E183 D187	L150-R171 HydrophobicContact CB-CB 4.04Å; L150-R171 HydrophobicContact CD1-CB 4.37Å; A167-R171 WeakPolarHBondContact O-CB 3.29Å; A167-R171 PolarHBondContact O-N 2.89Å; W169-R171 PolarHBondContact O-N 3.44Å; R171-A173 VanDerWaalsContact C-N 3.26Å; R171-A173 PolarHBondContact O-N 3.29Å; R171-S174 WeakPolarHBondContact CA-OG 3.42Å; R171-S174 PolarHBondContact O-N 2.86Å; R171-S174 VanDerWaalsContact O-N 3.13Å; R171-S174 PolarHBondContact O-OG 3.18Å; R171-E175 HydrophobicContact CG-CG 4.33Å; R171-E175 WeakPolarHBondContact O-CG 3.31Å; R171-E175 PolarHBondContact O-N 3.18Å; R171-E183 IonicContact NH2-OE2 2.91Å; R171-E183 PolarHBondContact NH2-OE2 2.88Å; R171-D187 WeakPolarHBondContact CD-OD2 3.21Å; R171-D187 IonicContact CZ-OD1 3.68Å; R171-D187 IonicContact CZ-OD2 2.98Å; R171-D187 VanDerWaalsContact NE-CG 3.33Å; R171-D187 IonicContact NE-OD1 2.81Å; R171-D187 PolarHBondContact NE-OD1 3.2Å; R171-D187 IonicContact NE-OD2 3.74Å; R171-D187 PolarHBondContact NE-OD2 3.48Å; R171-D187 IonicContact NH1-OD1 3.31Å; R171-D187 PolarHBondContact NH1-OD1 3.42Å; R171-D187 IonicContact NH2-OD1 2.94Å; R171-D187 PolarHBondContact NH2-OD1 3.37Å; R171-D187 VanDerWaalsContact NH2-OD1 3.14Å; R171-D187 IonicContact NH2-OD2 3.31Å; R171-D187 PolarHBondContact NH2-OD2 2.79Å; R171-D187 VanDerWaalsContact NH2-OD2 3.13Å
172	L	84.4	Confident	80.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.3	-42.1	177	-177.9	63.7	0	0	0	111.3	S168 W169 E175 I176 A184 D187 L188 L191 W221 V225	S168-L172 WeakPolarHBondContact O-CB 3.06Å; S168-L172 PolarHBondContact O-N 2.87Å; W169-L172 PolarHBondContact O-N 2.74Å; L172-E175 PolarHBondContact O-N 3.1Å; L172-I176 HydrophobicContact CD1-CD1 4.14Å; L172-I176 HydrophobicContact CD1-CG1 4.41Å; L172-I176 HydrophobicContact CG-CD1 3.93Å; L172-I176 WeakPolarHBondContact O-CD1 3.41Å; L172-I176 WeakPolarHBondContact O-CG1 3.29Å; L172-I176 PolarHBondContact O-N 3.17Å; L172-A184 HydrophobicContact CD1-CB 4.36Å; L172-D187 HydrophobicContact CD1-CB 4.5Å; L172-L188 HydrophobicContact CD1-CB 4.36Å; L172-L188 HydrophobicContact CD2-CD1 4.07Å; L172-L191 HydrophobicContact CD2-CD2 3.68Å; L172-W221 HydrophobicContact CB-CE3 4.36Å; L172-W221 HydrophobicContact CB-CZ3 4.39Å; L172-W221 HydrophobicContact CD2-CB 4.3Å; L172-W221 HydrophobicContact CD2-CE3 3.72Å; L172-W221 HydrophobicContact CD2-CZ3 4.45Å; L172-W221 HydrophobicContact CG-CE3 3.94Å; L172-W221 HydrophobicContact CG-CZ3 4.45Å; L172-V225 HydrophobicContact CD1-CG2 4.38Å
173	A	86	Confident	81.3	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-62.6	-45.2	176.5	0	0	0	0	0	112	Y138 W169 G170 R171 I176 L177 W221	Y138-A173 HydrophobicContact CE2-CB 3.77Å; Y138-A173 WeakPolarHBondContact OH-CB 3.43Å; W169-A173 PolarHBondContact O-N 3.45Å; G170-A173 PolarHBondContact O-N 3.29Å; R171-A173 VanDerWaalsContact C-N 3.26Å; R171-A173 PolarHBondContact O-N 3.29Å; A173-I176 PolarHBondContact O-N 2.71Å; A173-L177 WeakPolarHBondContact O-CD1 3.4Å; A173-L177 WeakPolarHBondContact O-CG 3.17Å; A173-L177 PolarHBondContact O-N 3.24Å; A173-L177 VanDerWaalsContact O-N 3.12Å; A173-W221 HydrophobicContact CB-CH2 3.88Å; A173-W221 HydrophobicContact CB-CZ3 3.64Å
174	S	83.4	Confident	82	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.8	-43.5	177.5	59.7	0	0	0	0	112.7	S147 G170 R171 I176 L177 V178	S147-S174 VanDerWaalsContact CB-OG 3.26Å; S147-S174 WeakPolarHBondContact CB-OG 3.4Å; G170-S174 PolarHBondContact O-N 3.2Å; G170-S174 PolarHBondContact O-OG 2.79Å; R171-S174 WeakPolarHBondContact CA-OG 3.42Å; R171-S174 PolarHBondContact O-N 2.86Å; R171-S174 VanDerWaalsContact O-N 3.13Å; R171-S174 PolarHBondContact O-OG 3.18Å; S174-I176 PolarHBondContact O-N 3.05Å; S174-L177 PolarHBondContact O-N 3.24Å; S174-V178 VanDerWaalsContact O-CG2 3.27Å; S174-V178 WeakPolarHBondContact O-CG2 3.27Å; S174-V178 PolarHBondContact O-N 3.12Å
175	E	83.8	Confident	82.6	Confident	5 Å²	5	32.2 Å²	32.2	2%	0.023	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-37.5	179.7	-67.7	-62.1	143.1	0	0	112	S147 R171 L172 L177 V178 Q179 N180 A184	S147-E175 WeakPolarHBondContact CB-OE1 3.37Å; S147-E175 PolarHBondContact OG-OE1 3.15Å; R171-E175 HydrophobicContact CG-CG 4.33Å; R171-E175 WeakPolarHBondContact O-CG 3.31Å; R171-E175 PolarHBondContact O-N 3.18Å; L172-E175 PolarHBondContact O-N 3.1Å; E175-L177 VanDerWaalsContact C-N 3.31Å; E175-L177 PolarHBondContact O-N 3.4Å; E175-V178 PolarHBondContact O-N 2.81Å; E175-Q179 PolarHBondContact O-N 3.07Å; E175-N180 PolarHBondContact O-N 3.37Å; E175-N180 VanDerWaalsContact O-N 3.15Å; E175-N180 WeakPolarHBondContact OE2-CB 3.44Å; E175-N180 PolarHBondContact OE2-ND2 3.24Å; E175-N180 VanDerWaalsContact OE2-ND2 3.13Å; E175-A184 HydrophobicContact CB-CB 4.07Å
176	I	85	Confident	82.9	Confident	8 Å²	8	36.6 Å²	36.6	4%	0.041	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-40.7	174.1	-68.6	166.1	0	0	0	110.7	L18 L172 A173 S174 Q179 W181 W221 F224 V225	L18-I176 HydrophobicContact CD2-CB 4.07Å; L18-I176 HydrophobicContact CD2-CG2 3.49Å; L18-I176 VanDerWaalsContact CD2-CG2 3.49Å; L172-I176 HydrophobicContact CD1-CD1 4.14Å; L172-I176 HydrophobicContact CD1-CG1 4.41Å; L172-I176 HydrophobicContact CG-CD1 3.93Å; L172-I176 WeakPolarHBondContact O-CD1 3.41Å; L172-I176 WeakPolarHBondContact O-CG1 3.29Å; L172-I176 PolarHBondContact O-N 3.17Å; A173-I176 PolarHBondContact O-N 2.71Å; S174-I176 PolarHBondContact O-N 3.05Å; I176-Q179 PolarHBondContact O-N 2.82Å; I176-W181 HydrophobicContact CG2-CH2 4.38Å; I176-W181 HydrophobicContact CG2-CZ3 4.26Å; I176-W221 HydrophobicContact CD1-CB 4.44Å; I176-W221 HydrophobicContact CD1-CE3 4.34Å; I176-F224 HydrophobicContact CD1-CB 4.41Å; I176-F224 HydrophobicContact CG2-CB 3.93Å; I176-F224 HydrophobicContact CG2-CD1 4.31Å; I176-F224 HydrophobicContact CG2-CG 4.16Å; I176-V225 HydrophobicContact CD1-CG2 4.19Å; I176-V225 HydrophobicContact CG1-CG2 3.99Å
177	L	84.3	Confident	83	Confident	34 Å²	34	32.1 Å²	32.1	18%	0.178	16%	0.162	C	C	.	.	H	α-helix	trans	-74.4	-32.3	-179.6	-69.2	165.9	0	0	0	112.9	H17 L18 P21 Y138 Y143 A173 S174 E175 Q179	H17-L177 HydrophobicContact CB-CD1 3.7Å; L18-L177 HydrophobicContact CD2-CD2 3.97Å; L18-L177 HydrophobicContact CD2-CG 3.97Å; P21-L177 HydrophobicContact CG-CD2 4.41Å; Y138-L177 HydrophobicContact CE2-CD1 3.93Å; Y143-L177 HydrophobicContact CD1-CB 4.21Å; Y143-L177 HydrophobicContact CD1-CD1 3.73Å; Y143-L177 HydrophobicContact CD2-CB 3.72Å; Y143-L177 HydrophobicContact CD2-CD1 4.44Å; Y143-L177 HydrophobicContact CE1-CB 4.41Å; Y143-L177 HydrophobicContact CE1-CD1 3.36Å; Y143-L177 HydrophobicContact CE1-CG 4.45Å; Y143-L177 HydrophobicContact CE2-CB 3.92Å; Y143-L177 HydrophobicContact CE2-CD1 4.11Å; Y143-L177 HydrophobicContact CE2-CG 4.46Å; Y143-L177 HydrophobicContact CG-CB 3.88Å; Y143-L177 HydrophobicContact CG-CD1 4.27Å; A173-L177 WeakPolarHBondContact O-CD1 3.4Å; A173-L177 WeakPolarHBondContact O-CG 3.17Å; A173-L177 PolarHBondContact O-N 3.24Å; A173-L177 VanDerWaalsContact O-N 3.12Å; S174-L177 PolarHBondContact O-N 3.24Å; E175-L177 VanDerWaalsContact C-N 3.31Å; E175-L177 PolarHBondContact O-N 3.4Å; L177-Q179 PolarHBondContact O-N 3.22Å
178	V	86.3	Confident	83.1	Confident	50 Å²	50	32.1 Å²	32.1	30%	0.303	16%	0.162	S	C	.	.	H	α-helix	trans	-72.6	-16.9	171.9	175.2	0	0	0	0	112	N144 S174 E175 N180	N144-V178 VanDerWaalsContact OD1-CG1 3.29Å; N144-V178 WeakPolarHBondContact OD1-CG1 3.25Å; N144-V178 WeakPolarHBondContact OD1-CG2 3.2Å; S174-V178 VanDerWaalsContact O-CG2 3.27Å; S174-V178 WeakPolarHBondContact O-CG2 3.27Å; S174-V178 PolarHBondContact O-N 3.12Å; E175-V178 PolarHBondContact O-N 2.81Å; V178-N180 HydrophobicContact CG1-CB 4.41Å
179	Q	82.1	Confident	83.1	Confident	141 Å²	141	36.1 Å²	36.1	66%	0.659	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.9	30.5	-176.3	-49.8	178.7	-4.9	0	0	114	E175 I176 L177 W181	E175-Q179 PolarHBondContact O-N 3.07Å; I176-Q179 PolarHBondContact O-N 2.82Å; L177-Q179 PolarHBondContact O-N 3.22Å; Q179-W181 HydrophobicContact CB-CZ2 4.01Å; Q179-W181 HydrophobicContact CG-CZ2 4.29Å; Q179-W181 PolarHBondContact O-N 3.25Å; Q179-W181 PolarHBondContact O-NE1 3.28Å
180	N	83.8	Confident	82.9	Confident	53 Å²	53	38.4 Å²	38.4	28%	0.283	19%	0.191	S	C	.	.			trans	-95.5	90.8	175.5	-174.8	13.9	0	0	0	110.7	E175 V178 D182 E183 A184	E175-N180 PolarHBondContact O-N 3.37Å; E175-N180 VanDerWaalsContact O-N 3.15Å; E175-N180 WeakPolarHBondContact OE2-CB 3.44Å; E175-N180 PolarHBondContact OE2-ND2 3.24Å; E175-N180 VanDerWaalsContact OE2-ND2 3.13Å; V178-N180 HydrophobicContact CG1-CB 4.41Å; N180-D182 PolarHBondContact O-N 3.31Å; N180-E183 WeakPolarHBondContact ND2-CG 3.05Å; N180-A184 VanDerWaalsContact O-CB 3.29Å; N180-A184 WeakPolarHBondContact O-CB 3.39Å; N180-A184 PolarHBondContact O-N 3.3Å
181	W	81.9	Confident	82.8	Confident	51 Å²	51	37.3 Å²	37.3	19%	0.193	18%	0.181	C	C	.	.	H	α-helix	trans	-74	-26.9	-169.3	-52.6	111.1	0	0	0	114.4	I176 Q179 L185 F224 N228 H229	I176-W181 HydrophobicContact CG2-CH2 4.38Å; I176-W181 HydrophobicContact CG2-CZ3 4.26Å; Q179-W181 HydrophobicContact CB-CZ2 4.01Å; Q179-W181 HydrophobicContact CG-CZ2 4.29Å; Q179-W181 PolarHBondContact O-N 3.25Å; Q179-W181 PolarHBondContact O-NE1 3.28Å; W181-L185 PolarHBondContact O-N 3.48Å; W181-F224 HydrophobicContact CZ3-CB 4.41Å; W181-F224 VanDerWaalsContact CZ3-O 3.25Å; W181-F224 WeakPolarHBondContact CZ3-O 3.09Å; W181-N228 HydrophobicContact CD2-CB 3.58Å; W181-N228 HydrophobicContact CE3-CB 4.07Å; W181-N228 HydrophobicContact CG-CB 4.04Å; W181-N228 HydrophobicContact CH2-CB 4.16Å; W181-N228 WeakPolarHBondContact CH2-ND2 3.43Å; W181-N228 HydrophobicContact CZ2-CB 3.68Å; W181-N228 WeakPolarHBondContact CZ2-ND2 3.34Å; W181-N228 HydrophobicContact CZ3-CB 4.32Å; W181-H229 HydrophobicContact CB-CB 4.43Å
182	D	82.4	Confident	82.6	Confident	101 Å²	101	39.2 Å²	39.2	54%	0.54	19%	0.189	S	C	.	.	H	α-helix	trans	-73.7	-47	-177.7	-65.7	-28.2	0	0	0	111.3	N180 A184 L185 E186 H229	N180-D182 PolarHBondContact O-N 3.31Å; D182-A184 VanDerWaalsContact C-N 3.33Å; D182-L185 PolarHBondContact O-N 2.97Å; D182-E186 PolarHBondContact O-N 3.15Å; D182-H229 IonicContact OD1-CE1 2.65Å; D182-H229 PolarHBondContact OD1-CE1 3.09Å; D182-H229 IonicContact OD1-ND1 2.69Å; D182-H229 PolarHBondContact OD1-ND1 3.05Å
183	E	80.4	Confident	82.3	Confident	57 Å²	57	43.6 Å²	43.6	27%	0.266	21%	0.213	S	C	.	.	H	α-helix	trans	-66.2	-37.2	173.1	-70.7	-154.8	-156.7	0	0	111.5	K151 R171 N180 L185 E186 D187	K151-E183 IonicContact NZ-OE1 2.97Å; K151-E183 PolarHBondContact NZ-OE1 2.89Å; K151-E183 IonicContact NZ-OE2 2.96Å; K151-E183 PolarHBondContact NZ-OE2 3.47Å; R171-E183 IonicContact NH2-OE2 2.91Å; R171-E183 PolarHBondContact NH2-OE2 2.88Å; N180-E183 WeakPolarHBondContact ND2-CG 3.05Å; E183-L185 VanDerWaalsContact C-N 3.25Å; E183-L185 PolarHBondContact O-N 2.81Å; E183-E186 PolarHBondContact O-N 2.83Å; E183-D187 WeakPolarHBondContact O-CB 3.47Å; E183-D187 PolarHBondContact O-N 3.31Å
184	A	81.8	Confident	81.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-34.8	176.2	0	0	0	0	0	112.4	L172 E175 N180 D182 D187 L188 V225	L172-A184 HydrophobicContact CD1-CB 4.36Å; E175-A184 HydrophobicContact CB-CB 4.07Å; N180-A184 VanDerWaalsContact O-CB 3.29Å; N180-A184 WeakPolarHBondContact O-CB 3.39Å; N180-A184 PolarHBondContact O-N 3.3Å; D182-A184 VanDerWaalsContact C-N 3.33Å; A184-D187 PolarHBondContact O-N 3.13Å; A184-L188 VanDerWaalsContact O-CB 3.24Å; A184-L188 WeakPolarHBondContact O-CB 3.43Å; A184-L188 PolarHBondContact O-N 2.91Å; A184-V225 HydrophobicContact CB-CG1 4.1Å; A184-V225 HydrophobicContact CB-CG2 3.92Å
185	L	82	Confident	81.4	Confident	14 Å²	14	44.5 Å²	44.5	7%	0.073	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-45.7	177	-169.1	151.9	0	0	0	111.4	W181 D182 E183 D187 L188 E189 V225 K235	W181-L185 PolarHBondContact O-N 3.48Å; D182-L185 PolarHBondContact O-N 2.97Å; E183-L185 VanDerWaalsContact C-N 3.25Å; E183-L185 PolarHBondContact O-N 2.81Å; L185-D187 VanDerWaalsContact C-N 3.31Å; L185-D187 PolarHBondContact O-N 3.35Å; L185-L188 WeakPolarHBondContact O-CB 3.35Å; L185-L188 PolarHBondContact O-N 3.46Å; L185-E189 HydrophobicContact CD2-CG 4.23Å; L185-E189 VanDerWaalsContact CD2-OE1 3.29Å; L185-E189 WeakPolarHBondContact CD2-OE1 3.33Å; L185-E189 PolarHBondContact O-N 2.88Å; L185-V225 HydrophobicContact CB-CG1 4.28Å; L185-K235 HydrophobicContact CD1-CD 3.83Å; L185-K235 HydrophobicContact CD2-CD 4.49Å
186	E	82.2	Confident	80.8	Confident	101 Å²	101	46.4 Å²	46.4	47%	0.472	23%	0.23	S	C	.	.	H	α-helix	trans	-63	-40.3	175	-67.7	-168.2	-173.3	0	0	111.9	D182 E183 L188 E189 K190	D182-E186 PolarHBondContact O-N 3.15Å; E183-E186 PolarHBondContact O-N 2.83Å; E186-L188 VanDerWaalsContact C-N 3.3Å; E186-L188 PolarHBondContact O-N 3.37Å; E186-E189 PolarHBondContact O-N 2.94Å; E186-K190 WeakPolarHBondContact O-CB 3.45Å; E186-K190 WeakPolarHBondContact O-CD 3.47Å; E186-K190 WeakPolarHBondContact O-CG 3.48Å; E186-K190 PolarHBondContact O-N 3.22Å; E186-K190 IonicContact OE2-NZ 2.76Å; E186-K190 PolarHBondContact OE2-NZ 3.4Å
187	D	81.4	Confident	79.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-35.1	178.5	-73.2	-33.9	0	0	0	111.6	R154 R171 L172 E183 A184 L185 L191	R154-D187 IonicContact CZ-OD1 2.81Å; R154-D187 IonicContact NH1-OD1 2.81Å; R154-D187 PolarHBondContact NH1-OD1 3.32Å; R171-D187 WeakPolarHBondContact CD-OD2 3.21Å; R171-D187 IonicContact CZ-OD1 3.68Å; R171-D187 IonicContact CZ-OD2 2.98Å; R171-D187 VanDerWaalsContact NE-CG 3.33Å; R171-D187 IonicContact NE-OD1 2.81Å; R171-D187 PolarHBondContact NE-OD1 3.2Å; R171-D187 IonicContact NE-OD2 3.74Å; R171-D187 PolarHBondContact NE-OD2 3.48Å; R171-D187 IonicContact NH1-OD1 3.31Å; R171-D187 PolarHBondContact NH1-OD1 3.42Å; R171-D187 IonicContact NH2-OD1 2.94Å; R171-D187 PolarHBondContact NH2-OD1 3.37Å; R171-D187 VanDerWaalsContact NH2-OD1 3.14Å; R171-D187 IonicContact NH2-OD2 3.31Å; R171-D187 PolarHBondContact NH2-OD2 2.79Å; R171-D187 VanDerWaalsContact NH2-OD2 3.13Å; L172-D187 HydrophobicContact CD1-CB 4.5Å; E183-D187 WeakPolarHBondContact O-CB 3.47Å; E183-D187 PolarHBondContact O-N 3.31Å; A184-D187 PolarHBondContact O-N 3.13Å; L185-D187 VanDerWaalsContact C-N 3.31Å; L185-D187 PolarHBondContact O-N 3.35Å; D187-L191 VanDerWaalsContact O-CB 3.23Å; D187-L191 WeakPolarHBondContact O-CB 3.2Å; D187-L191 PolarHBondContact O-N 3.06Å
188	L	82.3	Confident	78.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-46	173.6	-176.5	72.1	0	0	0	112.3	L172 A184 L185 E186 K190 L191 K192 M218 F226 W239	L172-L188 HydrophobicContact CD1-CB 4.36Å; L172-L188 HydrophobicContact CD2-CD1 4.07Å; A184-L188 VanDerWaalsContact O-CB 3.24Å; A184-L188 WeakPolarHBondContact O-CB 3.43Å; A184-L188 PolarHBondContact O-N 2.91Å; L185-L188 WeakPolarHBondContact O-CB 3.35Å; L185-L188 PolarHBondContact O-N 3.46Å; E186-L188 VanDerWaalsContact C-N 3.3Å; E186-L188 PolarHBondContact O-N 3.37Å; L188-K190 VanDerWaalsContact C-N 3.33Å; L188-K190 PolarHBondContact O-N 3.15Å; L188-L191 PolarHBondContact O-N 3.26Å; L188-K192 PolarHBondContact O-N 3.05Å; L188-M218 HydrophobicContact CD1-CG 3.93Å; L188-F226 HydrophobicContact CD2-CE1 4.31Å; L188-F226 HydrophobicContact CD2-CE2 3.82Å; L188-F226 HydrophobicContact CD2-CZ 3.61Å; L188-W239 HydrophobicContact CD1-CH2 3.61Å; L188-W239 HydrophobicContact CD1-CZ2 4.47Å; L188-W239 HydrophobicContact CD1-CZ3 4.09Å; L188-W239 HydrophobicContact CD2-CH2 3.81Å; L188-W239 HydrophobicContact CD2-CZ2 4.13Å; L188-W239 HydrophobicContact CD2-CZ3 4.11Å; L188-W239 HydrophobicContact CG-CH2 3.44Å; L188-W239 VanDerWaalsContact CG-CH2 3.44Å; L188-W239 HydrophobicContact CG-CZ2 3.84Å; L188-W239 HydrophobicContact CG-CZ3 4.14Å
189	E	81.4	Confident	77	Confident	86 Å²	86	53 Å²	53	40%	0.402	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-45.7	175.8	-75.3	-179.9	-178	0	0	110.7	L185 E186 L191 K192 D193 K235	L185-E189 HydrophobicContact CD2-CG 4.23Å; L185-E189 VanDerWaalsContact CD2-OE1 3.29Å; L185-E189 WeakPolarHBondContact CD2-OE1 3.33Å; L185-E189 PolarHBondContact O-N 2.88Å; E186-E189 PolarHBondContact O-N 2.94Å; E189-L191 VanDerWaalsContact C-N 3.35Å; E189-L191 PolarHBondContact O-N 3.47Å; E189-K192 WeakPolarHBondContact O-CB 3.36Å; E189-K192 PolarHBondContact O-N 3.12Å; E189-D193 PolarHBondContact O-N 3.04Å; E189-K235 IonicContact OE1-NZ 3.13Å; E189-K235 PolarHBondContact OE1-NZ 3.37Å
190	K	78.9	Confident	75.5	Confident	71 Å²	71	54.7 Å²	54.7	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-70.8	-29.1	178.3	-59.2	160.7	-173.2	150	0	112.9	R154 E186 L188 D193 A194	R154-K190 VanDerWaalsContact NH1-CD 3.3Å; E186-K190 WeakPolarHBondContact O-CB 3.45Å; E186-K190 WeakPolarHBondContact O-CD 3.47Å; E186-K190 WeakPolarHBondContact O-CG 3.48Å; E186-K190 PolarHBondContact O-N 3.22Å; E186-K190 IonicContact OE2-NZ 2.76Å; E186-K190 PolarHBondContact OE2-NZ 3.4Å; L188-K190 VanDerWaalsContact C-N 3.33Å; L188-K190 PolarHBondContact O-N 3.15Å; K190-D193 PolarHBondContact O-N 3.41Å; K190-A194 WeakPolarHBondContact O-CB 3.48Å; K190-A194 PolarHBondContact O-N 3.11Å
191	L	82	Confident	73.8	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.1	-38.7	173	176.9	65.5	0	0	0	110.7	W169 L172 D187 L188 E189 A194 I195 M218	W169-L191 HydrophobicContact CD2-CD1 4.24Å; W169-L191 HydrophobicContact CD2-CD2 3.94Å; W169-L191 HydrophobicContact CE3-CD2 3.82Å; W169-L191 HydrophobicContact CG-CD1 4.42Å; W169-L191 HydrophobicContact CH2-CD2 3.88Å; W169-L191 HydrophobicContact CZ2-CD1 4.4Å; W169-L191 HydrophobicContact CZ2-CD2 3.98Å; W169-L191 HydrophobicContact CZ3-CD2 3.8Å; L172-L191 HydrophobicContact CD2-CD2 3.68Å; D187-L191 VanDerWaalsContact O-CB 3.23Å; D187-L191 WeakPolarHBondContact O-CB 3.2Å; D187-L191 PolarHBondContact O-N 3.06Å; L188-L191 PolarHBondContact O-N 3.26Å; E189-L191 VanDerWaalsContact C-N 3.35Å; E189-L191 PolarHBondContact O-N 3.47Å; L191-A194 PolarHBondContact O-N 2.87Å; L191-I195 HydrophobicContact CD1-CD1 4.03Å; L191-I195 HydrophobicContact CD1-CG1 4.46Å; L191-I195 HydrophobicContact CG-CD1 4.07Å; L191-I195 WeakPolarHBondContact O-CG1 3.37Å; L191-I195 PolarHBondContact O-N 3.04Å; L191-M218 HydrophobicContact CD2-CG 4.38Å
192	K	78.5	Confident	72.3	Confident	49 Å²	49	65.9 Å²	65.9	21%	0.213	33%	0.325	C	S	.	.	H	α-helix	trans	-59.4	-49.5	171.1	175.1	-173.1	169.5	-169.5	0	110.8	L188 E189 A194 I195 D196 M218 W239	L188-K192 PolarHBondContact O-N 3.05Å; E189-K192 WeakPolarHBondContact O-CB 3.36Å; E189-K192 PolarHBondContact O-N 3.12Å; K192-A194 VanDerWaalsContact C-N 3.29Å; K192-A194 PolarHBondContact O-N 3.39Å; K192-I195 PolarHBondContact O-N 3.45Å; K192-I195 VanDerWaalsContact O-N 3.15Å; K192-D196 PolarHBondContact O-N 2.89Å; K192-M218 HydrophobicContact CB-CE 4.15Å; K192-M218 HydrophobicContact CB-SD 4.21Å; K192-W239 HydrophobicContact CB-CH2 4.02Å; K192-W239 HydrophobicContact CB-CZ2 3.62Å; K192-W239 HydrophobicContact CD-CH2 4.38Å; K192-W239 HydrophobicContact CD-CZ2 3.5Å; K192-W239 HydrophobicContact CG-CZ2 4.06Å
193	D	78.2	Confident	70.6	Confident	93 Å²	93	66.4 Å²	66.4	50%	0.497	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-42.4	176.7	-67.2	-19.5	0	0	0	111.2	E189 K190 I195 D196 C197	E189-D193 PolarHBondContact O-N 3.04Å; K190-D193 PolarHBondContact O-N 3.41Å; D193-I195 VanDerWaalsContact C-N 3.33Å; D193-I195 PolarHBondContact O-N 3.18Å; D193-D196 PolarHBondContact O-N 2.92Å; D193-C197 VanDerWaalsContact O-CB 3.23Å; D193-C197 WeakPolarHBondContact O-CB 3.38Å; D193-C197 PolarHBondContact O-N 3.38Å; D193-C197 PolarHBondContact O-SG 3.3Å
194	A	75	Confident	69.4	Low	20 Å²	20	66 Å²	66	17%	0.165	34%	0.34	C	S	.	.	H	α-helix	trans	-62.6	-36.9	177.2	0	0	0	0	0	113.1	K190 L191 K192 Q198	K190-A194 WeakPolarHBondContact O-CB 3.48Å; K190-A194 PolarHBondContact O-N 3.11Å; L191-A194 PolarHBondContact O-N 2.87Å; K192-A194 VanDerWaalsContact C-N 3.29Å; K192-A194 PolarHBondContact O-N 3.39Å; A194-Q198 WeakPolarHBondContact O-CG 3.43Å; A194-Q198 PolarHBondContact O-N 3.1Å
195	I	75.3	Confident	68.1	Low	0 Å²	0	71 Å²	71	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-75	-38.6	177.9	-75	170.5	0	0	0	111.2	L165 W169 L191 K192 D193 Q198 Q214 R215 M218	L165-I195 HydrophobicContact CD1-CD1 4.37Å; L165-I195 HydrophobicContact CD1-CG1 3.69Å; W169-I195 HydrophobicContact CZ2-CD1 3.87Å; L191-I195 HydrophobicContact CD1-CD1 4.03Å; L191-I195 HydrophobicContact CD1-CG1 4.46Å; L191-I195 HydrophobicContact CG-CD1 4.07Å; L191-I195 WeakPolarHBondContact O-CG1 3.37Å; L191-I195 PolarHBondContact O-N 3.04Å; K192-I195 PolarHBondContact O-N 3.45Å; K192-I195 VanDerWaalsContact O-N 3.15Å; D193-I195 VanDerWaalsContact C-N 3.33Å; D193-I195 PolarHBondContact O-N 3.18Å; I195-Q198 WeakPolarHBondContact O-CB 3.35Å; I195-Q198 PolarHBondContact O-N 3.14Å; I195-Q214 HydrophobicContact CD1-CB 4.05Å; I195-R215 HydrophobicContact CG2-CG 3.98Å; I195-M218 HydrophobicContact CB-CE 3.96Å; I195-M218 HydrophobicContact CD1-CE 3.26Å; I195-M218 HydrophobicContact CG1-CE 4.1Å; I195-M218 HydrophobicContact CG2-CE 4.21Å
196	D	71.3	Confident	67	Low	44 Å²	44	80.3 Å²	80.3	24%	0.235	41%	0.409	C	S	.	.	H	α-helix	trans	-73.7	-32.1	177.7	-73.3	-26	0	0	0	112.2	K192 D193 Q198 N199 R215	K192-D196 PolarHBondContact O-N 2.89Å; D193-D196 PolarHBondContact O-N 2.92Å; D196-Q198 PolarHBondContact O-N 3.04Å; D196-N199 VanDerWaalsContact O-CB 3.32Å; D196-N199 WeakPolarHBondContact O-CB 3.43Å; D196-N199 VanDerWaalsContact O-CG 3.27Å; D196-N199 PolarHBondContact O-N 3.13Å; D196-N199 PolarHBondContact O-ND2 3.22Å; D196-R215 IonicContact OD1-CZ 3.99Å; D196-R215 IonicContact OD1-NE 3.02Å; D196-R215 IonicContact OD1-NH2 3.59Å; D196-R215 PolarHBondContact OD1-NH2 3.47Å
197	C	64.7	Low	66.3	Low	92 Å²	92	77.3 Å²	77.3	62%	0.622	40%	0.398	S	S	*	.	H	α-helix	trans	-68.8	-17.5	172.9	-74.8	0	0	0	0	113.6	D193 N199 E200	D193-C197 VanDerWaalsContact O-CB 3.23Å; D193-C197 WeakPolarHBondContact O-CB 3.38Å; D193-C197 PolarHBondContact O-N 3.38Å; D193-C197 PolarHBondContact O-SG 3.3Å; C197-N199 PolarHBondContact O-N 3.1Å; C197-E200 PolarHBondContact O-N 3.08Å
198	Q	58.3	Low	65.8	Low	50 Å²	50	83.3 Å²	83.3	23%	0.234	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-9.3	172.1	-63.8	-157	-20.4	0	0	113.2	A194 I195 D196 E200	A194-Q198 WeakPolarHBondContact O-CG 3.43Å; A194-Q198 PolarHBondContact O-N 3.1Å; I195-Q198 WeakPolarHBondContact O-CB 3.35Å; I195-Q198 PolarHBondContact O-N 3.14Å; D196-Q198 PolarHBondContact O-N 3.04Å; Q198-E200 VanDerWaalsContact C-N 3.26Å; Q198-E200 PolarHBondContact O-N 2.81Å
199	N	53.9	Low	65.7	Low	90 Å²	90	89 Å²	89	48%	0.481	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-17.6	178.7	-72.3	-32.7	0	0	0	114.4	D196 C197 Q211	D196-N199 VanDerWaalsContact O-CB 3.32Å; D196-N199 WeakPolarHBondContact O-CB 3.43Å; D196-N199 VanDerWaalsContact O-CG 3.27Å; D196-N199 PolarHBondContact O-N 3.13Å; D196-N199 PolarHBondContact O-ND2 3.22Å; C197-N199 PolarHBondContact O-N 3.1Å; N199-Q211 PolarHBondContact OD1-NE2 3.03Å
200	E	51	Low	65.6	Low	175 Å²	175	89 Å²	89	82%	0.818	45%	0.453	S	S	*	.	S	Bend	trans	-83.7	-27.8	-176	-60.6	-154.2	154.8	0	0	113.4	C197 Q198	C197-E200 PolarHBondContact O-N 3.08Å; Q198-E200 VanDerWaalsContact C-N 3.26Å; Q198-E200 PolarHBondContact O-N 2.81Å
201	D	48	Very low	65.6	Low	131 Å²	131	85.8 Å²	85.8	70%	0.701	44%	0.439	S	S	*	.	S	Bend	trans	-107.4	83.6	-173.4	-75.1	-39.6	0	0	0	112.9
202	R	49.2	Very low	65.6	Low	209 Å²	209	87.5 Å²	87.5	79%	0.789	45%	0.448	S	S	*	.			trans	84	108.9	164.7	-52.6	-177.1	-171.7	-173.5	2.6	117.6	A204	R202-A204 PolarHBondContact O-N 2.76Å
203	P	48	Very low	65.9	Low	111 Å²	111	89.4 Å²	89.4	72%	0.721	46%	0.458	S	S	*	.			trans	-78.6	87.5	171.4	32.8	-31.7	0	0	0	110	Y208	P203-Y208 HydrophobicContact CB-CE2 4.37Å
204	A	53.6	Low	66.2	Low	49 Å²	49	86 Å²	86	41%	0.405	44%	0.439	S	S	.	.			trans	-102.9	137.1	161.7	0	0	0	0	0	108.5	R202 R206 T207	R202-A204 PolarHBondContact O-N 2.76Å; A204-R206 PolarHBondContact O-N 2.96Å; A204-T207 WeakPolarHBondContact O-CA 3.17Å; A204-T207 WeakPolarHBondContact O-CB 3.37Å; A204-T207 PolarHBondContact O-N 2.98Å; A204-T207 PolarHBondContact O-OG1 3.31Å
205	S	55.2	Low	66.5	Low	105 Å²	105	86.2 Å²	86.2	73%	0.734	44%	0.435	S	S	*	.	H	α-helix	trans	-53.8	-25.6	-180	-50.7	0	0	0	0	113.9
206	R	58.9	Low	67	Low	209 Å²	209	86.2 Å²	86.2	79%	0.789	44%	0.435	S	S	*	.	H	α-helix	trans	-69.9	-32.7	173.6	-69.5	-175	179	-171.2	-0.5	113	A204 L209 I210	A204-R206 PolarHBondContact O-N 2.96Å; R206-L209 PolarHBondContact O-N 3.16Å; R206-I210 WeakPolarHBondContact O-CG1 3.43Å; R206-I210 PolarHBondContact O-N 3.43Å; R206-I210 VanDerWaalsContact O-N 3.16Å
207	T	67.2	Low	67.8	Low	38 Å²	38	88.2 Å²	88.2	23%	0.233	44%	0.44	C	S	.	.	H	α-helix	trans	-62.5	-43.4	177.7	-48	0	0	0	0	110.5	A204 L209 I210 Q211	A204-T207 WeakPolarHBondContact O-CA 3.17Å; A204-T207 WeakPolarHBondContact O-CB 3.37Å; A204-T207 PolarHBondContact O-N 2.98Å; A204-T207 PolarHBondContact O-OG1 3.31Å; T207-L209 PolarHBondContact O-N 2.91Å; T207-I210 PolarHBondContact O-N 2.94Å; T207-Q211 HydrophobicContact CG2-CG 4.33Å; T207-Q211 WeakPolarHBondContact O-CB 3.33Å; T207-Q211 VanDerWaalsContact O-CG 3.23Å; T207-Q211 WeakPolarHBondContact O-CG 3.13Å; T207-Q211 PolarHBondContact O-N 3.31Å
208	Y	71	Confident	68.8	Low	127 Å²	127	83.8 Å²	83.8	50%	0.498	41%	0.41	S	S	.	.	H	α-helix	trans	-64.5	-36.4	179.2	-64	-71.7	0	0	0	113.6	P203 L212	P203-Y208 HydrophobicContact CB-CE2 4.37Å; Y208-L212 WeakPolarHBondContact O-CB 3.23Å; Y208-L212 PolarHBondContact O-N 2.61Å
209	L	79.5	Confident	70	Confident	119 Å²	119	81.4 Å²	81.4	62%	0.623	40%	0.399	S	S	*	.	H	α-helix	trans	-67.6	-43	175.8	-71	176.5	0	0	0	111.7	R206 T207 L212 Q213	R206-L209 PolarHBondContact O-N 3.16Å; T207-L209 PolarHBondContact O-N 2.91Å; L209-L212 WeakPolarHBondContact O-CB 3.46Å; L209-L212 PolarHBondContact O-N 3.01Å; L209-Q213 PolarHBondContact O-N 3.07Å
210	I	80.9	Confident	71.5	Confident	86 Å²	86	77.2 Å²	77.2	44%	0.441	38%	0.376	S	S	.	.	H	α-helix	trans	-65	-42.4	176.4	-65.9	167.3	0	0	0	110.2	R206 T207 L212 Q213 Q214	R206-I210 WeakPolarHBondContact O-CG1 3.43Å; R206-I210 PolarHBondContact O-N 3.43Å; R206-I210 VanDerWaalsContact O-N 3.16Å; T207-I210 PolarHBondContact O-N 2.94Å; I210-L212 VanDerWaalsContact C-N 3.34Å; I210-L212 PolarHBondContact O-N 3.33Å; I210-Q213 WeakPolarHBondContact O-CB 3.22Å; I210-Q213 PolarHBondContact O-N 3.4Å; I210-Q214 HydrophobicContact CG2-CG 4.41Å; I210-Q214 WeakPolarHBondContact O-CB 3.24Å; I210-Q214 WeakPolarHBondContact O-CG 3.23Å; I210-Q214 PolarHBondContact O-N 2.97Å
211	Q	77.9	Confident	73.2	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.019	34%	0.341	C	S	.	.	H	α-helix	trans	-61.3	-42.1	174.1	-75.1	174.3	-10.3	0	0	111.7	N199 T207 Q213 Q214 R215	N199-Q211 PolarHBondContact OD1-NE2 3.03Å; T207-Q211 HydrophobicContact CG2-CG 4.33Å; T207-Q211 WeakPolarHBondContact O-CB 3.33Å; T207-Q211 VanDerWaalsContact O-CG 3.23Å; T207-Q211 WeakPolarHBondContact O-CG 3.13Å; T207-Q211 PolarHBondContact O-N 3.31Å; Q211-Q213 VanDerWaalsContact C-N 3.33Å; Q211-Q213 PolarHBondContact O-N 3.49Å; Q211-Q214 PolarHBondContact O-N 3.44Å; Q211-R215 WeakPolarHBondContact O-CB 3.39Å; Q211-R215 VanDerWaalsContact O-CG 3.27Å; Q211-R215 WeakPolarHBondContact O-CG 3.47Å; Q211-R215 PolarHBondContact O-N 3.21Å
212	L	82.2	Confident	75	Confident	36 Å²	36	63.5 Å²	63.5	19%	0.188	31%	0.307	C	S	.	.	H	α-helix	trans	-60.8	-45.3	176.3	-170.5	71.8	0	0	0	110.5	Y208 L209 I210 R215 T216 A249 T252 L253	Y208-L212 WeakPolarHBondContact O-CB 3.23Å; Y208-L212 PolarHBondContact O-N 2.61Å; L209-L212 WeakPolarHBondContact O-CB 3.46Å; L209-L212 PolarHBondContact O-N 3.01Å; I210-L212 VanDerWaalsContact C-N 3.34Å; I210-L212 PolarHBondContact O-N 3.33Å; L212-R215 PolarHBondContact O-N 2.93Å; L212-T216 PolarHBondContact O-N 3.26Å; L212-T216 PolarHBondContact O-OG1 3.47Å; L212-A249 HydrophobicContact CD1-CB 3.74Å; L212-T252 HydrophobicContact CD2-CG2 4.32Å; L212-L253 HydrophobicContact CD2-CD1 3.81Å; L212-L253 HydrophobicContact CD2-CG 4.3Å; L212-L253 HydrophobicContact CG-CD1 3.82Å
213	Q	85.2	Confident	76.6	Confident	89 Å²	89	53.6 Å²	53.6	42%	0.416	27%	0.27	S	S	.	.	H	α-helix	trans	-61.9	-46.5	176.5	-177.6	175.3	10.5	0	0	112.2	L209 I210 Q211 R215 T216 W217	L209-Q213 PolarHBondContact O-N 3.07Å; I210-Q213 WeakPolarHBondContact O-CB 3.22Å; I210-Q213 PolarHBondContact O-N 3.4Å; Q211-Q213 VanDerWaalsContact C-N 3.33Å; Q211-Q213 PolarHBondContact O-N 3.49Å; Q213-R215 VanDerWaalsContact C-N 3.34Å; Q213-R215 PolarHBondContact O-N 3.1Å; Q213-T216 WeakPolarHBondContact O-CB 3.47Å; Q213-T216 PolarHBondContact O-N 3.11Å; Q213-T216 VanDerWaalsContact O-N 3.17Å; Q213-W217 HydrophobicContact CG-CD2 4.23Å; Q213-W217 HydrophobicContact CG-CH2 4.32Å; Q213-W217 HydrophobicContact CG-CZ2 3.8Å; Q213-W217 PolarHBondContact O-N 3.19Å
214	Q	83.3	Confident	78.3	Confident	22 Å²	22	48.6 Å²	48.6	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-40.7	177.2	-74.3	175.4	-8.4	0	0	111.9	W169 I195 I210 Q211 W217 M218	W169-Q214 HydrophobicContact CZ2-CB 4.35Å; I195-Q214 HydrophobicContact CD1-CB 4.05Å; I210-Q214 HydrophobicContact CG2-CG 4.41Å; I210-Q214 WeakPolarHBondContact O-CB 3.24Å; I210-Q214 WeakPolarHBondContact O-CG 3.23Å; I210-Q214 PolarHBondContact O-N 2.97Å; Q211-Q214 PolarHBondContact O-N 3.44Å; Q214-W217 PolarHBondContact O-N 2.9Å; Q214-M218 WeakPolarHBondContact O-CB 3.49Å; Q214-M218 PolarHBondContact O-N 3.37Å
215	R	82.2	Confident	79.6	Confident	24 Å²	24	46.3 Å²	46.3	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-43.5	172.8	-75.5	174.1	172.5	155.7	-1.1	111.2	I195 D196 Q211 L212 Q213 W217 M218 L219 A249	I195-R215 HydrophobicContact CG2-CG 3.98Å; D196-R215 IonicContact OD1-CZ 3.99Å; D196-R215 IonicContact OD1-NE 3.02Å; D196-R215 IonicContact OD1-NH2 3.59Å; D196-R215 PolarHBondContact OD1-NH2 3.47Å; Q211-R215 WeakPolarHBondContact O-CB 3.39Å; Q211-R215 VanDerWaalsContact O-CG 3.27Å; Q211-R215 WeakPolarHBondContact O-CG 3.47Å; Q211-R215 PolarHBondContact O-N 3.21Å; L212-R215 PolarHBondContact O-N 2.93Å; Q213-R215 VanDerWaalsContact C-N 3.34Å; Q213-R215 PolarHBondContact O-N 3.1Å; R215-W217 VanDerWaalsContact C-N 3.34Å; R215-W217 PolarHBondContact O-N 3.27Å; R215-M218 WeakPolarHBondContact O-CB 3.26Å; R215-M218 PolarHBondContact O-N 3.37Å; R215-L219 VanDerWaalsContact O-CG 3.3Å; R215-L219 WeakPolarHBondContact O-CG 3.27Å; R215-L219 PolarHBondContact O-N 2.86Å; R215-A249 HydrophobicContact CB-CB 4.48Å
216	T	85.1	Confident	80.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.7	-45.1	175.6	-61.1	0	0	0	0	111.3	F13 L212 Q213 M218 L219 H220 L253 A254	F13-T216 HydrophobicContact CD1-CG2 3.89Å; F13-T216 HydrophobicContact CE1-CG2 3.8Å; F13-T216 HydrophobicContact CG-CG2 4.49Å; F13-T216 HydrophobicContact CZ-CG2 4.35Å; L212-T216 PolarHBondContact O-N 3.26Å; L212-T216 PolarHBondContact O-OG1 3.47Å; Q213-T216 WeakPolarHBondContact O-CB 3.47Å; Q213-T216 PolarHBondContact O-N 3.11Å; Q213-T216 VanDerWaalsContact O-N 3.17Å; T216-M218 VanDerWaalsContact C-N 3.33Å; T216-M218 PolarHBondContact O-N 2.72Å; T216-L219 PolarHBondContact O-N 3Å; T216-H220 PolarHBondContact O-N 3.44Å; T216-H220 PolarHBondContact O-ND1 2.92Å; T216-L253 HydrophobicContact CG2-CB 4.13Å; T216-L253 HydrophobicContact CG2-CD1 4.49Å; T216-L253 VanDerWaalsContact OG1-CD1 3.28Å; T216-L253 WeakPolarHBondContact OG1-CD1 3.37Å; T216-A254 HydrophobicContact CG2-CB 4.05Å
217	W	87.6	Confident	81.6	Confident	86 Å²	86	32.7 Å²	32.7	33%	0.326	15%	0.151	S	C	.	.	H	α-helix	trans	-60	-44.5	174.1	-64.4	-18	0	0	0	111.9	F13 W169 Q213 Q214 R215 L219 H220 W221	F13-W217 AromaticContact CD1-CD1 3.7Å; F13-W217 AromaticContact CD1-NE1 3.8Å; W169-W217 HydrophobicContact CH2-CB 3.76Å; W169-W217 HydrophobicContact CZ2-CB 4.44Å; W169-W217 HydrophobicContact CZ3-CB 4.28Å; Q213-W217 HydrophobicContact CG-CD2 4.23Å; Q213-W217 HydrophobicContact CG-CH2 4.32Å; Q213-W217 HydrophobicContact CG-CZ2 3.8Å; Q213-W217 PolarHBondContact O-N 3.19Å; Q214-W217 PolarHBondContact O-N 2.9Å; R215-W217 VanDerWaalsContact C-N 3.34Å; R215-W217 PolarHBondContact O-N 3.27Å; W217-L219 VanDerWaalsContact C-N 3.28Å; W217-L219 PolarHBondContact O-N 3.25Å; W217-H220 PolarHBondContact O-N 3.39Å; W217-H220 VanDerWaalsContact O-N 3.07Å; W217-W221 PolarHBondContact O-N 3.2Å
218	M	85.7	Confident	82	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.9	-41.7	-178.3	-178	-151.2	-68.7	0	0	110.4	W169 L188 L191 K192 I195 Q214 R215 T216 H220 W221 S222 W239	W169-M218 HydrophobicContact CH2-CB 3.8Å; W169-M218 HydrophobicContact CZ2-CB 4.5Å; L188-M218 HydrophobicContact CD1-CG 3.93Å; L191-M218 HydrophobicContact CD2-CG 4.38Å; K192-M218 HydrophobicContact CB-CE 4.15Å; K192-M218 HydrophobicContact CB-SD 4.21Å; I195-M218 HydrophobicContact CB-CE 3.96Å; I195-M218 HydrophobicContact CD1-CE 3.26Å; I195-M218 HydrophobicContact CG1-CE 4.1Å; I195-M218 HydrophobicContact CG2-CE 4.21Å; Q214-M218 WeakPolarHBondContact O-CB 3.49Å; Q214-M218 PolarHBondContact O-N 3.37Å; R215-M218 WeakPolarHBondContact O-CB 3.26Å; R215-M218 PolarHBondContact O-N 3.37Å; T216-M218 VanDerWaalsContact C-N 3.33Å; T216-M218 PolarHBondContact O-N 2.72Å; M218-H220 PolarHBondContact O-N 3.22Å; M218-W221 PolarHBondContact O-N 3.3Å; M218-S222 VanDerWaalsContact O-CB 3.23Å; M218-S222 WeakPolarHBondContact O-CB 3.33Å; M218-S222 PolarHBondContact O-N 3.17Å; M218-S222 PolarHBondContact O-OG 3.23Å; M218-W239 HydrophobicContact CG-CH2 3.82Å; M218-W239 HydrophobicContact CG-CZ3 3.88Å; M218-W239 HydrophobicContact SD-CH2 3.22Å; M218-W239 WeakPolarHBondContact SD-CH2 3.47Å; M218-W239 HydrophobicContact SD-CZ2 4.27Å; M218-W239 HydrophobicContact SD-CZ3 3.44Å; M218-W239 WeakPolarHBondContact SD-CZ3 3.15Å
219	L	84.8	Confident	82.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.6	-43.6	176.1	-67.7	172.5	0	0	0	111.7	R215 T216 W217 S222 L223 W239 F240 H246 A249 I250 L257	R215-L219 VanDerWaalsContact O-CG 3.3Å; R215-L219 WeakPolarHBondContact O-CG 3.27Å; R215-L219 PolarHBondContact O-N 2.86Å; T216-L219 PolarHBondContact O-N 3Å; W217-L219 VanDerWaalsContact C-N 3.28Å; W217-L219 PolarHBondContact O-N 3.25Å; L219-S222 PolarHBondContact O-N 2.7Å; L219-S222 PolarHBondContact O-OG 2.84Å; L219-L223 PolarHBondContact O-N 3.45Å; L219-W239 HydrophobicContact CD2-CE3 4.45Å; L219-F240 HydrophobicContact CB-CZ 4.29Å; L219-F240 HydrophobicContact CD2-CD2 4.4Å; L219-F240 HydrophobicContact CD2-CE1 4.09Å; L219-F240 HydrophobicContact CD2-CE2 3.96Å; L219-F240 HydrophobicContact CD2-CZ 3.78Å; L219-H246 HydrophobicContact CD1-CB 4.4Å; L219-H246 HydrophobicContact CD2-CB 4.16Å; L219-A249 HydrophobicContact CD1-CB 4.22Å; L219-I250 HydrophobicContact CD1-CD1 4.18Å; L219-I250 HydrophobicContact CD1-CG1 3.7Å; L219-L257 HydrophobicContact CB-CD1 3.87Å; L219-L257 HydrophobicContact CD1-CD1 4.32Å
220	H	85.6	Confident	81.5	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-41.3	176.7	-71.3	86.2	0	0	0	112.3	F13 L14 T216 W217 M218 S222 L223 H256	F13-H220 HydrophobicContact CB-CB 4.34Å; F13-H220 AromaticContact CD2-CE1 3.43Å; F13-H220 VanDerWaalsContact CD2-CE1 3.43Å; F13-H220 WeakPolarHBondContact CD2-CE1 3.21Å; F13-H220 AromaticContact CD2-NE2 3.41Å; F13-H220 WeakPolarHBondContact CD2-NE2 3.5Å; F13-H220 AromaticContact CE2-CE1 3.94Å; F13-H220 AromaticContact CE2-NE2 3.99Å; F13-H220 AromaticContact CG-CE1 3.62Å; F13-H220 AromaticContact CG-ND1 3.87Å; F13-H220 AromaticContact CG-NE2 3.97Å; L14-H220 HydrophobicContact CD2-CB 4.11Å; T216-H220 PolarHBondContact O-N 3.44Å; T216-H220 PolarHBondContact O-ND1 2.92Å; W217-H220 PolarHBondContact O-N 3.39Å; W217-H220 VanDerWaalsContact O-N 3.07Å; M218-H220 PolarHBondContact O-N 3.22Å; H220-S222 VanDerWaalsContact C-N 3.34Å; H220-L223 WeakPolarHBondContact O-CB 3.46Å; H220-L223 PolarHBondContact O-N 2.9Å; H220-H256 AromaticContact CD2-NE2 3.76Å; H220-H256 AromaticContact CE1-NE2 3.86Å; H220-H256 AromaticContact NE2-CE1 3.47Å; H220-H256 PolarHBondContact NE2-CE1 3.13Å; H220-H256 AromaticContact NE2-NE2 2.85Å; H220-H256 PolarHBondContact NE2-NE2 3.09Å
221	W	86.9	Confident	80.9	Confident	19 Å²	19	31.6 Å²	31.6	7%	0.072	16%	0.155	C	C	.	.	H	α-helix	trans	-71.2	-35.1	-179.8	-70.2	36.7	0	0	0	111.2	F13 L14 D15 L18 W169 L172 A173 I176 W217 M218 L223 F224	F13-W221 PolarHBondContact O-NE1 3.45Å; L14-W221 VanDerWaalsContact CD2-CD1 3.4Å; L14-W221 HydrophobicContact CD2-CG 4.36Å; D15-W221 HydrophobicContact CB-CH2 4.28Å; D15-W221 HydrophobicContact CB-CZ2 3.91Å; L18-W221 HydrophobicContact CD1-CD2 3.92Å; L18-W221 HydrophobicContact CD1-CE3 4.17Å; L18-W221 HydrophobicContact CD1-CG 4.43Å; L18-W221 HydrophobicContact CD1-CH2 4.37Å; L18-W221 HydrophobicContact CD1-CZ2 4.12Å; L18-W221 HydrophobicContact CD1-CZ3 4.39Å; W169-W221 AromaticContact CE3-CD2 3.99Å; W169-W221 HydrophobicContact CE3-CD2 3.99Å; W169-W221 AromaticContact CE3-CE3 3.64Å; W169-W221 HydrophobicContact CE3-CE3 3.64Å; W169-W221 AromaticContact CE3-CH2 3.77Å; W169-W221 HydrophobicContact CE3-CH2 3.77Å; W169-W221 HydrophobicContact CE3-CZ2 4.12Å; W169-W221 AromaticContact CE3-CZ3 3.52Å; W169-W221 HydrophobicContact CE3-CZ3 3.52Å; W169-W221 AromaticContact CZ3-CD2 3.69Å; W169-W221 HydrophobicContact CZ3-CD2 3.69Å; W169-W221 AromaticContact CZ3-CE3 3.75Å; W169-W221 HydrophobicContact CZ3-CE3 3.75Å; W169-W221 HydrophobicContact CZ3-CG 4.11Å; W169-W221 HydrophobicContact CZ3-CH2 4.39Å; W169-W221 HydrophobicContact CZ3-CZ2 4.35Å; W169-W221 HydrophobicContact CZ3-CZ3 4.1Å; W169-W221 WeakPolarHBondContact O-CZ3 3.42Å; L172-W221 HydrophobicContact CB-CE3 4.36Å; L172-W221 HydrophobicContact CB-CZ3 4.39Å; L172-W221 HydrophobicContact CD2-CB 4.3Å; L172-W221 HydrophobicContact CD2-CE3 3.72Å; L172-W221 HydrophobicContact CD2-CZ3 4.45Å; L172-W221 HydrophobicContact CG-CE3 3.94Å; L172-W221 HydrophobicContact CG-CZ3 4.45Å; A173-W221 HydrophobicContact CB-CH2 3.88Å; A173-W221 HydrophobicContact CB-CZ3 3.64Å; I176-W221 HydrophobicContact CD1-CB 4.44Å; I176-W221 HydrophobicContact CD1-CE3 4.34Å; W217-W221 PolarHBondContact O-N 3.2Å; M218-W221 PolarHBondContact O-N 3.3Å; W221-L223 PolarHBondContact O-N 3.14Å; W221-F224 WeakPolarHBondContact O-CB 3.45Å; W221-F224 PolarHBondContact O-N 2.99Å; W221-F224 VanDerWaalsContact O-N 3.11Å
222	S	84.3	Confident	80.4	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-28.8	176.2	79.3	0	0	0	0	112.9	M218 L219 H220 F224 V225 F226	M218-S222 VanDerWaalsContact O-CB 3.23Å; M218-S222 WeakPolarHBondContact O-CB 3.33Å; M218-S222 PolarHBondContact O-N 3.17Å; M218-S222 PolarHBondContact O-OG 3.23Å; L219-S222 PolarHBondContact O-N 2.7Å; L219-S222 PolarHBondContact O-OG 2.84Å; H220-S222 VanDerWaalsContact C-N 3.34Å; S222-F224 VanDerWaalsContact C-N 3.29Å; S222-F224 PolarHBondContact O-N 3.43Å; S222-V225 PolarHBondContact O-N 3.49Å; S222-F226 WeakPolarHBondContact O-CB 3.47Å; S222-F226 WeakPolarHBondContact O-CD2 3.25Å; S222-F226 WeakPolarHBondContact O-CG 3.31Å; S222-F226 PolarHBondContact O-N 3.26Å
223	L	84.1	Confident	79.7	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-59	-40.9	174.6	-64	178	0	0	0	111.5	L219 H220 W221 V225 F227 L236 F240 L257 Y260 F327	L219-L223 PolarHBondContact O-N 3.45Å; H220-L223 WeakPolarHBondContact O-CB 3.46Å; H220-L223 PolarHBondContact O-N 2.9Å; W221-L223 PolarHBondContact O-N 3.14Å; L223-V225 VanDerWaalsContact C-N 3.31Å; L223-V225 PolarHBondContact O-N 2.93Å; L223-F227 HydrophobicContact CB-CD2 4.27Å; L223-F227 HydrophobicContact CB-CE2 4.45Å; L223-F227 HydrophobicContact CD2-CE2 3.97Å; L223-F227 VanDerWaalsContact O-CD2 3.27Å; L223-F227 WeakPolarHBondContact O-CD2 3.44Å; L223-F227 PolarHBondContact O-N 2.88Å; L223-F227 VanDerWaalsContact O-N 3.13Å; L223-L236 HydrophobicContact CD2-CD1 4.06Å; L223-F240 HydrophobicContact CD2-CZ 4.24Å; L223-L257 HydrophobicContact CD1-CD2 3.48Å; L223-L257 VanDerWaalsContact CD1-CD2 3.48Å; L223-L257 HydrophobicContact CG-CD2 4.31Å; L223-Y260 HydrophobicContact CD1-CD2 3.52Å; L223-Y260 HydrophobicContact CD1-CE2 3.83Å; L223-Y260 HydrophobicContact CD1-CG 4.12Å; L223-Y260 HydrophobicContact CD2-CD2 4.3Å; L223-Y260 HydrophobicContact CD2-CG 4.21Å; L223-F327 HydrophobicContact CB-CZ 4.49Å
224	F	82.4	Confident	79.1	Confident	6 Å²	6	32.9 Å²	32.9	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-60.5	-42.5	176.9	-72.8	-87.6	0	0	0	112	L14 L22 I176 W181 W221 S222 N228 F326 F327	L14-F224 HydrophobicContact CD1-CE2 3.61Å; L14-F224 HydrophobicContact CD1-CZ 3.69Å; L14-F224 HydrophobicContact CD2-CE2 3.72Å; L14-F224 HydrophobicContact CG-CE2 4.33Å; L22-F224 HydrophobicContact CD1-CZ 4.14Å; L22-F224 HydrophobicContact CD2-CE1 4.27Å; L22-F224 HydrophobicContact CD2-CZ 4.26Å; L22-F224 HydrophobicContact CG-CZ 4.24Å; I176-F224 HydrophobicContact CD1-CB 4.41Å; I176-F224 HydrophobicContact CG2-CB 3.93Å; I176-F224 HydrophobicContact CG2-CD1 4.31Å; I176-F224 HydrophobicContact CG2-CG 4.16Å; W181-F224 HydrophobicContact CZ3-CB 4.41Å; W181-F224 VanDerWaalsContact CZ3-O 3.25Å; W181-F224 WeakPolarHBondContact CZ3-O 3.09Å; W221-F224 WeakPolarHBondContact O-CB 3.45Å; W221-F224 PolarHBondContact O-N 2.99Å; W221-F224 VanDerWaalsContact O-N 3.11Å; S222-F224 VanDerWaalsContact C-N 3.29Å; S222-F224 PolarHBondContact O-N 3.43Å; F224-N228 PolarHBondContact O-ND2 3.5Å; F224-F326 HydrophobicContact CD1-CE1 4.24Å; F224-F326 HydrophobicContact CE1-CD1 4.41Å; F224-F326 AromaticContact CE1-CE1 3.97Å; F224-F326 HydrophobicContact CE1-CE1 3.97Å; F224-F327 HydrophobicContact CB-CE1 4.28Å; F224-F327 AromaticContact CD1-CE1 3.41Å; F224-F327 HydrophobicContact CD1-CE1 3.41Å; F224-F327 VanDerWaalsContact CD1-CE1 3.41Å; F224-F327 AromaticContact CD1-CZ 3.73Å; F224-F327 HydrophobicContact CD1-CZ 3.73Å; F224-F327 HydrophobicContact CD2-CE1 4.11Å; F224-F327 AromaticContact CD2-CZ 3.89Å; F224-F327 HydrophobicContact CD2-CZ 3.89Å; F224-F327 AromaticContact CE1-CE1 3.65Å; F224-F327 HydrophobicContact CE1-CE1 3.65Å; F224-F327 AromaticContact CE1-CZ 3.52Å; F224-F327 HydrophobicContact CE1-CZ 3.52Å; F224-F327 HydrophobicContact CE2-CE1 4.33Å; F224-F327 AromaticContact CE2-CZ 3.72Å; F224-F327 HydrophobicContact CE2-CZ 3.72Å; F224-F327 AromaticContact CG-CE1 3.66Å; F224-F327 HydrophobicContact CG-CE1 3.66Å; F224-F327 AromaticContact CG-CZ 3.91Å; F224-F327 HydrophobicContact CG-CZ 3.91Å; F224-F327 HydrophobicContact CZ-CE1 4.13Å; F224-F327 AromaticContact CZ-CZ 3.54Å; F224-F327 HydrophobicContact CZ-CZ 3.54Å
225	V	81.7	Confident	78.6	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-71.9	-46.4	-177.9	-175.8	0	0	0	0	111	L172 I176 A184 L185 S222 L223 H229	L172-V225 HydrophobicContact CD1-CG2 4.38Å; I176-V225 HydrophobicContact CD1-CG2 4.19Å; I176-V225 HydrophobicContact CG1-CG2 3.99Å; A184-V225 HydrophobicContact CB-CG1 4.1Å; A184-V225 HydrophobicContact CB-CG2 3.92Å; L185-V225 HydrophobicContact CB-CG1 4.28Å; S222-V225 PolarHBondContact O-N 3.49Å; L223-V225 VanDerWaalsContact C-N 3.31Å; L223-V225 PolarHBondContact O-N 2.93Å; V225-H229 WeakPolarHBondContact O-CB 3.41Å; V225-H229 PolarHBondContact O-N 3.31Å
226	F	79.4	Confident	78.3	Confident	5 Å²	5	33.8 Å²	33.8	2%	0.022	16%	0.164	C	C	.	.	H	α-helix	trans	-74.9	-30.8	-172	-70.2	-50.2	0	0	0	114.5	L188 S222 G232 K235 L236 W239	L188-F226 HydrophobicContact CD2-CE1 4.31Å; L188-F226 HydrophobicContact CD2-CE2 3.82Å; L188-F226 HydrophobicContact CD2-CZ 3.61Å; S222-F226 WeakPolarHBondContact O-CB 3.47Å; S222-F226 WeakPolarHBondContact O-CD2 3.25Å; S222-F226 WeakPolarHBondContact O-CG 3.31Å; S222-F226 PolarHBondContact O-N 3.26Å; F226-G232 WeakPolarHBondContact CD1-O 3.48Å; F226-G232 WeakPolarHBondContact O-CA 3.22Å; F226-K235 HydrophobicContact CD1-CB 4.27Å; F226-K235 HydrophobicContact CE1-CB 3.75Å; F226-L236 HydrophobicContact CB-CB 4.05Å; F226-L236 HydrophobicContact CB-CD1 3.75Å; F226-L236 HydrophobicContact CB-CG 4.41Å; F226-L236 HydrophobicContact CD1-CB 4.42Å; F226-L236 HydrophobicContact CD2-CB 3.85Å; F226-L236 HydrophobicContact CD2-CD1 3.95Å; F226-L236 HydrophobicContact CD2-CG 3.97Å; F226-L236 HydrophobicContact CE2-CB 4.38Å; F226-L236 HydrophobicContact CG-CB 3.88Å; F226-L236 HydrophobicContact CG-CD1 4.18Å; F226-L236 HydrophobicContact CG-CG 4.37Å; F226-W239 HydrophobicContact CE2-CD2 4.3Å; F226-W239 HydrophobicContact CE2-CE3 4.07Å; F226-W239 HydrophobicContact CZ-CD2 4.18Å; F226-W239 HydrophobicContact CZ-CE3 4.37Å; F226-W239 HydrophobicContact CZ-CG 4.27Å
227	F	76.9	Confident	77.8	Confident	24 Å²	24	34.3 Å²	34.3	11%	0.105	17%	0.166	C	C	.	.	H	α-helix	trans	-74.8	-26.7	178	-84.4	-69.8	0	0	0	113.2	L223 Y260 F327 L328	L223-F227 HydrophobicContact CB-CD2 4.27Å; L223-F227 HydrophobicContact CB-CE2 4.45Å; L223-F227 HydrophobicContact CD2-CE2 3.97Å; L223-F227 VanDerWaalsContact O-CD2 3.27Å; L223-F227 WeakPolarHBondContact O-CD2 3.44Å; L223-F227 PolarHBondContact O-N 2.88Å; L223-F227 VanDerWaalsContact O-N 3.13Å; F227-Y260 AromaticContact CE2-CD1 3.79Å; F227-Y260 HydrophobicContact CE2-CD1 3.79Å; F227-Y260 HydrophobicContact CE2-CG 4.07Å; F227-Y260 AromaticContact CZ-CD1 3.87Å; F227-Y260 HydrophobicContact CZ-CD1 3.87Å; F227-Y260 HydrophobicContact CZ-CG 4.29Å; F227-F327 HydrophobicContact CB-CB 4.45Å; F227-F327 HydrophobicContact CB-CD1 4.38Å; F227-F327 HydrophobicContact CD2-CB 3.66Å; F227-F327 HydrophobicContact CD2-CD1 4.08Å; F227-F327 HydrophobicContact CD2-CG 4.03Å; F227-F327 HydrophobicContact CE2-CB 3.97Å; F227-F327 HydrophobicContact CE2-CG 4.48Å; F227-F327 HydrophobicContact CG-CB 3.97Å; F227-L328 HydrophobicContact CE1-CD2 3.74Å; F227-L328 HydrophobicContact CZ-CD2 3.73Å
228	N	75.7	Confident	77.2	Confident	80 Å²	80	34.4 Å²	34.4	43%	0.428	17%	0.171	S	C	.	.	H	α-helix	trans	-90.6	-22.7	-179.9	-68	-44.6	0	0	0	113.2	W181 F224	W181-N228 HydrophobicContact CD2-CB 3.58Å; W181-N228 HydrophobicContact CE3-CB 4.07Å; W181-N228 HydrophobicContact CG-CB 4.04Å; W181-N228 HydrophobicContact CH2-CB 4.16Å; W181-N228 WeakPolarHBondContact CH2-ND2 3.43Å; W181-N228 HydrophobicContact CZ2-CB 3.68Å; W181-N228 WeakPolarHBondContact CZ2-ND2 3.34Å; W181-N228 HydrophobicContact CZ3-CB 4.32Å; F224-N228 PolarHBondContact O-ND2 3.5Å
229	H	73.6	Confident	76.6	Confident	24 Å²	24	35.6 Å²	35.6	11%	0.111	18%	0.175	C	C	.	.	S	Bend	trans	-87.1	131.1	176.8	-168.4	72.8	0	0	0	111.6	W181 D182 V225 Q231 G232	W181-H229 HydrophobicContact CB-CB 4.43Å; D182-H229 IonicContact OD1-CE1 2.65Å; D182-H229 PolarHBondContact OD1-CE1 3.09Å; D182-H229 IonicContact OD1-ND1 2.69Å; D182-H229 PolarHBondContact OD1-ND1 3.05Å; V225-H229 WeakPolarHBondContact O-CB 3.41Å; V225-H229 PolarHBondContact O-N 3.31Å; H229-Q231 VanDerWaalsContact C-N 3.28Å; H229-Q231 PolarHBondContact CD2-N 3Å; H229-Q231 PolarHBondContact O-N 2.73Å; H229-G232 PolarHBondContact O-N 3.28Å
230	P	66.5	Low	75.9	Confident	116 Å²	116	35.8 Å²	35.8	75%	0.753	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.9	-176.2	22.6	-33.9	0	0	0	113.9
231	Q	68.2	Low	75	Confident	127 Å²	127	37.3 Å²	37.3	59%	0.593	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-0.3	174.8	-57.7	-179.4	-6.6	0	0	113	H229 K233	H229-Q231 VanDerWaalsContact C-N 3.28Å; H229-Q231 PolarHBondContact CD2-N 3Å; H229-Q231 PolarHBondContact O-N 2.73Å; Q231-K233 VanDerWaalsContact C-N 3.29Å; Q231-K233 PolarHBondContact O-N 2.7Å
232	G	67.6	Low	74	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.6	-28.6	-172.4	0	0	0	0	0	113.3	F226 H229 E234 K235 L236	F226-G232 WeakPolarHBondContact CD1-O 3.48Å; F226-G232 WeakPolarHBondContact O-CA 3.22Å; H229-G232 PolarHBondContact O-N 3.28Å; G232-E234 PolarHBondContact O-N 2.81Å; G232-K235 PolarHBondContact O-N 3.46Å; G232-L236 VanDerWaalsContact O-CB 3.23Å; G232-L236 WeakPolarHBondContact O-CB 3.41Å; G232-L236 PolarHBondContact O-N 3.47Å
233	K	67.6	Low	73.3	Confident	45 Å²	45	44.5 Å²	44.5	20%	0.196	22%	0.219	C	C	.	.	H	α-helix	trans	-61.2	-45.4	-179.5	-64.1	177	-178.4	170.1	0	112.6	Q231 I237 C331 E334	Q231-K233 VanDerWaalsContact C-N 3.29Å; Q231-K233 PolarHBondContact O-N 2.7Å; K233-I237 WeakPolarHBondContact O-CG1 3.46Å; K233-I237 PolarHBondContact O-N 3.48Å; K233-C331 WeakPolarHBondContact CE-SG 3.34Å; K233-E334 IonicContact NZ-OE1 3.17Å; K233-E334 IonicContact NZ-OE2 3.02Å; K233-E334 PolarHBondContact NZ-OE2 3.44Å
234	E	72.8	Confident	72.9	Confident	111 Å²	111	49 Å²	49	52%	0.519	25%	0.246	S	C	.	.	H	α-helix	trans	-69.8	-47	179.2	-66	-174.7	172.1	0	0	110.8	G232 L236 I237 E238	G232-E234 PolarHBondContact O-N 2.81Å; E234-L236 VanDerWaalsContact C-N 3.27Å; E234-L236 PolarHBondContact O-N 3.31Å; E234-I237 PolarHBondContact O-N 3.28Å; E234-I237 VanDerWaalsContact O-N 3.11Å; E234-E238 WeakPolarHBondContact O-CG 3.5Å; E234-E238 PolarHBondContact O-N 3.06Å
235	K	72.8	Confident	72.6	Confident	64 Å²	64	50.8 Å²	50.8	28%	0.278	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-37	176.8	-75.4	-171.8	171.2	-159.4	0	112.5	L185 E189 F226 G232 E238 W239	L185-K235 HydrophobicContact CD1-CD 3.83Å; L185-K235 HydrophobicContact CD2-CD 4.49Å; E189-K235 IonicContact OE1-NZ 3.13Å; E189-K235 PolarHBondContact OE1-NZ 3.37Å; F226-K235 HydrophobicContact CD1-CB 4.27Å; F226-K235 HydrophobicContact CE1-CB 3.75Å; G232-K235 PolarHBondContact O-N 3.46Å; K235-E238 PolarHBondContact O-N 3.01Å; K235-W239 VanDerWaalsContact O-CB 3.32Å; K235-W239 WeakPolarHBondContact O-CB 3.35Å; K235-W239 PolarHBondContact O-N 3.47Å
236	L	76.2	Confident	72.2	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-48	174.6	-173.3	158	0	0	0	110.6	L223 F226 G232 E234 E238 W239 F240 L261 C264	L223-L236 HydrophobicContact CD2-CD1 4.06Å; F226-L236 HydrophobicContact CB-CB 4.05Å; F226-L236 HydrophobicContact CB-CD1 3.75Å; F226-L236 HydrophobicContact CB-CG 4.41Å; F226-L236 HydrophobicContact CD1-CB 4.42Å; F226-L236 HydrophobicContact CD2-CB 3.85Å; F226-L236 HydrophobicContact CD2-CD1 3.95Å; F226-L236 HydrophobicContact CD2-CG 3.97Å; F226-L236 HydrophobicContact CE2-CB 4.38Å; F226-L236 HydrophobicContact CG-CB 3.88Å; F226-L236 HydrophobicContact CG-CD1 4.18Å; F226-L236 HydrophobicContact CG-CG 4.37Å; G232-L236 VanDerWaalsContact O-CB 3.23Å; G232-L236 WeakPolarHBondContact O-CB 3.41Å; G232-L236 PolarHBondContact O-N 3.47Å; E234-L236 VanDerWaalsContact C-N 3.27Å; E234-L236 PolarHBondContact O-N 3.31Å; L236-E238 VanDerWaalsContact C-N 3.28Å; L236-E238 PolarHBondContact O-N 3.19Å; L236-W239 PolarHBondContact O-N 2.86Å; L236-W239 VanDerWaalsContact O-N 3.15Å; L236-F240 HydrophobicContact CD1-CE2 4.26Å; L236-F240 HydrophobicContact CD2-CD2 3.57Å; L236-F240 HydrophobicContact CD2-CE2 3.83Å; L236-F240 HydrophobicContact CD2-CG 4.02Å; L236-F240 HydrophobicContact CG-CD2 3.66Å; L236-F240 HydrophobicContact CG-CE2 3.61Å; L236-F240 WeakPolarHBondContact O-CB 3.49Å; L236-F240 WeakPolarHBondContact O-CD2 3.25Å; L236-F240 PolarHBondContact O-N 3.36Å; L236-L261 HydrophobicContact CD2-CD1 4.18Å; L236-C264 HydrophobicContact CD2-CB 4.25Å
237	I	74.1	Confident	72.2	Confident	10 Å²	10	52 Å²	52	5%	0.051	27%	0.265	C	S	.	.	H	α-helix	trans	-58.7	-45	177.7	-67.6	168.3	0	0	0	110.2	K233 E234 M241 C264 V265 L276	K233-I237 WeakPolarHBondContact O-CG1 3.46Å; K233-I237 PolarHBondContact O-N 3.48Å; E234-I237 PolarHBondContact O-N 3.28Å; E234-I237 VanDerWaalsContact O-N 3.11Å; I237-M241 HydrophobicContact CG2-CG 4.31Å; I237-M241 WeakPolarHBondContact O-CB 3.49Å; I237-M241 WeakPolarHBondContact O-CG 3.14Å; I237-M241 PolarHBondContact O-N 3.44Å; I237-C264 HydrophobicContact CG1-CB 4.36Å; I237-V265 HydrophobicContact CD1-CG2 4.23Å; I237-V265 HydrophobicContact CG1-CG2 4.13Å; I237-L276 HydrophobicContact CG2-CD1 3.7Å; I237-L276 HydrophobicContact CG2-CD2 3.53Å; I237-L276 HydrophobicContact CG2-CG 4.23Å
238	E	75.5	Confident	72.4	Confident	89 Å²	89	54.4 Å²	54.4	42%	0.416	28%	0.279	S	S	.	.	H	α-helix	trans	-61.5	-44.7	176.2	-66.5	-166.7	151.8	0	0	111.7	E234 K235 L236 F240 Q242	E234-E238 WeakPolarHBondContact O-CG 3.5Å; E234-E238 PolarHBondContact O-N 3.06Å; K235-E238 PolarHBondContact O-N 3.01Å; L236-E238 VanDerWaalsContact C-N 3.28Å; L236-E238 PolarHBondContact O-N 3.19Å; E238-F240 PolarHBondContact O-N 2.91Å; E238-Q242 HydrophobicContact CB-CG 4.31Å; E238-Q242 VanDerWaalsContact CG-NE2 3.27Å; E238-Q242 WeakPolarHBondContact O-CA 3.2Å; E238-Q242 WeakPolarHBondContact O-CB 3.31Å; E238-Q242 WeakPolarHBondContact O-CG 3.49Å; E238-Q242 PolarHBondContact O-N 3.29Å; E238-Q242 PolarHBondContact OE1-NE2 3.49Å
239	W	71.4	Confident	72.7	Confident	25 Å²	25	50.6 Å²	50.6	10%	0.095	26%	0.258	C	S	.	.	H	α-helix	trans	-64.1	-41	-180	-116.6	52.6	0	0	0	114	L188 K192 M218 L219 F226 K235 L236 H246	L188-W239 HydrophobicContact CD1-CH2 3.61Å; L188-W239 HydrophobicContact CD1-CZ2 4.47Å; L188-W239 HydrophobicContact CD1-CZ3 4.09Å; L188-W239 HydrophobicContact CD2-CH2 3.81Å; L188-W239 HydrophobicContact CD2-CZ2 4.13Å; L188-W239 HydrophobicContact CD2-CZ3 4.11Å; L188-W239 HydrophobicContact CG-CH2 3.44Å; L188-W239 VanDerWaalsContact CG-CH2 3.44Å; L188-W239 HydrophobicContact CG-CZ2 3.84Å; L188-W239 HydrophobicContact CG-CZ3 4.14Å; K192-W239 HydrophobicContact CB-CH2 4.02Å; K192-W239 HydrophobicContact CB-CZ2 3.62Å; K192-W239 HydrophobicContact CD-CH2 4.38Å; K192-W239 HydrophobicContact CD-CZ2 3.5Å; K192-W239 HydrophobicContact CG-CZ2 4.06Å; M218-W239 HydrophobicContact CG-CH2 3.82Å; M218-W239 HydrophobicContact CG-CZ3 3.88Å; M218-W239 HydrophobicContact SD-CH2 3.22Å; M218-W239 WeakPolarHBondContact SD-CH2 3.47Å; M218-W239 HydrophobicContact SD-CZ2 4.27Å; M218-W239 HydrophobicContact SD-CZ3 3.44Å; M218-W239 WeakPolarHBondContact SD-CZ3 3.15Å; L219-W239 HydrophobicContact CD2-CE3 4.45Å; F226-W239 HydrophobicContact CE2-CD2 4.3Å; F226-W239 HydrophobicContact CE2-CE3 4.07Å; F226-W239 HydrophobicContact CZ-CD2 4.18Å; F226-W239 HydrophobicContact CZ-CE3 4.37Å; F226-W239 HydrophobicContact CZ-CG 4.27Å; K235-W239 VanDerWaalsContact O-CB 3.32Å; K235-W239 WeakPolarHBondContact O-CB 3.35Å; K235-W239 PolarHBondContact O-N 3.47Å; L236-W239 PolarHBondContact O-N 2.86Å; L236-W239 VanDerWaalsContact O-N 3.15Å; W239-H246 PolarHBondContact O-ND1 2.93Å
240	F	71.2	Confident	73.1	Confident	3 Å²	3	49.8 Å²	49.8	1%	0.013	25%	0.254	C	S	.	.	H	α-helix	trans	-79.2	-34.3	-177.2	-81.9	-112.2	0	0	0	111.6	L219 L223 L236 E238 I250 L257 L261	L219-F240 HydrophobicContact CB-CZ 4.29Å; L219-F240 HydrophobicContact CD2-CD2 4.4Å; L219-F240 HydrophobicContact CD2-CE1 4.09Å; L219-F240 HydrophobicContact CD2-CE2 3.96Å; L219-F240 HydrophobicContact CD2-CZ 3.78Å; L223-F240 HydrophobicContact CD2-CZ 4.24Å; L236-F240 HydrophobicContact CD1-CE2 4.26Å; L236-F240 HydrophobicContact CD2-CD2 3.57Å; L236-F240 HydrophobicContact CD2-CE2 3.83Å; L236-F240 HydrophobicContact CD2-CG 4.02Å; L236-F240 HydrophobicContact CG-CD2 3.66Å; L236-F240 HydrophobicContact CG-CE2 3.61Å; L236-F240 WeakPolarHBondContact O-CB 3.49Å; L236-F240 WeakPolarHBondContact O-CD2 3.25Å; L236-F240 PolarHBondContact O-N 3.36Å; E238-F240 PolarHBondContact O-N 2.91Å; F240-I250 HydrophobicContact CD1-CD1 3.27Å; F240-I250 HydrophobicContact CD1-CG1 4.44Å; F240-I250 HydrophobicContact CE1-CD1 3.62Å; F240-I250 HydrophobicContact CE1-CG1 4.37Å; F240-I250 HydrophobicContact CG-CD1 4.29Å; F240-L257 HydrophobicContact CE1-CB 4.41Å; F240-L261 HydrophobicContact CB-CD1 3.87Å; F240-L261 HydrophobicContact CD1-CD1 4.36Å; F240-L261 HydrophobicContact CG-CD1 4.26Å
241	M	66.8	Low	73.8	Confident	33 Å²	33	46.3 Å²	46.3	16%	0.163	23%	0.228	C	C	.	.	H	α-helix	trans	-95.3	-37.1	-175.3	-65.7	-70.7	147.2	0	0	114	I237 L261 L276 L280 L283	I237-M241 HydrophobicContact CG2-CG 4.31Å; I237-M241 WeakPolarHBondContact O-CB 3.49Å; I237-M241 WeakPolarHBondContact O-CG 3.14Å; I237-M241 PolarHBondContact O-N 3.44Å; M241-L261 HydrophobicContact CE-CD1 3.72Å; M241-L261 HydrophobicContact CE-CD2 3.22Å; M241-L261 HydrophobicContact CE-CG 3.82Å; M241-L276 HydrophobicContact CB-CD2 4.46Å; M241-L276 HydrophobicContact CG-CD2 4.09Å; M241-L280 HydrophobicContact CE-CD1 4.47Å; M241-L283 HydrophobicContact CE-CD1 3.65Å; M241-L283 HydrophobicContact SD-CD1 3.96Å
242	Q	65.9	Low	74.4	Confident	138 Å²	138	44.9 Å²	44.9	65%	0.645	23%	0.228	S	C	*	.	H	α-helix	trans	-77.1	-25.5	-175.1	-61.1	177.5	4.4	0	0	112.4	E238	E238-Q242 HydrophobicContact CB-CG 4.31Å; E238-Q242 VanDerWaalsContact CG-NE2 3.27Å; E238-Q242 WeakPolarHBondContact O-CA 3.2Å; E238-Q242 WeakPolarHBondContact O-CB 3.31Å; E238-Q242 WeakPolarHBondContact O-CG 3.49Å; E238-Q242 PolarHBondContact O-N 3.29Å; E238-Q242 PolarHBondContact OE1-NE2 3.49Å
243	N	70	Confident	75.1	Confident	33 Å²	33	48.5 Å²	48.5	18%	0.176	25%	0.247	C	C	.	.			trans	-102.2	101.9	-179.4	-159.4	-6.1	0	0	0	111.8	T245 H246 L247	N243-T245 PolarHBondContact ND2-OG1 3.49Å; N243-T245 PolarHBondContact O-N 3.46Å; N243-T245 VanDerWaalsContact O-N 3.09Å; N243-T245 PolarHBondContact OD1-N 3.26Å; N243-T245 PolarHBondContact OD1-OG1 3.36Å; N243-H246 HydrophobicContact CB-CB 4.32Å; N243-H246 PolarHBondContact ND2-CD2 3.45Å; N243-H246 PolarHBondContact ND2-CE1 3.04Å; N243-H246 PolarHBondContact ND2-NE2 3.12Å; N243-H246 PolarHBondContact O-N 2.93Å; N243-L247 PolarHBondContact O-N 3.23Å
244	T	74.1	Confident	75.5	Confident	94 Å²	94	46.3 Å²	46.3	58%	0.577	24%	0.238	S	C	*	.	H	α-helix	trans	-54.7	-30	177.5	-47.8	0	0	0	0	112.7	L247 N248	T244-L247 PolarHBondContact O-N 3.24Å; T244-N248 VanDerWaalsContact O-CG 3.23Å; T244-N248 PolarHBondContact O-N 2.94Å; T244-N248 PolarHBondContact O-OD1 3.35Å
245	T	76.4	Confident	76	Confident	44 Å²	44	42 Å²	42	27%	0.27	22%	0.219	S	C	.	.	H	α-helix	trans	-69.2	-34.7	179.7	63.6	0	0	0	0	112.9	N243 A249	N243-T245 PolarHBondContact ND2-OG1 3.49Å; N243-T245 PolarHBondContact O-N 3.46Å; N243-T245 VanDerWaalsContact O-N 3.09Å; N243-T245 PolarHBondContact OD1-N 3.26Å; N243-T245 PolarHBondContact OD1-OG1 3.36Å; T245-A249 PolarHBondContact O-N 3.41Å
246	H	72.9	Confident	76.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-72.6	-39.3	176.5	-65.9	-178.3	0	0	0	110.8	L219 W239 N243 N248 A249 I250	L219-H246 HydrophobicContact CD1-CB 4.4Å; L219-H246 HydrophobicContact CD2-CB 4.16Å; W239-H246 PolarHBondContact O-ND1 2.93Å; N243-H246 HydrophobicContact CB-CB 4.32Å; N243-H246 PolarHBondContact ND2-CD2 3.45Å; N243-H246 PolarHBondContact ND2-CE1 3.04Å; N243-H246 PolarHBondContact ND2-NE2 3.12Å; N243-H246 PolarHBondContact O-N 2.93Å; H246-N248 VanDerWaalsContact C-N 3.33Å; H246-N248 PolarHBondContact O-N 3.3Å; H246-A249 WeakPolarHBondContact O-CB 3.18Å; H246-A249 PolarHBondContact O-N 3Å; H246-A249 VanDerWaalsContact O-N 3.08Å; H246-I250 WeakPolarHBondContact O-CG1 3.49Å; H246-I250 PolarHBondContact O-N 3.3Å
247	L	79.2	Confident	77	Confident	32 Å²	32	39.2 Å²	39.2	17%	0.168	21%	0.207	C	C	.	.	H	α-helix	trans	-58.6	-45.3	175.1	-170.1	158.5	0	0	0	111.2	N243 T244 A249 I250 Q251 L283	N243-L247 PolarHBondContact O-N 3.23Å; T244-L247 PolarHBondContact O-N 3.24Å; L247-A249 VanDerWaalsContact C-N 3.26Å; L247-A249 PolarHBondContact O-N 3.25Å; L247-I250 WeakPolarHBondContact O-CB 3.45Å; L247-I250 PolarHBondContact O-N 3.3Å; L247-I250 VanDerWaalsContact O-N 3.12Å; L247-Q251 VanDerWaalsContact CD2-CD 3.42Å; L247-Q251 HydrophobicContact CD2-CG 4.03Å; L247-Q251 WeakPolarHBondContact O-CG 3.25Å; L247-Q251 PolarHBondContact O-N 3.16Å; L247-L283 HydrophobicContact CD1-CD1 3.98Å; L247-L283 HydrophobicContact CD1-CD2 3.76Å; L247-L283 HydrophobicContact CD1-CG 4.47Å; L247-L283 HydrophobicContact CD2-CD2 3.65Å; L247-L283 HydrophobicContact CG-CD1 4.43Å; L247-L283 HydrophobicContact CG-CD2 3.82Å
248	N	81.4	Confident	77.5	Confident	74 Å²	74	39.2 Å²	39.2	40%	0.396	21%	0.207	S	C	.	.	H	α-helix	trans	-60.1	-36	175.2	-66.2	-12	0	0	0	112.4	T244 H246 T252	T244-N248 VanDerWaalsContact O-CG 3.23Å; T244-N248 PolarHBondContact O-N 2.94Å; T244-N248 PolarHBondContact O-OD1 3.35Å; H246-N248 VanDerWaalsContact C-N 3.33Å; H246-N248 PolarHBondContact O-N 3.3Å; N248-T252 WeakPolarHBondContact O-CB 3.02Å; N248-T252 PolarHBondContact O-N 2.86Å; N248-T252 PolarHBondContact O-OG1 3.3Å
249	A	81.8	Confident	78	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.1	-37.8	176.7	0	0	0	0	0	112.2	L212 R215 L219 T245 H246 L247 L253	L212-A249 HydrophobicContact CD1-CB 3.74Å; R215-A249 HydrophobicContact CB-CB 4.48Å; L219-A249 HydrophobicContact CD1-CB 4.22Å; T245-A249 PolarHBondContact O-N 3.41Å; H246-A249 WeakPolarHBondContact O-CB 3.18Å; H246-A249 PolarHBondContact O-N 3Å; H246-A249 VanDerWaalsContact O-N 3.08Å; L247-A249 VanDerWaalsContact C-N 3.26Å; L247-A249 PolarHBondContact O-N 3.25Å; A249-L253 PolarHBondContact O-N 2.91Å
250	I	82.6	Confident	78.6	Confident	6 Å²	6	34 Å²	34	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-47.9	175.9	-64.4	162.2	0	0	0	110.2	L219 F240 H246 L247 T252 A254 L257 L258	L219-I250 HydrophobicContact CD1-CD1 4.18Å; L219-I250 HydrophobicContact CD1-CG1 3.7Å; F240-I250 HydrophobicContact CD1-CD1 3.27Å; F240-I250 HydrophobicContact CD1-CG1 4.44Å; F240-I250 HydrophobicContact CE1-CD1 3.62Å; F240-I250 HydrophobicContact CE1-CG1 4.37Å; F240-I250 HydrophobicContact CG-CD1 4.29Å; H246-I250 WeakPolarHBondContact O-CG1 3.49Å; H246-I250 PolarHBondContact O-N 3.3Å; L247-I250 WeakPolarHBondContact O-CB 3.45Å; L247-I250 PolarHBondContact O-N 3.3Å; L247-I250 VanDerWaalsContact O-N 3.12Å; I250-T252 VanDerWaalsContact C-N 3.31Å; I250-T252 PolarHBondContact O-N 2.87Å; I250-A254 CarbonylContact O-C 3.59Å; I250-A254 PolarHBondContact O-N 2.88Å; I250-L257 HydrophobicContact CG1-CD1 4.2Å; I250-L257 HydrophobicContact CG2-CB 4.42Å; I250-L258 HydrophobicContact CG2-CD2 3.94Å; I250-L258 HydrophobicContact CG2-CG 4.14Å
251	Q	80.8	Confident	79.3	Confident	44 Å²	44	34 Å²	34	21%	0.206	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-36.4	179.6	-69.2	-176.2	-38.8	0	0	112.7	L247 E287	L247-Q251 VanDerWaalsContact CD2-CD 3.42Å; L247-Q251 HydrophobicContact CD2-CG 4.03Å; L247-Q251 WeakPolarHBondContact O-CG 3.25Å; L247-Q251 PolarHBondContact O-N 3.16Å; Q251-E287 VanDerWaalsContact CA-OE1 3.29Å; Q251-E287 WeakPolarHBondContact CA-OE1 3.3Å; Q251-E287 VanDerWaalsContact CB-OE1 3.24Å; Q251-E287 WeakPolarHBondContact CB-OE1 3.37Å; Q251-E287 HydrophobicContact CG-CG 4.38Å; Q251-E287 WeakPolarHBondContact CG-OE1 3.48Å
252	T	81.9	Confident	80.1	Confident	96 Å²	96	32.5 Å²	32.5	59%	0.589	18%	0.176	S	C	*	.	H	α-helix	trans	-85.8	-45.4	-174.1	-50.1	0	0	0	0	113.1	L212 N248 I250	L212-T252 HydrophobicContact CD2-CG2 4.32Å; N248-T252 WeakPolarHBondContact O-CB 3.02Å; N248-T252 PolarHBondContact O-N 2.86Å; N248-T252 PolarHBondContact O-OG1 3.3Å; I250-T252 VanDerWaalsContact C-N 3.31Å; I250-T252 PolarHBondContact O-N 2.87Å
253	L	81.5	Confident	81	Confident	76 Å²	76	26 Å²	26	40%	0.398	15%	0.146	S	C	.	.	H	α-helix	trans	-115.5	-30.4	-166.4	-69.7	173	0	0	0	114.1	L212 T216 A249	L212-L253 HydrophobicContact CD2-CD1 3.81Å; L212-L253 HydrophobicContact CD2-CG 4.3Å; L212-L253 HydrophobicContact CG-CD1 3.82Å; T216-L253 HydrophobicContact CG2-CB 4.13Å; T216-L253 HydrophobicContact CG2-CD1 4.49Å; T216-L253 VanDerWaalsContact OG1-CD1 3.28Å; T216-L253 WeakPolarHBondContact OG1-CD1 3.37Å; A249-L253 PolarHBondContact O-N 2.91Å
254	A	76.4	Confident	81.6	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.138	C	C	.	.			trans	-139	67.5	-166.4	0	0	0	0	0	113.2	T216 I250 H256 L257	T216-A254 HydrophobicContact CG2-CB 4.05Å; I250-A254 CarbonylContact O-C 3.59Å; I250-A254 PolarHBondContact O-N 2.88Å; A254-H256 PolarHBondContact O-N 2.95Å; A254-L257 HydrophobicContact CB-CD1 3.7Å; A254-L257 HydrophobicContact CB-CG 3.95Å; A254-L257 WeakPolarHBondContact O-CB 3.49Å; A254-L257 PolarHBondContact O-N 3.21Å
255	P	83.5	Confident	81.9	Confident	20 Å²	20	20 Å²	20	13%	0.13	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.7	-179.5	30	-37.3	0	0	0	112.9	L257 L258 Y291	P255-L257 PolarHBondContact O-N 2.71Å; P255-L258 VanDerWaalsContact O-CB 3.25Å; P255-L258 WeakPolarHBondContact O-CB 3.21Å; P255-L258 VanDerWaalsContact O-CG 3.31Å; P255-L258 WeakPolarHBondContact O-CG 3.37Å; P255-L258 PolarHBondContact O-N 2.96Å; P255-L258 VanDerWaalsContact O-N 3.16Å; P255-Y291 HydrophobicContact CB-CG 4.5Å
256	H	85	Confident	82.2	Confident	6 Å²	6	18.1 Å²	18.1	3%	0.028	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-19.7	175.8	57.4	-79.8	0	0	0	113.4	L6 H220 A254 L258 R259 Y291	L6-H256 HydrophobicContact CD1-CB 4.23Å; L6-H256 HydrophobicContact CD2-CB 3.57Å; H220-H256 AromaticContact CD2-NE2 3.76Å; H220-H256 AromaticContact CE1-NE2 3.86Å; H220-H256 AromaticContact NE2-CE1 3.47Å; H220-H256 PolarHBondContact NE2-CE1 3.13Å; H220-H256 AromaticContact NE2-NE2 2.85Å; H220-H256 PolarHBondContact NE2-NE2 3.09Å; A254-H256 PolarHBondContact O-N 2.95Å; H256-L258 PolarHBondContact O-N 2.63Å; H256-R259 WeakPolarHBondContact O-CB 3.49Å; H256-R259 PolarHBondContact O-N 3.47Å; H256-R259 VanDerWaalsContact O-N 3.14Å; H256-Y291 HydrophobicContact CB-CE1 4.26Å; H256-Y291 HydrophobicContact CB-CE2 4.16Å
257	L	84.3	Confident	82.5	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-64	-22	173.4	-65.2	177.6	0	0	0	112.4	L219 L223 F240 I250 A254 P255 R259 Y260 L261	L219-L257 HydrophobicContact CB-CD1 3.87Å; L219-L257 HydrophobicContact CD1-CD1 4.32Å; L223-L257 HydrophobicContact CD1-CD2 3.48Å; L223-L257 VanDerWaalsContact CD1-CD2 3.48Å; L223-L257 HydrophobicContact CG-CD2 4.31Å; F240-L257 HydrophobicContact CE1-CB 4.41Å; I250-L257 HydrophobicContact CG1-CD1 4.2Å; I250-L257 HydrophobicContact CG2-CB 4.42Å; A254-L257 HydrophobicContact CB-CD1 3.7Å; A254-L257 HydrophobicContact CB-CG 3.95Å; A254-L257 WeakPolarHBondContact O-CB 3.49Å; A254-L257 PolarHBondContact O-N 3.21Å; P255-L257 PolarHBondContact O-N 2.71Å; L257-R259 PolarHBondContact O-N 2.88Å; L257-Y260 HydrophobicContact CD2-CD2 4.29Å; L257-Y260 PolarHBondContact O-N 3.17Å; L257-Y260 VanDerWaalsContact O-N 3.13Å; L257-L261 PolarHBondContact O-N 2.86Å; L257-L261 VanDerWaalsContact O-N 3.1Å
258	L	84.6	Confident	82.2	Confident	9 Å²	9	17.4 Å²	17.4	5%	0.047	10%	0.096	C	C	.	.	H	α-helix	trans	-59.3	-29	174.4	-66.7	178.5	0	0	0	112.5	I250 P255 H256 L261 T262 E287 T296	I250-L258 HydrophobicContact CG2-CD2 3.94Å; I250-L258 HydrophobicContact CG2-CG 4.14Å; P255-L258 VanDerWaalsContact O-CB 3.25Å; P255-L258 WeakPolarHBondContact O-CB 3.21Å; P255-L258 VanDerWaalsContact O-CG 3.31Å; P255-L258 WeakPolarHBondContact O-CG 3.37Å; P255-L258 PolarHBondContact O-N 2.96Å; P255-L258 VanDerWaalsContact O-N 3.16Å; H256-L258 PolarHBondContact O-N 2.63Å; L258-L261 HydrophobicContact CD2-CD2 4.01Å; L258-L261 PolarHBondContact O-N 3.35Å; L258-T262 WeakPolarHBondContact O-CG2 3.14Å; L258-T262 PolarHBondContact O-N 3.38Å; L258-T262 PolarHBondContact O-OG1 3.23Å; L258-T262 VanDerWaalsContact O-OG1 3.12Å; L258-E287 HydrophobicContact CD1-CB 3.52Å; L258-E287 HydrophobicContact CD1-CG 3.78Å; L258-T296 HydrophobicContact CB-CG2 4.35Å
259	R	86.1	Confident	81.4	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.5	-44.3	175.5	-177.5	179	-179	-159.5	-19	111.8	H256 L257 T262 V263 Y291 D293 V295 D325	H256-R259 WeakPolarHBondContact O-CB 3.49Å; H256-R259 PolarHBondContact O-N 3.47Å; H256-R259 VanDerWaalsContact O-N 3.14Å; L257-R259 PolarHBondContact O-N 2.88Å; R259-T262 PolarHBondContact O-OG1 3.3Å; R259-V263 WeakPolarHBondContact O-CG2 3.37Å; R259-V263 PolarHBondContact O-N 2.95Å; R259-Y291 HydrophobicContact CB-CE1 4.44Å; R259-D293 WeakPolarHBondContact CD-OD2 3.39Å; R259-D293 WeakPolarHBondContact CG-OD2 3.43Å; R259-D293 IonicContact NE-OD1 3.28Å; R259-D293 IonicContact NE-OD2 3.28Å; R259-D293 PolarHBondContact NE-OD2 3.4Å; R259-V295 HydrophobicContact CG-CB 4.25Å; R259-V295 HydrophobicContact CG-CG2 4.21Å; R259-D325 VanDerWaalsContact CZ-CG 3.44Å; R259-D325 IonicContact CZ-OD1 2.7Å; R259-D325 VanDerWaalsContact CZ-OD1 3.31Å; R259-D325 IonicContact CZ-OD2 3.2Å; R259-D325 IonicContact NE-OD2 3.92Å; R259-D325 VanDerWaalsContact NH1-CG 3.35Å; R259-D325 IonicContact NH1-OD1 2.73Å; R259-D325 PolarHBondContact NH1-OD1 2.95Å; R259-D325 IonicContact NH1-OD2 3.45Å; R259-D325 PolarHBondContact NH1-OD2 3.26Å; R259-D325 IonicContact NH2-OD1 3.23Å; R259-D325 PolarHBondContact NH2-OD1 3.39Å; R259-D325 IonicContact NH2-OD2 3.14Å; R259-D325 PolarHBondContact NH2-OD2 2.83Å
260	Y	85.2	Confident	80.4	Confident	6 Å²	6	22.6 Å²	22.6	2%	0.024	13%	0.129	C	C	.	.	H	α-helix	trans	-70.5	-38.7	177.9	-60.1	-63.8	0	0	0	111	L6 I10 L223 F227 L257 V263 C264 F327 L328	L6-Y260 HydrophobicContact CD1-CE2 4.37Å; I10-Y260 HydrophobicContact CD1-CE2 4.03Å; I10-Y260 WeakPolarHBondContact CD1-OH 3.44Å; L223-Y260 HydrophobicContact CD1-CD2 3.52Å; L223-Y260 HydrophobicContact CD1-CE2 3.83Å; L223-Y260 HydrophobicContact CD1-CG 4.12Å; L223-Y260 HydrophobicContact CD2-CD2 4.3Å; L223-Y260 HydrophobicContact CD2-CG 4.21Å; F227-Y260 AromaticContact CE2-CD1 3.79Å; F227-Y260 HydrophobicContact CE2-CD1 3.79Å; F227-Y260 HydrophobicContact CE2-CG 4.07Å; F227-Y260 AromaticContact CZ-CD1 3.87Å; F227-Y260 HydrophobicContact CZ-CD1 3.87Å; F227-Y260 HydrophobicContact CZ-CG 4.29Å; L257-Y260 HydrophobicContact CD2-CD2 4.29Å; L257-Y260 PolarHBondContact O-N 3.17Å; L257-Y260 VanDerWaalsContact O-N 3.13Å; Y260-V263 PolarHBondContact O-N 3.2Å; Y260-C264 WeakPolarHBondContact O-CB 3.32Å; Y260-C264 PolarHBondContact O-N 3.08Å; Y260-C264 PolarHBondContact O-SG 2.81Å; Y260-F327 HydrophobicContact CD1-CB 4.5Å; Y260-F327 HydrophobicContact CE1-CB 4.18Å; Y260-F327 HydrophobicContact CE1-CD2 4Å; Y260-L328 HydrophobicContact CD1-CD1 4.14Å; Y260-L328 HydrophobicContact CD1-CD2 3.88Å; Y260-L328 HydrophobicContact CD1-CG 4.03Å; Y260-L328 HydrophobicContact CE1-CD1 4.01Å; Y260-L328 HydrophobicContact CE1-CD2 4.33Å; Y260-L328 HydrophobicContact CE1-CG 3.96Å
261	L	84.1	Confident	79.2	Confident	3 Å²	3	32.1 Å²	32.1	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-62.8	-43.5	177.1	-176.7	63.7	0	0	0	112.5	L236 F240 M241 L257 L258 V263 C264 V265 L280	L236-L261 HydrophobicContact CD2-CD1 4.18Å; F240-L261 HydrophobicContact CB-CD1 3.87Å; F240-L261 HydrophobicContact CD1-CD1 4.36Å; F240-L261 HydrophobicContact CG-CD1 4.26Å; M241-L261 HydrophobicContact CE-CD1 3.72Å; M241-L261 HydrophobicContact CE-CD2 3.22Å; M241-L261 HydrophobicContact CE-CG 3.82Å; L257-L261 PolarHBondContact O-N 2.86Å; L257-L261 VanDerWaalsContact O-N 3.1Å; L258-L261 HydrophobicContact CD2-CD2 4.01Å; L258-L261 PolarHBondContact O-N 3.35Å; L261-V263 PolarHBondContact O-N 2.81Å; L261-C264 PolarHBondContact O-N 2.81Å; L261-V265 HydrophobicContact CD1-CG2 4.34Å; L261-V265 WeakPolarHBondContact O-CB 3.39Å; L261-V265 VanDerWaalsContact O-CG2 3.29Å; L261-V265 WeakPolarHBondContact O-CG2 3.35Å; L261-V265 PolarHBondContact O-N 2.93Å; L261-L280 HydrophobicContact CD2-CD1 3.89Å; L261-L280 HydrophobicContact CG-CD1 4.08Å
262	T	84.2	Confident	78.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.9	-43	176.4	48.4	0	0	0	0	111.6	L258 R259 V265 I266 L280 I284 V295 T296 F299	L258-T262 WeakPolarHBondContact O-CG2 3.14Å; L258-T262 PolarHBondContact O-N 3.38Å; L258-T262 PolarHBondContact O-OG1 3.23Å; L258-T262 VanDerWaalsContact O-OG1 3.12Å; R259-T262 PolarHBondContact O-OG1 3.3Å; T262-V265 PolarHBondContact O-N 3.32Å; T262-I266 WeakPolarHBondContact O-CB 3.44Å; T262-I266 VanDerWaalsContact O-CG1 3.3Å; T262-I266 WeakPolarHBondContact O-CG1 3.3Å; T262-I266 PolarHBondContact O-N 3.37Å; T262-L280 HydrophobicContact CG2-CD1 4.25Å; T262-L280 HydrophobicContact CG2-CD2 4.05Å; T262-L280 HydrophobicContact CG2-CG 4.47Å; T262-I284 HydrophobicContact CG2-CD1 3.44Å; T262-I284 VanDerWaalsContact CG2-CD1 3.44Å; T262-I284 HydrophobicContact CG2-CG1 4.43Å; T262-V295 VanDerWaalsContact OG1-CG1 3.27Å; T262-V295 WeakPolarHBondContact OG1-CG1 3.32Å; T262-T296 HydrophobicContact CG2-CG2 4.44Å; T262-F299 HydrophobicContact CG2-CB 4.49Å
263	V	85.3	Confident	77.5	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-63.9	-45.5	176.9	176.8	0	0	0	0	111.3	R259 Y260 L261 V265 I266 T267 V295 L322 L328 C331 F335	R259-V263 WeakPolarHBondContact O-CG2 3.37Å; R259-V263 PolarHBondContact O-N 2.95Å; Y260-V263 PolarHBondContact O-N 3.2Å; L261-V263 PolarHBondContact O-N 2.81Å; V263-V265 PolarHBondContact O-N 2.92Å; V263-I266 PolarHBondContact O-N 3.47Å; V263-T267 HydrophobicContact CG1-CG2 4.32Å; V263-T267 WeakPolarHBondContact O-CB 3.35Å; V263-T267 WeakPolarHBondContact O-CG2 3.36Å; V263-T267 PolarHBondContact O-N 2.81Å; V263-T267 PolarHBondContact O-OG1 2.88Å; V263-V295 HydrophobicContact CG2-CG1 3.91Å; V263-L322 HydrophobicContact CG2-CD2 4.28Å; V263-L328 HydrophobicContact CB-CD2 4.03Å; V263-L328 HydrophobicContact CG1-CD2 3.78Å; V263-L328 HydrophobicContact CG2-CD1 4.19Å; V263-L328 HydrophobicContact CG2-CD2 4.17Å; V263-C331 HydrophobicContact CG1-CB 4.33Å; V263-F335 HydrophobicContact CB-CD2 4.16Å; V263-F335 HydrophobicContact CB-CE2 4.38Å; V263-F335 HydrophobicContact CG1-CB 4.39Å; V263-F335 HydrophobicContact CG1-CD2 3.82Å; V263-F335 HydrophobicContact CG1-CG 4.35Å; V263-F335 HydrophobicContact CG2-CD2 4.02Å; V263-F335 HydrophobicContact CG2-CE2 3.91Å
264	C	81.5	Confident	76.9	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.014	18%	0.176	C	C	.	.	H	α-helix	trans	-60.7	-43.8	176.9	-70.3	0	0	0	0	112.1	L236 I237 Y260 L261 T267 S268	L236-C264 HydrophobicContact CD2-CB 4.25Å; I237-C264 HydrophobicContact CG1-CB 4.36Å; Y260-C264 WeakPolarHBondContact O-CB 3.32Å; Y260-C264 PolarHBondContact O-N 3.08Å; Y260-C264 PolarHBondContact O-SG 2.81Å; L261-C264 PolarHBondContact O-N 2.81Å; C264-T267 WeakPolarHBondContact CA-OG1 3.42Å; C264-T267 PolarHBondContact O-N 3.22Å; C264-T267 PolarHBondContact O-OG1 3.37Å; C264-T267 VanDerWaalsContact O-OG1 3.06Å; C264-S268 WeakPolarHBondContact O-CB 3.37Å; C264-S268 PolarHBondContact O-N 3.15Å
265	V	81.7	Confident	76.8	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-67.5	-38.2	179	172.5	0	0	0	0	111.6	I237 L261 T262 V263 S268 L276 I277 L280	I237-V265 HydrophobicContact CD1-CG2 4.23Å; I237-V265 HydrophobicContact CG1-CG2 4.13Å; L261-V265 HydrophobicContact CD1-CG2 4.34Å; L261-V265 WeakPolarHBondContact O-CB 3.39Å; L261-V265 VanDerWaalsContact O-CG2 3.29Å; L261-V265 WeakPolarHBondContact O-CG2 3.35Å; L261-V265 PolarHBondContact O-N 2.93Å; T262-V265 PolarHBondContact O-N 3.32Å; V263-V265 PolarHBondContact O-N 2.92Å; V265-S268 PolarHBondContact O-OG 2.79Å; V265-L276 HydrophobicContact CG1-CB 4.3Å; V265-I277 HydrophobicContact CG1-CG1 4.3Å; V265-L280 HydrophobicContact CB-CD2 3.89Å; V265-L280 HydrophobicContact CG1-CD2 3.89Å; V265-L280 HydrophobicContact CG2-CD2 4.11Å
266	I	81.4	Confident	76.2	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.015	20%	0.203	C	C	.	.	H	α-helix	trans	-67.6	-42.2	178.6	-74.1	166.9	0	0	0	111.5	T262 V263 K273 F298 F299 F335 N338 L342	T262-I266 WeakPolarHBondContact O-CB 3.44Å; T262-I266 VanDerWaalsContact O-CG1 3.3Å; T262-I266 WeakPolarHBondContact O-CG1 3.3Å; T262-I266 PolarHBondContact O-N 3.37Å; V263-I266 PolarHBondContact O-N 3.47Å; I266-K273 PolarHBondContact O-NZ 2.77Å; I266-F298 HydrophobicContact CD1-CE1 4.33Å; I266-F299 HydrophobicContact CD1-CD2 4.23Å; I266-F335 HydrophobicContact CB-CD2 4.02Å; I266-F335 HydrophobicContact CB-CE2 3.96Å; I266-F335 HydrophobicContact CD1-CD2 4.4Å; I266-F335 HydrophobicContact CD1-CE2 3.49Å; I266-F335 VanDerWaalsContact CD1-CE2 3.49Å; I266-F335 HydrophobicContact CD1-CZ 4.09Å; I266-F335 HydrophobicContact CG1-CE2 4.31Å; I266-F335 HydrophobicContact CG2-CD2 3.72Å; I266-F335 HydrophobicContact CG2-CE2 3.86Å; I266-N338 HydrophobicContact CG2-CB 3.81Å; I266-N338 WeakPolarHBondContact O-CB 3.27Å; I266-L342 HydrophobicContact CG1-CD1 4.07Å; I266-L342 HydrophobicContact CG2-CD1 4.12Å
267	T	79.7	Confident	75.9	Confident	7 Å²	7	42.4 Å²	42.4	4%	0.043	21%	0.207	C	C	.	.	H	α-helix	trans	-73.2	-24.7	179.4	51.7	0	0	0	0	113.2	V263 C264 T269 E334 F335	V263-T267 HydrophobicContact CG1-CG2 4.32Å; V263-T267 WeakPolarHBondContact O-CB 3.35Å; V263-T267 WeakPolarHBondContact O-CG2 3.36Å; V263-T267 PolarHBondContact O-N 2.81Å; V263-T267 PolarHBondContact O-OG1 2.88Å; C264-T267 WeakPolarHBondContact CA-OG1 3.42Å; C264-T267 PolarHBondContact O-N 3.22Å; C264-T267 PolarHBondContact O-OG1 3.37Å; C264-T267 VanDerWaalsContact O-OG1 3.06Å; T267-T269 PolarHBondContact O-N 3.42Å; T267-E334 HydrophobicContact CG2-CB 4.11Å; T267-F335 HydrophobicContact CG2-CB 4.01Å
268	S	74.1	Confident	75.6	Confident	10 Å²	10	49.8 Å²	49.8	7%	0.07	24%	0.235	C	C	.	.			trans	-60.5	128.3	177.4	72.3	0	0	0	0	112.2	C264 V265 D270	C264-S268 WeakPolarHBondContact O-CB 3.37Å; C264-S268 PolarHBondContact O-N 3.15Å; V265-S268 PolarHBondContact O-OG 2.79Å; S268-D270 VanDerWaalsContact C-N 3.3Å
269	T	63.6	Low	75.4	Confident	124 Å²	124	53.1 Å²	53.1	76%	0.761	25%	0.253	S	S	*	.			trans	-87.4	2.7	179.5	49	0	0	0	0	113.1	T267	T267-T269 PolarHBondContact O-N 3.42Å
270	D	61.2	Low	75.2	Confident	60 Å²	60	53.1 Å²	53.1	32%	0.321	25%	0.253	S	S	.	.			trans	-72.8	144	-167.8	-164.8	11	0	0	0	112.9	S268 K272 K273	S268-D270 VanDerWaalsContact C-N 3.3Å; D270-K272 PolarHBondContact O-N 3.26Å; D270-K272 VanDerWaalsContact O-N 3.1Å; D270-K273 WeakPolarHBondContact O-CB 3.24Å; D270-K273 PolarHBondContact O-N 3.21Å
271	K	57.6	Low	75.1	Confident	205 Å²	205	55.9 Å²	55.9	89%	0.891	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.4	178.9	-67	177.3	-178.2	172.5	0	112.4	K273	K271-K273 VanDerWaalsContact C-N 3.27Å; K271-K273 PolarHBondContact O-N 3.47Å
272	K	61.7	Low	75	Confident	130 Å²	130	62.1 Å²	62.1	57%	0.565	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-3.5	176.3	-63.5	177.9	-173.7	165.8	0	114.2	D270 K274 N275 L276	D270-K272 PolarHBondContact O-N 3.26Å; D270-K272 VanDerWaalsContact O-N 3.1Å; K272-K274 PolarHBondContact O-N 2.87Å; K272-N275 PolarHBondContact O-N 3.31Å; K272-L276 PolarHBondContact O-N 3.47Å
273	K	65	Low	74.8	Confident	34 Å²	34	63 Å²	63	15%	0.148	29%	0.294	C	S	.	.	H	α-helix	trans	-45.9	-35.7	179.9	-178.5	169	-167.4	168.5	0	114	I266 D270 K271 N275 L276 I277	I266-K273 PolarHBondContact O-NZ 2.77Å; D270-K273 WeakPolarHBondContact O-CB 3.24Å; D270-K273 PolarHBondContact O-N 3.21Å; K271-K273 VanDerWaalsContact C-N 3.27Å; K271-K273 PolarHBondContact O-N 3.47Å; K273-N275 PolarHBondContact O-N 3.06Å; K273-L276 PolarHBondContact O-N 3.21Å; K273-I277 HydrophobicContact CD-CD1 4.34Å; K273-I277 HydrophobicContact CG-CD1 3.53Å; K273-I277 HydrophobicContact CG-CG1 4.13Å; K273-I277 WeakPolarHBondContact O-CB 3.29Å; K273-I277 WeakPolarHBondContact O-CD1 2.9Å; K273-I277 WeakPolarHBondContact O-CG1 2.87Å; K273-I277 PolarHBondContact O-N 2.93Å
274	K	68.4	Low	74.7	Confident	142 Å²	142	63.2 Å²	63.2	62%	0.617	30%	0.295	S	S	*	.	H	α-helix	trans	-64.3	-36.7	179.3	-67.5	-174.2	-179.1	-179.8	0	114.2	K272 R278	K272-K274 PolarHBondContact O-N 2.87Å; K274-R278 PolarHBondContact O-N 3.42Å
275	N	73.9	Confident	74.8	Confident	103 Å²	103	68 Å²	68	55%	0.551	32%	0.317	S	S	*	.	H	α-helix	trans	-75.3	-45.6	178.5	-68.7	-8.9	0	0	0	109.9	K272 K273 I277 R278 D279	K272-N275 PolarHBondContact O-N 3.31Å; K273-N275 PolarHBondContact O-N 3.06Å; N275-I277 VanDerWaalsContact C-N 3.32Å; N275-I277 PolarHBondContact O-N 3.44Å; N275-R278 WeakPolarHBondContact O-CA 3.32Å; N275-R278 WeakPolarHBondContact O-CB 3.4Å; N275-R278 PolarHBondContact O-N 3.48Å; N275-D279 PolarHBondContact O-N 2.83Å
276	L	72.4	Confident	74.8	Confident	27 Å²	27	73 Å²	73	14%	0.141	34%	0.341	C	S	.	.	H	α-helix	trans	-59.3	-40.8	177.1	-66.9	167.6	0	0	0	112.6	I237 M241 V265 K272 K273 R278 D279 L280	I237-L276 HydrophobicContact CG2-CD1 3.7Å; I237-L276 HydrophobicContact CG2-CD2 3.53Å; I237-L276 HydrophobicContact CG2-CG 4.23Å; M241-L276 HydrophobicContact CB-CD2 4.46Å; M241-L276 HydrophobicContact CG-CD2 4.09Å; V265-L276 HydrophobicContact CG1-CB 4.3Å; K272-L276 PolarHBondContact O-N 3.47Å; K273-L276 PolarHBondContact O-N 3.21Å; L276-R278 VanDerWaalsContact C-N 3.29Å; L276-R278 PolarHBondContact O-N 3.46Å; L276-D279 PolarHBondContact O-N 2.95Å; L276-L280 WeakPolarHBondContact O-CB 3.43Å; L276-L280 PolarHBondContact O-N 3.07Å
277	I	77.6	Confident	74.7	Confident	22 Å²	22	73.3 Å²	73.3	11%	0.113	34%	0.342	C	S	.	.	H	α-helix	trans	-62	-38.3	174.6	-74.5	169.2	0	0	0	111.2	V265 K273 N275 K281 F299 F303	V265-I277 HydrophobicContact CG1-CG1 4.3Å; K273-I277 HydrophobicContact CD-CD1 4.34Å; K273-I277 HydrophobicContact CG-CD1 3.53Å; K273-I277 HydrophobicContact CG-CG1 4.13Å; K273-I277 WeakPolarHBondContact O-CB 3.29Å; K273-I277 WeakPolarHBondContact O-CD1 2.9Å; K273-I277 WeakPolarHBondContact O-CG1 2.87Å; K273-I277 PolarHBondContact O-N 2.93Å; N275-I277 VanDerWaalsContact C-N 3.32Å; N275-I277 PolarHBondContact O-N 3.44Å; I277-K281 VanDerWaalsContact O-CB 3.27Å; I277-K281 WeakPolarHBondContact O-CB 3.44Å; I277-K281 PolarHBondContact O-N 3.43Å; I277-F299 HydrophobicContact CG2-CZ 4.01Å; I277-F303 HydrophobicContact CD1-CE1 4.49Å; I277-F303 HydrophobicContact CD1-CZ 3.92Å; I277-F303 HydrophobicContact CG1-CZ 4.38Å; I277-F303 HydrophobicContact CG2-CD1 3.82Å; I277-F303 HydrophobicContact CG2-CD2 4.21Å; I277-F303 HydrophobicContact CG2-CE1 3.51Å; I277-F303 HydrophobicContact CG2-CE2 3.92Å; I277-F303 HydrophobicContact CG2-CG 4.17Å; I277-F303 HydrophobicContact CG2-CZ 3.57Å
278	R	79.1	Confident	74.6	Confident	156 Å²	156	74.8 Å²	74.8	59%	0.589	35%	0.353	S	S	*	.	H	α-helix	trans	-65.9	-46.8	178.1	-177.9	-176.4	-66.5	177.9	-1	110.5	K274 N275 L276 K281 Y282	K274-R278 PolarHBondContact O-N 3.42Å; N275-R278 WeakPolarHBondContact O-CA 3.32Å; N275-R278 WeakPolarHBondContact O-CB 3.4Å; N275-R278 PolarHBondContact O-N 3.48Å; L276-R278 VanDerWaalsContact C-N 3.29Å; L276-R278 PolarHBondContact O-N 3.46Å; R278-K281 WeakPolarHBondContact O-CB 2.97Å; R278-K281 PolarHBondContact O-N 3.34Å; R278-Y282 HydrophobicContact CG-CD2 4.17Å; R278-Y282 HydrophobicContact CG-CE2 3.71Å; R278-Y282 WeakPolarHBondContact O-CD2 3.47Å; R278-Y282 PolarHBondContact O-N 3.35Å
279	D	80	Confident	74.9	Confident	79 Å²	79	83 Å²	83	42%	0.422	38%	0.383	S	S	.	.	H	α-helix	trans	-66.5	-43.9	-179.6	-60.2	-24.1	0	0	0	110.7	N275 L276 K281 Y282 L283	N275-D279 PolarHBondContact O-N 2.83Å; L276-D279 PolarHBondContact O-N 2.95Å; D279-K281 VanDerWaalsContact C-N 3.31Å; D279-K281 PolarHBondContact O-N 3.31Å; D279-Y282 PolarHBondContact O-N 3.47Å; D279-Y282 VanDerWaalsContact O-N 3.12Å; D279-L283 WeakPolarHBondContact O-CG 3Å; D279-L283 PolarHBondContact O-N 2.88Å
280	L	81.3	Confident	75.5	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-60.5	-38.1	174.7	-176.5	63	0	0	0	112.4	M241 L261 T262 V265 L276 Y282 L283 I284 F299	M241-L280 HydrophobicContact CE-CD1 4.47Å; L261-L280 HydrophobicContact CD2-CD1 3.89Å; L261-L280 HydrophobicContact CG-CD1 4.08Å; T262-L280 HydrophobicContact CG2-CD1 4.25Å; T262-L280 HydrophobicContact CG2-CD2 4.05Å; T262-L280 HydrophobicContact CG2-CG 4.47Å; V265-L280 HydrophobicContact CB-CD2 3.89Å; V265-L280 HydrophobicContact CG1-CD2 3.89Å; V265-L280 HydrophobicContact CG2-CD2 4.11Å; L276-L280 WeakPolarHBondContact O-CB 3.43Å; L276-L280 PolarHBondContact O-N 3.07Å; L280-Y282 VanDerWaalsContact C-N 3.34Å; L280-Y282 PolarHBondContact O-N 3.48Å; L280-L283 PolarHBondContact O-N 3.42Å; L280-I284 HydrophobicContact CD1-CD1 3.79Å; L280-I284 HydrophobicContact CD1-CG1 4.1Å; L280-I284 HydrophobicContact CD2-CD1 4.3Å; L280-I284 HydrophobicContact CG-CD1 3.66Å; L280-I284 HydrophobicContact CG-CG1 4.36Å; L280-I284 WeakPolarHBondContact O-CG1 3.28Å; L280-I284 PolarHBondContact O-N 3.1Å; L280-F299 HydrophobicContact CB-CE1 4.43Å; L280-F299 HydrophobicContact CB-CZ 4.12Å; L280-F299 HydrophobicContact CD2-CD2 4.24Å; L280-F299 HydrophobicContact CD2-CE1 4.19Å; L280-F299 HydrophobicContact CD2-CE2 3.65Å; L280-F299 HydrophobicContact CD2-CZ 3.62Å; L280-F299 HydrophobicContact CG-CE1 4.02Å; L280-F299 HydrophobicContact CG-CE2 4.38Å; L280-F299 HydrophobicContact CG-CZ 3.85Å
281	K	83.3	Confident	76.3	Confident	64 Å²	64	78.4 Å²	78.4	28%	0.278	36%	0.358	S	S	.	.	H	α-helix	trans	-59	-45	173.8	175.1	-179.8	174.1	165.2	0	111.5	I277 R278 D279 L283 Q285 F299 F303 V304	I277-K281 VanDerWaalsContact O-CB 3.27Å; I277-K281 WeakPolarHBondContact O-CB 3.44Å; I277-K281 PolarHBondContact O-N 3.43Å; R278-K281 WeakPolarHBondContact O-CB 2.97Å; R278-K281 PolarHBondContact O-N 3.34Å; D279-K281 VanDerWaalsContact C-N 3.31Å; D279-K281 PolarHBondContact O-N 3.31Å; K281-L283 VanDerWaalsContact C-N 3.35Å; K281-Q285 VanDerWaalsContact O-CB 3.31Å; K281-Q285 WeakPolarHBondContact O-CB 3.41Å; K281-Q285 PolarHBondContact O-N 2.8Å; K281-F299 HydrophobicContact CB-CE1 4.18Å; K281-F303 HydrophobicContact CD-CB 4.32Å; K281-F303 WeakPolarHBondContact CE-O 3.33Å; K281-F303 PolarHBondContact NZ-O 3.22Å; K281-V304 HydrophobicContact CG-CG2 4.22Å
282	Y	81.7	Confident	77.1	Confident	134 Å²	134	77.2 Å²	77.2	53%	0.525	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-41.1	177.1	-74.3	-68.4	0	0	0	111.7	R278 D279 L280 Q285 Q286	R278-Y282 HydrophobicContact CG-CD2 4.17Å; R278-Y282 HydrophobicContact CG-CE2 3.71Å; R278-Y282 WeakPolarHBondContact O-CD2 3.47Å; R278-Y282 PolarHBondContact O-N 3.35Å; D279-Y282 PolarHBondContact O-N 3.47Å; D279-Y282 VanDerWaalsContact O-N 3.12Å; L280-Y282 VanDerWaalsContact C-N 3.34Å; L280-Y282 PolarHBondContact O-N 3.48Å; Y282-Q285 PolarHBondContact O-N 3.37Å; Y282-Q286 WeakPolarHBondContact O-CG 3.43Å; Y282-Q286 PolarHBondContact O-N 2.92Å
283	L	80.4	Confident	78	Confident	18 Å²	18	71.1 Å²	71.1	9%	0.094	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-45.8	179.6	-67.2	170.8	0	0	0	113	M241 L247 D279 L280 K281 Q285 Q286 E287	M241-L283 HydrophobicContact CE-CD1 3.65Å; M241-L283 HydrophobicContact SD-CD1 3.96Å; L247-L283 HydrophobicContact CD1-CD1 3.98Å; L247-L283 HydrophobicContact CD1-CD2 3.76Å; L247-L283 HydrophobicContact CD1-CG 4.47Å; L247-L283 HydrophobicContact CD2-CD2 3.65Å; L247-L283 HydrophobicContact CG-CD1 4.43Å; L247-L283 HydrophobicContact CG-CD2 3.82Å; D279-L283 WeakPolarHBondContact O-CG 3Å; D279-L283 PolarHBondContact O-N 2.88Å; L280-L283 PolarHBondContact O-N 3.42Å; K281-L283 VanDerWaalsContact C-N 3.35Å; L283-Q285 VanDerWaalsContact C-N 3.31Å; L283-Q285 PolarHBondContact O-N 3Å; L283-Q286 PolarHBondContact O-N 3.32Å; L283-E287 PolarHBondContact O-N 3.38Å
284	I	82.9	Confident	78.8	Confident	7 Å²	7	69.6 Å²	69.6	4%	0.036	32%	0.315	C	S	.	.	H	α-helix	trans	-67.2	-37	179	-67.8	166.7	0	0	0	110.7	T262 L280 Q286 E287 S288 F299	T262-I284 HydrophobicContact CG2-CD1 3.44Å; T262-I284 VanDerWaalsContact CG2-CD1 3.44Å; T262-I284 HydrophobicContact CG2-CG1 4.43Å; L280-I284 HydrophobicContact CD1-CD1 3.79Å; L280-I284 HydrophobicContact CD1-CG1 4.1Å; L280-I284 HydrophobicContact CD2-CD1 4.3Å; L280-I284 HydrophobicContact CG-CD1 3.66Å; L280-I284 HydrophobicContact CG-CG1 4.36Å; L280-I284 WeakPolarHBondContact O-CG1 3.28Å; L280-I284 PolarHBondContact O-N 3.1Å; I284-Q286 VanDerWaalsContact C-N 3.32Å; I284-Q286 PolarHBondContact O-N 2.97Å; I284-E287 PolarHBondContact O-N 3.27Å; I284-S288 WeakPolarHBondContact O-CB 3.21Å; I284-S288 PolarHBondContact O-N 2.92Å; I284-F299 HydrophobicContact CD1-CB 4.2Å; I284-F299 HydrophobicContact CD1-CD1 3.31Å; I284-F299 HydrophobicContact CD1-CE1 3.78Å; I284-F299 HydrophobicContact CD1-CG 3.85Å
285	Q	83.2	Confident	79.6	Confident	101 Å²	101	62.9 Å²	62.9	47%	0.472	29%	0.286	S	S	.	.	H	α-helix	trans	-63.7	-40.3	176.4	-172.2	173.2	4.4	0	0	111.5	K281 Y282 L283 S288	K281-Q285 VanDerWaalsContact O-CB 3.31Å; K281-Q285 WeakPolarHBondContact O-CB 3.41Å; K281-Q285 PolarHBondContact O-N 2.8Å; Y282-Q285 PolarHBondContact O-N 3.37Å; L283-Q285 VanDerWaalsContact C-N 3.31Å; L283-Q285 PolarHBondContact O-N 3Å; Q285-S288 PolarHBondContact O-OG 2.88Å
286	Q	82.6	Confident	80	Confident	108 Å²	108	58.3 Å²	58.3	51%	0.505	26%	0.262	S	S	.	.	H	α-helix	trans	-63.3	-44.4	174.5	-74	177.8	-7.8	0	0	111.6	Y282 L283 I284 Y289	Y282-Q286 WeakPolarHBondContact O-CG 3.43Å; Y282-Q286 PolarHBondContact O-N 2.92Å; L283-Q286 PolarHBondContact O-N 3.32Å; I284-Q286 VanDerWaalsContact C-N 3.32Å; I284-Q286 PolarHBondContact O-N 2.97Å; Q286-Y289 WeakPolarHBondContact O-CD1 3.27Å; Q286-Y289 WeakPolarHBondContact O-CE1 3.47Å
287	E	79.2	Confident	80.5	Confident	9 Å²	9	58.9 Å²	58.9	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-87.7	-1.5	-174.3	-68	-60.6	144	0	0	115.1	Q251 L258 L283 I284 Y289 S290 Y291	Q251-E287 VanDerWaalsContact CA-OE1 3.29Å; Q251-E287 WeakPolarHBondContact CA-OE1 3.3Å; Q251-E287 VanDerWaalsContact CB-OE1 3.24Å; Q251-E287 WeakPolarHBondContact CB-OE1 3.37Å; Q251-E287 HydrophobicContact CG-CG 4.38Å; Q251-E287 WeakPolarHBondContact CG-OE1 3.48Å; L258-E287 HydrophobicContact CD1-CB 3.52Å; L258-E287 HydrophobicContact CD1-CG 3.78Å; L283-E287 PolarHBondContact O-N 3.38Å; I284-E287 PolarHBondContact O-N 3.27Å; E287-Y289 PolarHBondContact O-N 3.47Å; E287-S290 PolarHBondContact O-N 3.32Å; E287-Y291 PolarHBondContact O-N 3.38Å
288	S	77.2	Confident	80.9	Confident	38 Å²	38	57.9 Å²	57.9	27%	0.266	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.6	-177.7	62.7	0	0	0	0	114.6	I284 Q285	I284-S288 WeakPolarHBondContact O-CB 3.21Å; I284-S288 PolarHBondContact O-N 2.92Å; Q285-S288 PolarHBondContact O-OG 2.88Å
289	Y	80.2	Confident	81.3	Confident	181 Å²	181	50.5 Å²	50.5	71%	0.71	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-26.6	175.3	70.1	-96.9	0	0	0	113.4	Q286 E287	Q286-Y289 WeakPolarHBondContact O-CD1 3.27Å; Q286-Y289 WeakPolarHBondContact O-CE1 3.47Å; E287-Y289 PolarHBondContact O-N 3.47Å
290	S	75.9	Confident	81.5	Confident	66 Å²	66	48.4 Å²	48.4	46%	0.462	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-40.9	-169.9	-167.3	0	0	0	0	111.9	E287	E287-S290 PolarHBondContact O-N 3.32Å
291	Y	77.6	Confident	81.6	Confident	23 Å²	23	49 Å²	49	9%	0.09	22%	0.223	C	C	.	.			trans	-139.8	127.1	-174.6	-176.7	-113.6	0	0	0	112.6	L6 P255 H256 R259 E287 D293 T296	L6-Y291 HydrophobicContact CD2-CE2 4.22Å; P255-Y291 HydrophobicContact CB-CG 4.5Å; H256-Y291 HydrophobicContact CB-CE1 4.26Å; H256-Y291 HydrophobicContact CB-CE2 4.16Å; R259-Y291 HydrophobicContact CB-CE1 4.44Å; E287-Y291 PolarHBondContact O-N 3.38Å; Y291-D293 HydrophobicContact CD1-CB 4.32Å; Y291-D293 HydrophobicContact CE1-CB 3.49Å; Y291-D293 VanDerWaalsContact CE1-CB 3.49Å; Y291-D293 WeakPolarHBondContact OH-CB 3.15Å; Y291-D293 PolarHBondContact OH-OD1 3.18Å; Y291-T296 HydrophobicContact CE1-CG2 4.49Å
292	R	75	Confident	81.7	Confident	180 Å²	180	46.1 Å²	46.1	68%	0.679	21%	0.21	S	C	*	.			trans	-120.9	122.8	175.5	-65.8	-173	-177	-178.8	0.9	109
293	D	80.8	Confident	81.6	Confident	1 Å²	1	41 Å²	41	1%	0.005	19%	0.191	C	C	.	.			trans	-137.5	149.2	178.6	-174.9	68.3	0	0	0	108.9	R259 Y291 V295 T296 E297	R259-D293 WeakPolarHBondContact CD-OD2 3.39Å; R259-D293 WeakPolarHBondContact CG-OD2 3.43Å; R259-D293 IonicContact NE-OD1 3.28Å; R259-D293 IonicContact NE-OD2 3.28Å; R259-D293 PolarHBondContact NE-OD2 3.4Å; Y291-D293 HydrophobicContact CD1-CB 4.32Å; Y291-D293 HydrophobicContact CE1-CB 3.49Å; Y291-D293 VanDerWaalsContact CE1-CB 3.49Å; Y291-D293 WeakPolarHBondContact OH-CB 3.15Å; Y291-D293 PolarHBondContact OH-OD1 3.18Å; D293-V295 PolarHBondContact O-N 3.44Å; D293-V295 VanDerWaalsContact O-N 3.1Å; D293-V295 WeakPolarHBondContact OD2-CB 3.37Å; D293-V295 WeakPolarHBondContact OD2-CG2 3.36Å; D293-V295 PolarHBondContact OD2-N 3.12Å; D293-T296 HydrophobicContact CB-CG2 4.34Å; D293-T296 PolarHBondContact N-OG1 3.08Å; D293-T296 VanDerWaalsContact N-OG1 3.1Å; D293-T296 PolarHBondContact O-N 3.3Å; D293-T296 VanDerWaalsContact O-N 3.08Å; D293-T296 PolarHBondContact O-OG1 2.76Å; D293-E297 WeakPolarHBondContact O-CB 3.13Å; D293-E297 WeakPolarHBondContact O-CG 3.47Å; D293-E297 PolarHBondContact O-N 3.02Å
294	P	82	Confident	81.7	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.019	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-30.7	-178.9	-27.6	38.3	0	0	0	112.7	F4 F298 V317 C318 V321	F4-P294 HydrophobicContact CD1-CG 4.2Å; F4-P294 HydrophobicContact CD2-CG 4.41Å; F4-P294 HydrophobicContact CE1-CG 3.71Å; F4-P294 HydrophobicContact CE2-CG 3.92Å; F4-P294 HydrophobicContact CZ-CG 3.55Å; P294-F298 WeakPolarHBondContact O-CB 3.48Å; P294-F298 PolarHBondContact O-N 3.3Å; P294-V317 HydrophobicContact CB-CB 4.21Å; P294-V317 HydrophobicContact CB-CG1 3.78Å; P294-V317 HydrophobicContact CG-CG1 3.58Å; P294-C318 VanDerWaalsContact C-SG 3.56Å; P294-V321 HydrophobicContact CG-CG2 4.39Å
295	V	84.3	Confident	81.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-74.6	-42.4	177.7	-172.6	0	0	0	0	111.5	R259 T262 V263 D293 F298 F299 L322 F335	R259-V295 HydrophobicContact CG-CB 4.25Å; R259-V295 HydrophobicContact CG-CG2 4.21Å; T262-V295 VanDerWaalsContact OG1-CG1 3.27Å; T262-V295 WeakPolarHBondContact OG1-CG1 3.32Å; V263-V295 HydrophobicContact CG2-CG1 3.91Å; D293-V295 PolarHBondContact O-N 3.44Å; D293-V295 VanDerWaalsContact O-N 3.1Å; D293-V295 WeakPolarHBondContact OD2-CB 3.37Å; D293-V295 WeakPolarHBondContact OD2-CG2 3.36Å; D293-V295 PolarHBondContact OD2-N 3.12Å; V295-F298 PolarHBondContact O-N 3.04Å; V295-F299 PolarHBondContact O-N 3.02Å; V295-F299 VanDerWaalsContact O-N 3.16Å; V295-L322 HydrophobicContact CG2-CD2 4.29Å; V295-F335 HydrophobicContact CG1-CE2 4.24Å; V295-F335 HydrophobicContact CG1-CZ 3.99Å
296	T	83.2	Confident	81.5	Confident	7 Å²	7	48 Å²	48	4%	0.043	22%	0.223	C	C	.	.	H	α-helix	trans	-71.1	-38.4	177.8	60.3	0	0	0	0	111.2	L258 T262 Y291 D293 F299 E300	L258-T296 HydrophobicContact CB-CG2 4.35Å; T262-T296 HydrophobicContact CG2-CG2 4.44Å; Y291-T296 HydrophobicContact CE1-CG2 4.49Å; D293-T296 HydrophobicContact CB-CG2 4.34Å; D293-T296 PolarHBondContact N-OG1 3.08Å; D293-T296 VanDerWaalsContact N-OG1 3.1Å; D293-T296 PolarHBondContact O-N 3.3Å; D293-T296 VanDerWaalsContact O-N 3.08Å; D293-T296 PolarHBondContact O-OG1 2.76Å; T296-F299 PolarHBondContact O-N 3.27Å; T296-E300 WeakPolarHBondContact O-CB 3.45Å; T296-E300 PolarHBondContact O-N 3.43Å
297	E	83.8	Confident	81.6	Confident	39 Å²	39	46.3 Å²	46.3	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-38.8	173.7	-72.1	-176	167	0	0	111.9	D293 F299 E300 C301 K314	D293-E297 WeakPolarHBondContact O-CB 3.13Å; D293-E297 WeakPolarHBondContact O-CG 3.47Å; D293-E297 PolarHBondContact O-N 3.02Å; E297-F299 VanDerWaalsContact C-N 3.3Å; E297-F299 PolarHBondContact O-N 3.13Å; E297-E300 PolarHBondContact O-N 2.93Å; E297-C301 VanDerWaalsContact O-CB 3.3Å; E297-C301 WeakPolarHBondContact O-CB 3.49Å; E297-C301 PolarHBondContact O-N 3Å; E297-C301 PolarHBondContact O-SG 3.4Å; E297-C301 VanDerWaalsContact O-SG 3.37Å; E297-K314 HydrophobicContact CB-CD 4.24Å; E297-K314 WeakPolarHBondContact OE2-CD 3.4Å; E297-K314 WeakPolarHBondContact OE2-CE 3.33Å; E297-K314 IonicContact OE2-NZ 2.71Å; E297-K314 PolarHBondContact OE2-NZ 3.43Å
298	F	85.9	Confident	81.7	Confident	1 Å²	1	47 Å²	47	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-56.5	-47.1	172	169.1	-102.2	0	0	0	110.9	I266 P294 V295 C301 L302 A311 K314 L315 A339 M343	I266-F298 HydrophobicContact CD1-CE1 4.33Å; P294-F298 WeakPolarHBondContact O-CB 3.48Å; P294-F298 PolarHBondContact O-N 3.3Å; V295-F298 PolarHBondContact O-N 3.04Å; F298-C301 PolarHBondContact O-N 2.7Å; F298-L302 HydrophobicContact CE1-CD2 4.45Å; F298-L302 HydrophobicContact CZ-CD2 4.31Å; F298-L302 WeakPolarHBondContact O-CB 3.28Å; F298-L302 PolarHBondContact O-N 3.07Å; F298-A311 HydrophobicContact CD2-CB 4.04Å; F298-A311 WeakPolarHBondContact CD2-O 3.42Å; F298-A311 HydrophobicContact CE2-CB 4.02Å; F298-K314 HydrophobicContact CB-CB 4.11Å; F298-L315 HydrophobicContact CD2-CB 4.31Å; F298-L315 HydrophobicContact CE2-CB 4.25Å; F298-L315 HydrophobicContact CE2-CD1 4.07Å; F298-L315 HydrophobicContact CZ-CD1 4.34Å; F298-A339 HydrophobicContact CE1-CB 3.94Å; F298-A339 HydrophobicContact CZ-CB 3.83Å; F298-M343 HydrophobicContact CE2-CG 3.91Å; F298-M343 HydrophobicContact CE2-SD 3.68Å; F298-M343 HydrophobicContact CZ-CG 3.84Å; F298-M343 HydrophobicContact CZ-SD 4.15Å
299	F	85.7	Confident	82	Confident	1 Å²	1	49.4 Å²	49.4	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-65.6	-40.8	178.2	-169.5	-86.6	0	0	0	112.3	T262 I266 I277 L280 K281 I284 V295 T296 E297 L302 F303	T262-F299 HydrophobicContact CG2-CB 4.49Å; I266-F299 HydrophobicContact CD1-CD2 4.23Å; I277-F299 HydrophobicContact CG2-CZ 4.01Å; L280-F299 HydrophobicContact CB-CE1 4.43Å; L280-F299 HydrophobicContact CB-CZ 4.12Å; L280-F299 HydrophobicContact CD2-CD2 4.24Å; L280-F299 HydrophobicContact CD2-CE1 4.19Å; L280-F299 HydrophobicContact CD2-CE2 3.65Å; L280-F299 HydrophobicContact CD2-CZ 3.62Å; L280-F299 HydrophobicContact CG-CE1 4.02Å; L280-F299 HydrophobicContact CG-CE2 4.38Å; L280-F299 HydrophobicContact CG-CZ 3.85Å; K281-F299 HydrophobicContact CB-CE1 4.18Å; I284-F299 HydrophobicContact CD1-CB 4.2Å; I284-F299 HydrophobicContact CD1-CD1 3.31Å; I284-F299 HydrophobicContact CD1-CE1 3.78Å; I284-F299 HydrophobicContact CD1-CG 3.85Å; V295-F299 PolarHBondContact O-N 3.02Å; V295-F299 VanDerWaalsContact O-N 3.16Å; T296-F299 PolarHBondContact O-N 3.27Å; E297-F299 VanDerWaalsContact C-N 3.3Å; E297-F299 PolarHBondContact O-N 3.13Å; F299-L302 PolarHBondContact O-N 2.99Å; F299-F303 AromaticContact CD1-CD2 3.95Å; F299-F303 HydrophobicContact CD1-CD2 3.95Å; F299-F303 AromaticContact CD2-CD2 3.68Å; F299-F303 HydrophobicContact CD2-CD2 3.68Å; F299-F303 AromaticContact CD2-CE2 3.69Å; F299-F303 HydrophobicContact CD2-CE2 3.69Å; F299-F303 HydrophobicContact CE1-CB 4.43Å; F299-F303 AromaticContact CE1-CD2 3.71Å; F299-F303 HydrophobicContact CE1-CD2 3.71Å; F299-F303 HydrophobicContact CE1-CE2 4.42Å; F299-F303 HydrophobicContact CE1-CG 4.37Å; F299-F303 AromaticContact CE2-CD2 3.42Å; F299-F303 HydrophobicContact CE2-CD2 3.42Å; F299-F303 VanDerWaalsContact CE2-CD2 3.42Å; F299-F303 AromaticContact CE2-CE2 3.29Å; F299-F303 HydrophobicContact CE2-CE2 3.29Å; F299-F303 HydrophobicContact CE2-CZ 4.4Å; F299-F303 AromaticContact CG-CD2 3.95Å; F299-F303 HydrophobicContact CG-CD2 3.95Å; F299-F303 HydrophobicContact CG-CE2 4.42Å; F299-F303 AromaticContact CZ-CD2 3.45Å; F299-F303 HydrophobicContact CZ-CD2 3.45Å; F299-F303 VanDerWaalsContact CZ-CD2 3.45Å; F299-F303 AromaticContact CZ-CE2 3.72Å; F299-F303 HydrophobicContact CZ-CE2 3.72Å; F299-F303 HydrophobicContact CZ-CG 4.28Å; F299-F303 PolarHBondContact O-N 3.32Å
300	E	85.2	Confident	82.1	Confident	36 Å²	36	41.4 Å²	41.4	17%	0.168	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-45.3	175.4	-167.2	-165	140.8	0	0	111.6	T296 E297 L302 V304 K305	T296-E300 WeakPolarHBondContact O-CB 3.45Å; T296-E300 PolarHBondContact O-N 3.43Å; E297-E300 PolarHBondContact O-N 2.93Å; E300-L302 VanDerWaalsContact C-N 3.31Å; E300-L302 PolarHBondContact O-N 3.26Å; E300-V304 HydrophobicContact CG-CB 4.09Å; E300-V304 HydrophobicContact CG-CG2 3.97Å; E300-V304 WeakPolarHBondContact O-CA 3.44Å; E300-V304 WeakPolarHBondContact O-CB 3.23Å; E300-V304 PolarHBondContact O-N 2.91Å; E300-K305 PolarHBondContact O-N 2.74Å; E300-K305 VanDerWaalsContact O-N 3.14Å; E300-K305 WeakPolarHBondContact OE1-CE 3.33Å; E300-K305 IonicContact OE1-NZ 3.07Å; E300-K305 PolarHBondContact OE1-NZ 3.27Å
301	C	83.9	Confident	82.5	Confident	13 Å²	13	38.2 Å²	38.2	9%	0.088	18%	0.18	C	C	.	.	I	π-helix	trans	-60	-42.1	176.1	-78.8	0	0	0	0	111.5	E297 F298 F306 D307 A311	E297-C301 VanDerWaalsContact O-CB 3.3Å; E297-C301 WeakPolarHBondContact O-CB 3.49Å; E297-C301 PolarHBondContact O-N 3Å; E297-C301 PolarHBondContact O-SG 3.4Å; E297-C301 VanDerWaalsContact O-SG 3.37Å; F298-C301 PolarHBondContact O-N 2.7Å; C301-F306 WeakPolarHBondContact O-CA 3.26Å; C301-F306 PolarHBondContact O-N 3.22Å; C301-D307 PolarHBondContact O-N 3.42Å; C301-D307 VanDerWaalsContact O-N 3.08Å; C301-A311 HydrophobicContact CB-CB 4.24Å
302	L	84.1	Confident	82.7	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	18%	0.182	C	C	.	.	I	π-helix	trans	-71.7	-44.9	-177.9	-173.8	62	0	0	0	113.1	F298 F299 E300 F306 F308 L342 M343	F298-L302 HydrophobicContact CE1-CD2 4.45Å; F298-L302 HydrophobicContact CZ-CD2 4.31Å; F298-L302 WeakPolarHBondContact O-CB 3.28Å; F298-L302 PolarHBondContact O-N 3.07Å; F299-L302 PolarHBondContact O-N 2.99Å; E300-L302 VanDerWaalsContact C-N 3.31Å; E300-L302 PolarHBondContact O-N 3.26Å; L302-F306 WeakPolarHBondContact O-CD1 3.2Å; L302-F308 HydrophobicContact CD1-CE1 4.16Å; L302-L342 HydrophobicContact CD2-CB 4.06Å; L302-M343 HydrophobicContact CD1-CG 4.18Å
303	F	80.6	Confident	83.3	Confident	28 Å²	28	36 Å²	36	12%	0.123	18%	0.178	C	C	.	.	I	π-helix	trans	-104.7	-19.7	-170.5	-70.7	-69.8	0	0	0	115.7	I277 K281 F299	I277-F303 HydrophobicContact CD1-CE1 4.49Å; I277-F303 HydrophobicContact CD1-CZ 3.92Å; I277-F303 HydrophobicContact CG1-CZ 4.38Å; I277-F303 HydrophobicContact CG2-CD1 3.82Å; I277-F303 HydrophobicContact CG2-CD2 4.21Å; I277-F303 HydrophobicContact CG2-CE1 3.51Å; I277-F303 HydrophobicContact CG2-CE2 3.92Å; I277-F303 HydrophobicContact CG2-CG 4.17Å; I277-F303 HydrophobicContact CG2-CZ 3.57Å; K281-F303 HydrophobicContact CD-CB 4.32Å; K281-F303 WeakPolarHBondContact CE-O 3.33Å; K281-F303 PolarHBondContact NZ-O 3.22Å; F299-F303 AromaticContact CD1-CD2 3.95Å; F299-F303 HydrophobicContact CD1-CD2 3.95Å; F299-F303 AromaticContact CD2-CD2 3.68Å; F299-F303 HydrophobicContact CD2-CD2 3.68Å; F299-F303 AromaticContact CD2-CE2 3.69Å; F299-F303 HydrophobicContact CD2-CE2 3.69Å; F299-F303 HydrophobicContact CE1-CB 4.43Å; F299-F303 AromaticContact CE1-CD2 3.71Å; F299-F303 HydrophobicContact CE1-CD2 3.71Å; F299-F303 HydrophobicContact CE1-CE2 4.42Å; F299-F303 HydrophobicContact CE1-CG 4.37Å; F299-F303 AromaticContact CE2-CD2 3.42Å; F299-F303 HydrophobicContact CE2-CD2 3.42Å; F299-F303 VanDerWaalsContact CE2-CD2 3.42Å; F299-F303 AromaticContact CE2-CE2 3.29Å; F299-F303 HydrophobicContact CE2-CE2 3.29Å; F299-F303 HydrophobicContact CE2-CZ 4.4Å; F299-F303 AromaticContact CG-CD2 3.95Å; F299-F303 HydrophobicContact CG-CD2 3.95Å; F299-F303 HydrophobicContact CG-CE2 4.42Å; F299-F303 AromaticContact CZ-CD2 3.45Å; F299-F303 HydrophobicContact CZ-CD2 3.45Å; F299-F303 VanDerWaalsContact CZ-CD2 3.45Å; F299-F303 AromaticContact CZ-CE2 3.72Å; F299-F303 HydrophobicContact CZ-CE2 3.72Å; F299-F303 HydrophobicContact CZ-CG 4.28Å; F299-F303 PolarHBondContact O-N 3.32Å
304	V	81.7	Confident	83.5	Confident	50 Å²	50	39.1 Å²	39.1	30%	0.303	19%	0.192	S	C	.	.	I	π-helix	trans	-102.5	-55	178.8	-174.4	0	0	0	0	110.2	K281 E300	K281-V304 HydrophobicContact CG-CG2 4.22Å; E300-V304 HydrophobicContact CG-CB 4.09Å; E300-V304 HydrophobicContact CG-CG2 3.97Å; E300-V304 WeakPolarHBondContact O-CA 3.44Å; E300-V304 WeakPolarHBondContact O-CB 3.23Å; E300-V304 PolarHBondContact O-N 2.91Å
305	K	81.9	Confident	83.6	Confident	123 Å²	123	39.6 Å²	39.6	54%	0.535	19%	0.194	S	C	.	.	I	π-helix	trans	-86.3	-24.8	-174.4	-63.2	175.1	-176.4	146.9	0	113.4	E300 D307	E300-K305 PolarHBondContact O-N 2.74Å; E300-K305 VanDerWaalsContact O-N 3.14Å; E300-K305 WeakPolarHBondContact OE1-CE 3.33Å; E300-K305 IonicContact OE1-NZ 3.07Å; E300-K305 PolarHBondContact OE1-NZ 3.27Å; K305-D307 HydrophobicContact CB-CB 4.25Å; K305-D307 PolarHBondContact O-N 3.24Å
306	F	80.5	Confident	83.7	Confident	100 Å²	100	45.4 Å²	45.4	44%	0.439	22%	0.216	S	C	.	.			trans	52.1	35.9	-169	-65.5	-83.8	0	0	0	112.7	C301 L302 I350	C301-F306 WeakPolarHBondContact O-CA 3.26Å; C301-F306 PolarHBondContact O-N 3.22Å; L302-F306 WeakPolarHBondContact O-CD1 3.2Å; F306-I350 HydrophobicContact CD1-CD1 3.96Å
307	D	85	Confident	83.8	Confident	72 Å²	72	47.6 Å²	47.6	39%	0.385	23%	0.229	S	C	.	.			trans	-95.4	104	176.2	-178.9	4.1	0	0	0	109.6	C301 K305 D309 G310 A311	C301-D307 PolarHBondContact O-N 3.42Å; C301-D307 VanDerWaalsContact O-N 3.08Å; K305-D307 HydrophobicContact CB-CB 4.25Å; K305-D307 PolarHBondContact O-N 3.24Å; D307-D309 PolarHBondContact OD1-N 3.47Å; D307-D309 VanDerWaalsContact OD1-N 3.14Å; D307-G310 PolarHBondContact OD1-N 3.03Å; D307-G310 VanDerWaalsContact OD1-N 3.14Å; D307-A311 VanDerWaalsContact O-CB 3.3Å; D307-A311 WeakPolarHBondContact O-CB 3.19Å; D307-A311 PolarHBondContact O-N 2.9Å
308	F	80.3	Confident	83.9	Confident	24 Å²	24	45.8 Å²	45.8	11%	0.105	22%	0.221	C	C	.	.	H	α-helix	trans	-76.8	-29.4	-177.2	-64.1	-77.7	0	0	0	113.1	L302 A311 Q312 F347 I350	L302-F308 HydrophobicContact CD1-CE1 4.16Å; F308-A311 PolarHBondContact O-N 3.39Å; F308-Q312 PolarHBondContact O-N 3.12Å; F308-F347 HydrophobicContact CB-CD2 4.5Å; F308-F347 HydrophobicContact CD1-CB 4.4Å; F308-F347 AromaticContact CD1-CD2 3.9Å; F308-F347 HydrophobicContact CD1-CD2 3.9Å; F308-F347 AromaticContact CD2-CD2 3.71Å; F308-F347 HydrophobicContact CD2-CD2 3.71Å; F308-F347 HydrophobicContact CD2-CE2 4.08Å; F308-F347 HydrophobicContact CE1-CB 3.91Å; F308-F347 AromaticContact CE1-CD2 3.97Å; F308-F347 HydrophobicContact CE1-CD2 3.97Å; F308-F347 HydrophobicContact CE1-CG 4.47Å; F308-F347 AromaticContact CE2-CD2 3.79Å; F308-F347 HydrophobicContact CE2-CD2 3.79Å; F308-F347 HydrophobicContact CE2-CE2 4.4Å; F308-F347 AromaticContact CG-CD2 3.76Å; F308-F347 HydrophobicContact CG-CD2 3.76Å; F308-F347 HydrophobicContact CG-CE2 4.31Å; F308-F347 HydrophobicContact CZ-CB 4.13Å; F308-F347 AromaticContact CZ-CD2 3.92Å; F308-F347 HydrophobicContact CZ-CD2 3.92Å; F308-I350 HydrophobicContact CE2-CD1 3.9Å; F308-I350 HydrophobicContact CZ-CD1 3.8Å
309	D	83.4	Confident	83.7	Confident	87 Å²	87	49.3 Å²	49.3	47%	0.465	24%	0.237	S	C	.	.	H	α-helix	trans	-76.7	-41.6	-178.5	-60.3	-18.8	0	0	0	109.1	D307 Q312 Q313 K362	D307-D309 PolarHBondContact OD1-N 3.47Å; D307-D309 VanDerWaalsContact OD1-N 3.14Å; D309-Q312 PolarHBondContact O-N 3.38Å; D309-Q313 WeakPolarHBondContact O-CG 3.31Å; D309-Q313 PolarHBondContact O-N 3.28Å; D309-Q313 VanDerWaalsContact O-N 3.11Å; D309-K362 WeakPolarHBondContact OD1-CE 3.34Å; D309-K362 IonicContact OD1-NZ 3.69Å; D309-K362 PolarHBondContact OD1-NZ 3.37Å
310	G	83.1	Confident	83.6	Confident	13 Å²	13	52.7 Å²	52.7	13%	0.134	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-44.8	168.3	0	0	0	0	0	112.3	D307 Q312 Q313 K314	D307-G310 PolarHBondContact OD1-N 3.03Å; D307-G310 VanDerWaalsContact OD1-N 3.14Å; G310-Q312 VanDerWaalsContact C-N 3.34Å; G310-Q312 PolarHBondContact O-N 3.44Å; G310-Q313 PolarHBondContact O-N 2.55Å; G310-K314 VanDerWaalsContact O-CG 3.29Å; G310-K314 WeakPolarHBondContact O-CG 3.22Å; G310-K314 PolarHBondContact O-N 3.12Å
311	A	84.3	Confident	83.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-41.2	177	0	0	0	0	0	112.4	F298 C301 D307 F308 K314 L315 M343	F298-A311 HydrophobicContact CD2-CB 4.04Å; F298-A311 WeakPolarHBondContact CD2-O 3.42Å; F298-A311 HydrophobicContact CE2-CB 4.02Å; C301-A311 HydrophobicContact CB-CB 4.24Å; D307-A311 VanDerWaalsContact O-CB 3.3Å; D307-A311 WeakPolarHBondContact O-CB 3.19Å; D307-A311 PolarHBondContact O-N 2.9Å; F308-A311 PolarHBondContact O-N 3.39Å; A311-K314 PolarHBondContact O-N 2.85Å; A311-L315 WeakPolarHBondContact O-CB 3.41Å; A311-L315 PolarHBondContact O-N 2.99Å; A311-M343 HydrophobicContact CB-SD 4.27Å
312	Q	82.8	Confident	83.2	Confident	27 Å²	27	50.8 Å²	50.8	13%	0.126	25%	0.249	C	C	.	.	H	α-helix	trans	-63.7	-44.7	177.1	-175	-174.2	4.4	0	0	112	F308 D309 G310 K314 L315 R316 E361 K362 N364	F308-Q312 PolarHBondContact O-N 3.12Å; D309-Q312 PolarHBondContact O-N 3.38Å; G310-Q312 VanDerWaalsContact C-N 3.34Å; G310-Q312 PolarHBondContact O-N 3.44Å; Q312-K314 VanDerWaalsContact C-N 3.31Å; Q312-K314 PolarHBondContact O-N 3.47Å; Q312-L315 PolarHBondContact O-N 3.2Å; Q312-R316 PolarHBondContact O-N 2.93Å; Q312-E361 PolarHBondContact NE2-O 3.39Å; Q312-K362 WeakPolarHBondContact CG-O 3.38Å; Q312-K362 PolarHBondContact NE2-O 3.47Å; Q312-N364 PolarHBondContact NE2-OD1 3.46Å; Q312-N364 VanDerWaalsContact NE2-OD1 3.08Å
313	Q	86.5	Confident	82.9	Confident	130 Å²	130	52.6 Å²	52.6	61%	0.607	26%	0.26	S	S	*	.	H	α-helix	trans	-61.1	-43.2	176.5	-69.9	178.4	8.5	0	0	111.1	D309 G310 L315 R316 V317	D309-Q313 WeakPolarHBondContact O-CG 3.31Å; D309-Q313 PolarHBondContact O-N 3.28Å; D309-Q313 VanDerWaalsContact O-N 3.11Å; G310-Q313 PolarHBondContact O-N 2.55Å; Q313-L315 VanDerWaalsContact C-N 3.33Å; Q313-L315 PolarHBondContact O-N 3.37Å; Q313-R316 PolarHBondContact O-N 3.21Å; Q313-V317 WeakPolarHBondContact O-CG2 3.37Å; Q313-V317 PolarHBondContact O-N 3.11Å; Q313-V317 VanDerWaalsContact O-N 3.1Å
314	K	84.8	Confident	82.7	Confident	65 Å²	65	53.3 Å²	53.3	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-65.9	-35.1	176.8	-64.3	-66	170.5	178.4	0	112.2	E297 F298 G310 A311 Q312 V317 C318	E297-K314 HydrophobicContact CB-CD 4.24Å; E297-K314 WeakPolarHBondContact OE2-CD 3.4Å; E297-K314 WeakPolarHBondContact OE2-CE 3.33Å; E297-K314 IonicContact OE2-NZ 2.71Å; E297-K314 PolarHBondContact OE2-NZ 3.43Å; F298-K314 HydrophobicContact CB-CB 4.11Å; G310-K314 VanDerWaalsContact O-CG 3.29Å; G310-K314 WeakPolarHBondContact O-CG 3.22Å; G310-K314 PolarHBondContact O-N 3.12Å; A311-K314 PolarHBondContact O-N 2.85Å; Q312-K314 VanDerWaalsContact C-N 3.31Å; Q312-K314 PolarHBondContact O-N 3.47Å; K314-V317 CarbonylContact O-C 3.54Å; K314-V317 PolarHBondContact O-N 2.94Å; K314-C318 PolarHBondContact O-N 3.47Å; K314-C318 PolarHBondContact O-SG 3.44Å
315	L	85.5	Confident	82.5	Confident	14 Å²	14	51.5 Å²	51.5	7%	0.073	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-39.8	174.6	-170.4	152.1	0	0	0	111.9	F298 A311 Q312 Q313 V317 C318 E319 M336 A339 M343	F298-L315 HydrophobicContact CD2-CB 4.31Å; F298-L315 HydrophobicContact CE2-CB 4.25Å; F298-L315 HydrophobicContact CE2-CD1 4.07Å; F298-L315 HydrophobicContact CZ-CD1 4.34Å; A311-L315 WeakPolarHBondContact O-CB 3.41Å; A311-L315 PolarHBondContact O-N 2.99Å; Q312-L315 PolarHBondContact O-N 3.2Å; Q313-L315 VanDerWaalsContact C-N 3.33Å; Q313-L315 PolarHBondContact O-N 3.37Å; L315-V317 VanDerWaalsContact C-N 3.3Å; L315-V317 PolarHBondContact O-N 3.23Å; L315-C318 WeakPolarHBondContact O-CB 3.19Å; L315-C318 PolarHBondContact O-N 2.66Å; L315-E319 PolarHBondContact O-N 3.25Å; L315-M336 HydrophobicContact CD2-CE 3.44Å; L315-M336 VanDerWaalsContact CD2-CE 3.44Å; L315-M336 HydrophobicContact CD2-SD 4.06Å; L315-M336 HydrophobicContact CG-CE 4.3Å; L315-M336 HydrophobicContact CG-SD 4.29Å; L315-A339 HydrophobicContact CD1-CB 4.06Å; L315-M343 HydrophobicContact CD1-CE 3.47Å; L315-M343 VanDerWaalsContact CD1-CE 3.47Å; L315-M343 HydrophobicContact CD1-SD 4.1Å
316	R	85.3	Confident	82.2	Confident	122 Å²	122	49 Å²	49	46%	0.46	24%	0.243	S	C	.	.	H	α-helix	trans	-62.2	-38.1	172	-67.4	179.6	-175.8	-176.9	-0.6	112.1	Q312 Q313 E319 N364	Q312-R316 PolarHBondContact O-N 2.93Å; Q313-R316 PolarHBondContact O-N 3.21Å; R316-E319 WeakPolarHBondContact O-CB 3.38Å; R316-E319 PolarHBondContact O-N 3.39Å; R316-N364 PolarHBondContact NE-ND2 2.93Å; R316-N364 PolarHBondContact NH2-OD1 3.37Å
317	V	86.3	Confident	82	Confident	53 Å²	53	45 Å²	45	32%	0.321	23%	0.226	S	C	.	.	H	α-helix	trans	-67.1	-45	173.4	179.6	0	0	0	0	110	F4 P294 Q313 K314 L315 E319 T320 V321	F4-V317 HydrophobicContact CE2-CG1 4.41Å; P294-V317 HydrophobicContact CB-CB 4.21Å; P294-V317 HydrophobicContact CB-CG1 3.78Å; P294-V317 HydrophobicContact CG-CG1 3.58Å; Q313-V317 WeakPolarHBondContact O-CG2 3.37Å; Q313-V317 PolarHBondContact O-N 3.11Å; Q313-V317 VanDerWaalsContact O-N 3.1Å; K314-V317 CarbonylContact O-C 3.54Å; K314-V317 PolarHBondContact O-N 2.94Å; L315-V317 VanDerWaalsContact C-N 3.3Å; L315-V317 PolarHBondContact O-N 3.23Å; V317-E319 PolarHBondContact O-N 3.4Å; V317-T320 PolarHBondContact O-N 2.71Å; V317-T320 PolarHBondContact O-OG1 3.17Å; V317-V321 HydrophobicContact CG1-CG2 4.07Å; V317-V321 WeakPolarHBondContact O-CG2 3.29Å; V317-V321 PolarHBondContact O-N 3.44Å; V317-V321 VanDerWaalsContact O-N 3.17Å
318	C	84.2	Confident	81.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-55	-38.3	177.1	-67.5	0	0	0	0	112	P294 K314 L315 T320 V321 L322	P294-C318 VanDerWaalsContact C-SG 3.56Å; K314-C318 PolarHBondContact O-N 3.47Å; K314-C318 PolarHBondContact O-SG 3.44Å; L315-C318 WeakPolarHBondContact O-CB 3.19Å; L315-C318 PolarHBondContact O-N 2.66Å; C318-T320 PolarHBondContact O-N 3.04Å; C318-V321 PolarHBondContact O-N 2.8Å; C318-L322 HydrophobicContact CB-CD1 4.2Å; C318-L322 HydrophobicContact CB-CG 4.49Å; C318-L322 WeakPolarHBondContact O-CB 3.23Å; C318-L322 VanDerWaalsContact O-CG 3.26Å; C318-L322 WeakPolarHBondContact O-CG 3.36Å; C318-L322 PolarHBondContact O-N 2.87Å
319	E	83.1	Confident	81.4	Confident	75 Å²	75	43.3 Å²	43.3	35%	0.35	22%	0.22	S	C	.	.	H	α-helix	trans	-58.3	-31.8	176.1	-176.8	168.9	-157	0	0	113.2	L315 R316 V317 P323 Y332 M336	L315-E319 PolarHBondContact O-N 3.25Å; R316-E319 WeakPolarHBondContact O-CB 3.38Å; R316-E319 PolarHBondContact O-N 3.39Å; V317-E319 PolarHBondContact O-N 3.4Å; E319-P323 WeakPolarHBondContact O-CD 3.48Å; E319-P323 WeakPolarHBondContact O-CG 3.32Å; E319-Y332 HydrophobicContact CG-CE2 4.22Å; E319-Y332 WeakPolarHBondContact CG-OH 3.46Å; E319-Y332 PolarHBondContact OE1-OH 3.02Å; E319-M336 HydrophobicContact CB-CE 4.18Å; E319-M336 HydrophobicContact CG-CE 4.38Å
320	T	82	Confident	81.1	Confident	73 Å²	73	42.6 Å²	42.6	45%	0.448	23%	0.233	S	C	.	.	H	α-helix	trans	-84.7	-24.7	175	67.8	0	0	0	0	113.5	V317 C318 N324	V317-T320 PolarHBondContact O-N 2.71Å; V317-T320 PolarHBondContact O-OG1 3.17Å; C318-T320 PolarHBondContact O-N 3.04Å; T320-N324 PolarHBondContact O-ND2 2.94Å
321	V	82.4	Confident	80.8	Confident	8 Å²	8	42.3 Å²	42.3	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-91.5	-42.7	-174	-170.9	0	0	0	0	111.5	F4 P294 V317 C318 N324	F4-V321 HydrophobicContact CB-CG1 3.63Å; F4-V321 HydrophobicContact CB-CG2 4.46Å; F4-V321 HydrophobicContact CD2-CG1 4.32Å; F4-V321 HydrophobicContact CD2-CG2 3.64Å; F4-V321 HydrophobicContact CE2-CG2 4.22Å; F4-V321 HydrophobicContact CG-CG1 4.13Å; F4-V321 HydrophobicContact CG-CG2 4.22Å; P294-V321 HydrophobicContact CG-CG2 4.39Å; V317-V321 HydrophobicContact CG1-CG2 4.07Å; V317-V321 WeakPolarHBondContact O-CG2 3.29Å; V317-V321 PolarHBondContact O-N 3.44Å; V317-V321 VanDerWaalsContact O-N 3.17Å; C318-V321 PolarHBondContact O-N 2.8Å; V321-N324 PolarHBondContact O-N 3.46Å; V321-N324 VanDerWaalsContact O-N 3.15Å
322	L	79.9	Confident	80.7	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-57.2	-43.9	-179.4	-68.8	172	0	0	0	115.3	V263 V295 C318 N324 D325 L328 Y332 F335	V263-L322 HydrophobicContact CG2-CD2 4.28Å; V295-L322 HydrophobicContact CG2-CD2 4.29Å; C318-L322 HydrophobicContact CB-CD1 4.2Å; C318-L322 HydrophobicContact CB-CG 4.49Å; C318-L322 WeakPolarHBondContact O-CB 3.23Å; C318-L322 VanDerWaalsContact O-CG 3.26Å; C318-L322 WeakPolarHBondContact O-CG 3.36Å; C318-L322 PolarHBondContact O-N 2.87Å; L322-N324 PolarHBondContact O-N 3.39Å; L322-D325 PolarHBondContact O-N 2.95Å; L322-L328 HydrophobicContact CD2-CB 4.18Å; L322-L328 HydrophobicContact CD2-CD1 3.56Å; L322-L328 HydrophobicContact CD2-CG 4.44Å; L322-Y332 HydrophobicContact CB-CD2 3.91Å; L322-Y332 HydrophobicContact CD1-CD2 4.2Å; L322-F335 HydrophobicContact CD1-CD1 3.38Å; L322-F335 HydrophobicContact CD1-CE1 3.67Å; L322-F335 HydrophobicContact CD1-CG 4.22Å
323	P	77.8	Confident	80.6	Confident	39 Å²	39	48.9 Å²	48.9	25%	0.253	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-71.8	-10	-180	29	-36.5	0	0	0	113.5	Y25 K29 E319	Y25-P323 PolarHBondContact OH-O 3.28Å; Y25-P323 VanDerWaalsContact OH-O 3.07Å; K29-P323 WeakPolarHBondContact CE-O 3.4Å; K29-P323 PolarHBondContact NZ-O 2.96Å; E319-P323 WeakPolarHBondContact O-CD 3.48Å; E319-P323 WeakPolarHBondContact O-CG 3.32Å
324	N	76	Confident	80.5	Confident	44 Å²	44	46.8 Å²	46.8	24%	0.235	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-93.8	-9.8	177.7	-69.7	-30.7	0	0	0	112.6	Y25 I31 T320 V321 L322	Y25-N324 WeakPolarHBondContact CE1-O 3.43Å; I31-N324 HydrophobicContact CD1-CB 3.83Å; T320-N324 PolarHBondContact O-ND2 2.94Å; V321-N324 PolarHBondContact O-N 3.46Å; V321-N324 VanDerWaalsContact O-N 3.15Å; L322-N324 PolarHBondContact O-N 3.39Å
325	D	77.2	Confident	80.5	Confident	12 Å²	12	43.8 Å²	43.8	6%	0.064	24%	0.238	C	C	.	.	S	Bend	trans	-88	134.6	176.5	-86.4	41.4	0	0	0	110.8	R259 L322 F327 L328 T329	R259-D325 VanDerWaalsContact CZ-CG 3.44Å; R259-D325 IonicContact CZ-OD1 2.7Å; R259-D325 VanDerWaalsContact CZ-OD1 3.31Å; R259-D325 IonicContact CZ-OD2 3.2Å; R259-D325 IonicContact NE-OD2 3.92Å; R259-D325 VanDerWaalsContact NH1-CG 3.35Å; R259-D325 IonicContact NH1-OD1 2.73Å; R259-D325 PolarHBondContact NH1-OD1 2.95Å; R259-D325 IonicContact NH1-OD2 3.45Å; R259-D325 PolarHBondContact NH1-OD2 3.26Å; R259-D325 IonicContact NH2-OD1 3.23Å; R259-D325 PolarHBondContact NH2-OD1 3.39Å; R259-D325 IonicContact NH2-OD2 3.14Å; R259-D325 PolarHBondContact NH2-OD2 2.83Å; L322-D325 PolarHBondContact O-N 2.95Å; D325-F327 PolarHBondContact O-N 2.88Å; D325-L328 HydrophobicContact CB-CB 3.97Å; D325-L328 HydrophobicContact CB-CD1 4.11Å; D325-L328 HydrophobicContact CB-CG 4.15Å; D325-T329 PolarHBondContact O-OG1 3.35Å
326	F	76.1	Confident	80.5	Confident	70 Å²	70	43.4 Å²	43.4	31%	0.307	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-49.2	179.3	-178.3	-104.5	0	0	0	112.5	P21 L22 Y25 F224	P21-F326 HydrophobicContact CB-CZ 4.27Å; L22-F326 HydrophobicContact CD2-CB 3.7Å; L22-F326 HydrophobicContact CD2-CD1 3.5Å; L22-F326 HydrophobicContact CD2-CD2 4.23Å; L22-F326 HydrophobicContact CD2-CE1 4.15Å; L22-F326 HydrophobicContact CD2-CG 3.55Å; Y25-F326 HydrophobicContact CD1-CB 3.98Å; Y25-F326 HydrophobicContact CD1-CD2 4.01Å; Y25-F326 AromaticContact CD2-CD2 3.84Å; Y25-F326 HydrophobicContact CD2-CD2 3.84Å; Y25-F326 HydrophobicContact CD2-CE2 4.41Å; Y25-F326 HydrophobicContact CE1-CB 4.28Å; Y25-F326 HydrophobicContact CG-CB 4.38Å; Y25-F326 AromaticContact CG-CD2 3.53Å; Y25-F326 HydrophobicContact CG-CD2 3.53Å; Y25-F326 HydrophobicContact CG-CE2 4.33Å; Y25-F326 HydrophobicContact CG-CG 4.44Å; F224-F326 HydrophobicContact CD1-CE1 4.24Å; F224-F326 HydrophobicContact CE1-CD1 4.41Å; F224-F326 AromaticContact CE1-CE1 3.97Å; F224-F326 HydrophobicContact CE1-CE1 3.97Å
327	F	76.2	Confident	80.3	Confident	15 Å²	15	43.1 Å²	43.1	7%	0.066	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-29.6	-174.5	-60.4	-67.6	0	0	0	114.4	L22 L223 F224 F227 Y260 D325	L22-F327 HydrophobicContact CD2-CE2 4.44Å; L22-F327 HydrophobicContact CD2-CZ 4.38Å; L223-F327 HydrophobicContact CB-CZ 4.49Å; F224-F327 HydrophobicContact CB-CE1 4.28Å; F224-F327 AromaticContact CD1-CE1 3.41Å; F224-F327 HydrophobicContact CD1-CE1 3.41Å; F224-F327 VanDerWaalsContact CD1-CE1 3.41Å; F224-F327 AromaticContact CD1-CZ 3.73Å; F224-F327 HydrophobicContact CD1-CZ 3.73Å; F224-F327 HydrophobicContact CD2-CE1 4.11Å; F224-F327 AromaticContact CD2-CZ 3.89Å; F224-F327 HydrophobicContact CD2-CZ 3.89Å; F224-F327 AromaticContact CE1-CE1 3.65Å; F224-F327 HydrophobicContact CE1-CE1 3.65Å; F224-F327 AromaticContact CE1-CZ 3.52Å; F224-F327 HydrophobicContact CE1-CZ 3.52Å; F224-F327 HydrophobicContact CE2-CE1 4.33Å; F224-F327 AromaticContact CE2-CZ 3.72Å; F224-F327 HydrophobicContact CE2-CZ 3.72Å; F224-F327 AromaticContact CG-CE1 3.66Å; F224-F327 HydrophobicContact CG-CE1 3.66Å; F224-F327 AromaticContact CG-CZ 3.91Å; F224-F327 HydrophobicContact CG-CZ 3.91Å; F224-F327 HydrophobicContact CZ-CE1 4.13Å; F224-F327 AromaticContact CZ-CZ 3.54Å; F224-F327 HydrophobicContact CZ-CZ 3.54Å; F227-F327 HydrophobicContact CB-CB 4.45Å; F227-F327 HydrophobicContact CB-CD1 4.38Å; F227-F327 HydrophobicContact CD2-CB 3.66Å; F227-F327 HydrophobicContact CD2-CD1 4.08Å; F227-F327 HydrophobicContact CD2-CG 4.03Å; F227-F327 HydrophobicContact CE2-CB 3.97Å; F227-F327 HydrophobicContact CE2-CG 4.48Å; F227-F327 HydrophobicContact CG-CB 3.97Å; Y260-F327 HydrophobicContact CD1-CB 4.5Å; Y260-F327 HydrophobicContact CE1-CB 4.18Å; Y260-F327 HydrophobicContact CE1-CD2 4Å; D325-F327 PolarHBondContact O-N 2.88Å
328	L	77.2	Confident	80.1	Confident	1 Å²	1	42 Å²	42	1%	0.005	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-4.8	-167.4	-62.1	178.3	0	0	0	113.6	F227 Y260 V263 L322 D325 G330 C331 Y332	F227-L328 HydrophobicContact CE1-CD2 3.74Å; F227-L328 HydrophobicContact CZ-CD2 3.73Å; Y260-L328 HydrophobicContact CD1-CD1 4.14Å; Y260-L328 HydrophobicContact CD1-CD2 3.88Å; Y260-L328 HydrophobicContact CD1-CG 4.03Å; Y260-L328 HydrophobicContact CE1-CD1 4.01Å; Y260-L328 HydrophobicContact CE1-CD2 4.33Å; Y260-L328 HydrophobicContact CE1-CG 3.96Å; V263-L328 HydrophobicContact CB-CD2 4.03Å; V263-L328 HydrophobicContact CG1-CD2 3.78Å; V263-L328 HydrophobicContact CG2-CD1 4.19Å; V263-L328 HydrophobicContact CG2-CD2 4.17Å; L322-L328 HydrophobicContact CD2-CB 4.18Å; L322-L328 HydrophobicContact CD2-CD1 3.56Å; L322-L328 HydrophobicContact CD2-CG 4.44Å; D325-L328 HydrophobicContact CB-CB 3.97Å; D325-L328 HydrophobicContact CB-CD1 4.11Å; D325-L328 HydrophobicContact CB-CG 4.15Å; L328-G330 VanDerWaalsContact C-N 3.32Å; L328-G330 PolarHBondContact O-N 3.12Å; L328-C331 PolarHBondContact O-N 3.03Å; L328-Y332 PolarHBondContact O-N 2.79Å; L328-Y332 VanDerWaalsContact O-N 3.16Å
329	T	75.3	Confident	80.1	Confident	61 Å²	61	42 Å²	42	37%	0.374	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-60.9	-39.6	-176	-62.1	0	0	0	0	112.4	Y25 D325 C331	Y25-T329 PolarHBondContact OH-OG1 2.78Å; D325-T329 PolarHBondContact O-OG1 3.35Å; T329-C331 VanDerWaalsContact C-N 3.34Å; T329-C331 PolarHBondContact O-N 3.43Å
330	G	77.6	Confident	80.1	Confident	71 Å²	71	41.4 Å²	41.4	73%	0.732	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-75.3	-18.9	176.7	0	0	0	0	0	114.6	L328	L328-G330 VanDerWaalsContact C-N 3.32Å; L328-G330 PolarHBondContact O-N 3.12Å
331	C	76.1	Confident	80	Confident	7 Å²	7	40.3 Å²	40.3	5%	0.047	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-100.5	0.7	-177.6	-64.9	0	0	0	0	113.1	K233 V263 L328 T329 F335	K233-C331 WeakPolarHBondContact CE-SG 3.34Å; V263-C331 HydrophobicContact CG1-CB 4.33Å; L328-C331 PolarHBondContact O-N 3.03Å; T329-C331 VanDerWaalsContact C-N 3.34Å; T329-C331 PolarHBondContact O-N 3.43Å; C331-F335 WeakPolarHBondContact O-CB 3.22Å; C331-F335 PolarHBondContact O-N 3.37Å
332	Y	81.5	Confident	79.9	Confident	54 Å²	54	40.3 Å²	40.3	21%	0.212	22%	0.218	C	C	.	.	H	α-helix	trans	-60	-52.5	-173.9	164.7	-98.9	0	0	0	112.2	E319 L322 L328 F335 M336	E319-Y332 HydrophobicContact CG-CE2 4.22Å; E319-Y332 WeakPolarHBondContact CG-OH 3.46Å; E319-Y332 PolarHBondContact OE1-OH 3.02Å; L322-Y332 HydrophobicContact CB-CD2 3.91Å; L322-Y332 HydrophobicContact CD1-CD2 4.2Å; L328-Y332 PolarHBondContact O-N 2.79Å; L328-Y332 VanDerWaalsContact O-N 3.16Å; Y332-F335 PolarHBondContact O-N 3.01Å; Y332-M336 HydrophobicContact CD2-CG 4.04Å; Y332-M336 HydrophobicContact CE2-CG 3.69Å; Y332-M336 HydrophobicContact CE2-SD 4.27Å; Y332-M336 VanDerWaalsContact O-CG 3.27Å; Y332-M336 WeakPolarHBondContact O-CG 3.41Å; Y332-M336 PolarHBondContact O-N 3.28Å
333	D	82.3	Confident	79.9	Confident	112 Å²	112	41 Å²	41	60%	0.599	22%	0.222	S	C	*	.	H	α-helix	trans	-64.4	-47.8	-176.5	-65.2	-38.4	0	0	0	111.3	F335 M336 E337	D333-F335 VanDerWaalsContact C-N 3.3Å; D333-F335 PolarHBondContact O-N 3Å; D333-M336 PolarHBondContact O-N 3.24Å; D333-E337 PolarHBondContact O-N 2.93Å
334	E	83.2	Confident	79.9	Confident	86 Å²	86	39.9 Å²	39.9	40%	0.402	21%	0.212	S	C	.	.	H	α-helix	trans	-59.8	-40.6	176.6	-67.3	-178.2	-178.6	0	0	112	K233 T267 N338	K233-E334 IonicContact NZ-OE1 3.17Å; K233-E334 IonicContact NZ-OE2 3.02Å; K233-E334 PolarHBondContact NZ-OE2 3.44Å; T267-E334 HydrophobicContact CG2-CB 4.11Å; E334-N338 VanDerWaalsContact O-CB 3.23Å; E334-N338 WeakPolarHBondContact O-CB 3.5Å; E334-N338 PolarHBondContact O-N 2.98Å; E334-N338 PolarHBondContact O-ND2 2.92Å
335	F	85.5	Confident	80	Confident	1 Å²	1	40.9 Å²	40.9	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-66	-44.5	178.7	175.6	-93	0	0	0	111	V263 I266 T267 V295 L322 C331 Y332 D333 N338 A339	V263-F335 HydrophobicContact CB-CD2 4.16Å; V263-F335 HydrophobicContact CB-CE2 4.38Å; V263-F335 HydrophobicContact CG1-CB 4.39Å; V263-F335 HydrophobicContact CG1-CD2 3.82Å; V263-F335 HydrophobicContact CG1-CG 4.35Å; V263-F335 HydrophobicContact CG2-CD2 4.02Å; V263-F335 HydrophobicContact CG2-CE2 3.91Å; I266-F335 HydrophobicContact CB-CD2 4.02Å; I266-F335 HydrophobicContact CB-CE2 3.96Å; I266-F335 HydrophobicContact CD1-CD2 4.4Å; I266-F335 HydrophobicContact CD1-CE2 3.49Å; I266-F335 VanDerWaalsContact CD1-CE2 3.49Å; I266-F335 HydrophobicContact CD1-CZ 4.09Å; I266-F335 HydrophobicContact CG1-CE2 4.31Å; I266-F335 HydrophobicContact CG2-CD2 3.72Å; I266-F335 HydrophobicContact CG2-CE2 3.86Å; T267-F335 HydrophobicContact CG2-CB 4.01Å; V295-F335 HydrophobicContact CG1-CE2 4.24Å; V295-F335 HydrophobicContact CG1-CZ 3.99Å; L322-F335 HydrophobicContact CD1-CD1 3.38Å; L322-F335 HydrophobicContact CD1-CE1 3.67Å; L322-F335 HydrophobicContact CD1-CG 4.22Å; C331-F335 WeakPolarHBondContact O-CB 3.22Å; C331-F335 PolarHBondContact O-N 3.37Å; Y332-F335 PolarHBondContact O-N 3.01Å; D333-F335 VanDerWaalsContact C-N 3.3Å; D333-F335 PolarHBondContact O-N 3Å; F335-N338 PolarHBondContact O-N 3.21Å; F335-A339 HydrophobicContact CE1-CB 4.29Å; F335-A339 WeakPolarHBondContact O-CB 3.26Å; F335-A339 PolarHBondContact O-N 3.04Å
336	M	84.4	Confident	80.1	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.03	22%	0.216	C	C	.	.	H	α-helix	trans	-64.7	-44	-178.7	-71.7	-65.9	-75.3	0	0	111.6	L315 E319 Y332 D333 R340	L315-M336 HydrophobicContact CD2-CE 3.44Å; L315-M336 VanDerWaalsContact CD2-CE 3.44Å; L315-M336 HydrophobicContact CD2-SD 4.06Å; L315-M336 HydrophobicContact CG-CE 4.3Å; L315-M336 HydrophobicContact CG-SD 4.29Å; E319-M336 HydrophobicContact CB-CE 4.18Å; E319-M336 HydrophobicContact CG-CE 4.38Å; Y332-M336 HydrophobicContact CD2-CG 4.04Å; Y332-M336 HydrophobicContact CE2-CG 3.69Å; Y332-M336 HydrophobicContact CE2-SD 4.27Å; Y332-M336 VanDerWaalsContact O-CG 3.27Å; Y332-M336 WeakPolarHBondContact O-CG 3.41Å; Y332-M336 PolarHBondContact O-N 3.28Å; D333-M336 PolarHBondContact O-N 3.24Å; M336-R340 WeakPolarHBondContact O-CB 3.27Å; M336-R340 VanDerWaalsContact O-CG 3.26Å; M336-R340 WeakPolarHBondContact O-CG 3.42Å; M336-R340 PolarHBondContact O-N 2.97Å
337	E	81.6	Confident	80.3	Confident	117 Å²	117	38.3 Å²	38.3	55%	0.547	21%	0.205	S	C	.	.	H	α-helix	trans	-61.9	-51.6	174.1	-70	-172.1	167.2	0	0	111.1	D333 A339 R340 L341	D333-E337 PolarHBondContact O-N 2.93Å; E337-A339 VanDerWaalsContact C-N 3.33Å; E337-A339 PolarHBondContact O-N 2.98Å; E337-R340 PolarHBondContact O-N 3.41Å; E337-L341 WeakPolarHBondContact O-CG 3.3Å; E337-L341 PolarHBondContact O-N 2.78Å
338	N	83.1	Confident	80.2	Confident	29 Å²	29	38 Å²	38	16%	0.155	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-35.5	-179.8	-77.7	-56.3	0	0	0	113.5	I266 E334 F335 L341 L342	I266-N338 HydrophobicContact CG2-CB 3.81Å; I266-N338 WeakPolarHBondContact O-CB 3.27Å; E334-N338 VanDerWaalsContact O-CB 3.23Å; E334-N338 WeakPolarHBondContact O-CB 3.5Å; E334-N338 PolarHBondContact O-N 2.98Å; E334-N338 PolarHBondContact O-ND2 2.92Å; F335-N338 PolarHBondContact O-N 3.21Å; N338-L341 PolarHBondContact O-N 2.95Å; N338-L342 WeakPolarHBondContact O-CB 3.37Å; N338-L342 WeakPolarHBondContact O-CG 3.22Å; N338-L342 PolarHBondContact O-N 2.78Å
339	A	84	Confident	80.2	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-44.6	175.2	0	0	0	0	0	110.9	F298 L315 F335 E337 L341 L342 M343	F298-A339 HydrophobicContact CE1-CB 3.94Å; F298-A339 HydrophobicContact CZ-CB 3.83Å; L315-A339 HydrophobicContact CD1-CB 4.06Å; F335-A339 HydrophobicContact CE1-CB 4.29Å; F335-A339 WeakPolarHBondContact O-CB 3.26Å; F335-A339 PolarHBondContact O-N 3.04Å; E337-A339 VanDerWaalsContact C-N 3.33Å; E337-A339 PolarHBondContact O-N 2.98Å; A339-L341 VanDerWaalsContact C-N 3.35Å; A339-L341 PolarHBondContact O-N 3.09Å; A339-L342 PolarHBondContact O-N 3.16Å; A339-M343 WeakPolarHBondContact O-CG 3.4Å; A339-M343 PolarHBondContact O-N 3.45Å
340	R	81.6	Confident	80.4	Confident	63 Å²	63	46 Å²	46	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-44.1	173.7	-71.9	173.3	-174.4	165.5	4.2	111.4	M336 E337 L342 M343 F344 L363 W373	M336-R340 WeakPolarHBondContact O-CB 3.27Å; M336-R340 VanDerWaalsContact O-CG 3.26Å; M336-R340 WeakPolarHBondContact O-CG 3.42Å; M336-R340 PolarHBondContact O-N 2.97Å; E337-R340 PolarHBondContact O-N 3.41Å; R340-L342 PolarHBondContact O-N 3.22Å; R340-M343 HydrophobicContact CG-CE 4.27Å; R340-M343 PolarHBondContact O-N 2.85Å; R340-F344 WeakPolarHBondContact O-CB 3.19Å; R340-F344 PolarHBondContact O-N 2.82Å; R340-L363 HydrophobicContact CB-CD2 3.97Å; R340-L363 HydrophobicContact CG-CD2 3.9Å; R340-W373 HydrophobicContact CB-CH2 4.04Å; R340-W373 HydrophobicContact CB-CZ2 3.74Å
341	L	80.5	Confident	80.5	Confident	49 Å²	49	46 Å²	46	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-58.9	-46.2	176.2	-66.1	170.6	0	0	0	111.6	E337 N338 A339 F344 E345 W373 L377	E337-L341 WeakPolarHBondContact O-CG 3.3Å; E337-L341 PolarHBondContact O-N 2.78Å; N338-L341 PolarHBondContact O-N 2.95Å; A339-L341 VanDerWaalsContact C-N 3.35Å; A339-L341 PolarHBondContact O-N 3.09Å; L341-F344 PolarHBondContact O-N 2.94Å; L341-E345 WeakPolarHBondContact O-CB 3.49Å; L341-E345 PolarHBondContact O-N 3.21Å; L341-W373 HydrophobicContact CD2-CH2 3.92Å; L341-W373 HydrophobicContact CD2-CZ2 3.43Å; L341-W373 VanDerWaalsContact CD2-CZ2 3.43Å; L341-W373 HydrophobicContact CG-CH2 4.44Å; L341-W373 HydrophobicContact CG-CZ2 3.83Å; L341-L377 HydrophobicContact CD2-CB 4.45Å; L341-L377 HydrophobicContact CD2-CD1 3.35Å; L341-L377 HydrophobicContact CD2-CD2 3.98Å; L341-L377 HydrophobicContact CD2-CG 4.13Å
342	L	79.9	Confident	80.5	Confident	9 Å²	9	50.4 Å²	50.4	5%	0.047	23%	0.234	C	C	.	.	H	α-helix	trans	-67.9	-39.4	179.8	-77.2	174.3	0	0	0	113.2	I266 L302 N338 A339 R340 F344 S346	I266-L342 HydrophobicContact CG1-CD1 4.07Å; I266-L342 HydrophobicContact CG2-CD1 4.12Å; L302-L342 HydrophobicContact CD2-CB 4.06Å; N338-L342 WeakPolarHBondContact O-CB 3.37Å; N338-L342 WeakPolarHBondContact O-CG 3.22Å; N338-L342 PolarHBondContact O-N 2.78Å; A339-L342 PolarHBondContact O-N 3.16Å; R340-L342 PolarHBondContact O-N 3.22Å; L342-F344 VanDerWaalsContact C-N 3.33Å; L342-S346 VanDerWaalsContact O-CB 3.3Å; L342-S346 WeakPolarHBondContact O-CB 3.41Å; L342-S346 PolarHBondContact O-N 3.13Å; L342-S346 PolarHBondContact O-OG 3.34Å
343	M	80.6	Confident	80.2	Confident	16 Å²	16	51.3 Å²	51.3	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-47.6	172.7	-73.8	-166.3	-56.6	0	0	110.4	F298 L302 A311 L315 A339 R340 S346 F347 L363	F298-M343 HydrophobicContact CE2-CG 3.91Å; F298-M343 HydrophobicContact CE2-SD 3.68Å; F298-M343 HydrophobicContact CZ-CG 3.84Å; F298-M343 HydrophobicContact CZ-SD 4.15Å; L302-M343 HydrophobicContact CD1-CG 4.18Å; A311-M343 HydrophobicContact CB-SD 4.27Å; L315-M343 HydrophobicContact CD1-CE 3.47Å; L315-M343 VanDerWaalsContact CD1-CE 3.47Å; L315-M343 HydrophobicContact CD1-SD 4.1Å; A339-M343 WeakPolarHBondContact O-CG 3.4Å; A339-M343 PolarHBondContact O-N 3.45Å; R340-M343 HydrophobicContact CG-CE 4.27Å; R340-M343 PolarHBondContact O-N 2.85Å; M343-S346 PolarHBondContact O-N 3.1Å; M343-F347 VanDerWaalsContact O-CB 3.29Å; M343-F347 WeakPolarHBondContact O-CB 3.39Å; M343-F347 PolarHBondContact O-N 3.11Å; M343-L363 HydrophobicContact CE-CD2 4.36Å
344	F	77.1	Confident	79.9	Confident	14 Å²	14	46.2 Å²	46.2	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-46.4	179.7	-174.2	-86.2	0	0	0	112.2	R340 L341 L342 S346 F347 C348 L359 W373 I374 L377	R340-F344 WeakPolarHBondContact O-CB 3.19Å; R340-F344 PolarHBondContact O-N 2.82Å; L341-F344 PolarHBondContact O-N 2.94Å; L342-F344 VanDerWaalsContact C-N 3.33Å; F344-S346 VanDerWaalsContact C-N 3.27Å; F344-S346 PolarHBondContact O-N 3.16Å; F344-F347 PolarHBondContact O-N 2.97Å; F344-F347 VanDerWaalsContact O-N 3.12Å; F344-C348 VanDerWaalsContact CD1-SG 3.57Å; F344-C348 HydrophobicContact CE1-CB 4.36Å; F344-C348 WeakPolarHBondContact CE1-SG 3.48Å; F344-C348 WeakPolarHBondContact CZ-SG 3.37Å; F344-C348 WeakPolarHBondContact O-CB 3.32Å; F344-C348 PolarHBondContact O-N 3.22Å; F344-C348 PolarHBondContact O-SG 3.49Å; F344-C348 VanDerWaalsContact O-SG 3.4Å; F344-L359 HydrophobicContact CD2-CD1 4.49Å; F344-L359 HydrophobicContact CD2-CD2 3.92Å; F344-L359 HydrophobicContact CE2-CD1 3.75Å; F344-L359 HydrophobicContact CE2-CD2 3.99Å; F344-L359 HydrophobicContact CE2-CG 4.48Å; F344-W373 HydrophobicContact CB-CH2 3.9Å; F344-W373 HydrophobicContact CB-CZ3 3.94Å; F344-W373 AromaticContact CD2-CZ3 3.89Å; F344-W373 HydrophobicContact CD2-CZ3 3.89Å; F344-W373 HydrophobicContact CG-CH2 4.34Å; F344-W373 AromaticContact CG-CZ3 3.92Å; F344-W373 HydrophobicContact CG-CZ3 3.92Å; F344-I374 HydrophobicContact CD2-CG1 4.46Å; F344-I374 HydrophobicContact CE2-CD1 3.79Å; F344-I374 HydrophobicContact CE2-CG1 3.66Å; F344-I374 HydrophobicContact CE2-CG2 4.43Å; F344-I374 HydrophobicContact CZ-CB 4.41Å; F344-I374 HydrophobicContact CZ-CD1 4.23Å; F344-I374 HydrophobicContact CZ-CG1 3.87Å; F344-I374 HydrophobicContact CZ-CG2 3.8Å; F344-L377 HydrophobicContact CB-CD2 4.12Å; F344-L377 HydrophobicContact CD1-CD2 3.1Å; F344-L377 HydrophobicContact CD1-CG 4.33Å; F344-L377 HydrophobicContact CE1-CD2 3.53Å; F344-L377 HydrophobicContact CE1-CG 4.45Å; F344-L377 HydrophobicContact CG-CD2 3.74Å; F344-L377 HydrophobicContact CZ-CD2 4.49Å
345	E	78.5	Confident	79.7	Confident	66 Å²	66	43.4 Å²	43.4	31%	0.308	22%	0.216	S	C	.	.	H	α-helix	trans	-58.7	-41.9	177.4	-174.8	-174.7	178.7	0	0	111.2	L341 R349	L341-E345 WeakPolarHBondContact O-CB 3.49Å; L341-E345 PolarHBondContact O-N 3.21Å; E345-R349 WeakPolarHBondContact O-CB 3.4Å; E345-R349 VanDerWaalsContact O-CG 3.26Å; E345-R349 WeakPolarHBondContact O-CG 3.43Å; E345-R349 PolarHBondContact O-N 2.9Å; E345-R349 VanDerWaalsContact O-N 3.12Å; E345-R349 IonicContact OE1-CZ 3.1Å; E345-R349 IonicContact OE1-NE 3.87Å; E345-R349 IonicContact OE1-NH1 3.49Å; E345-R349 PolarHBondContact OE1-NH1 3.34Å; E345-R349 IonicContact OE1-NH2 2.57Å; E345-R349 PolarHBondContact OE1-NH2 3.36Å
346	S	80.5	Confident	79.4	Confident	10 Å²	10	43.4 Å²	43.4	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-67.2	-40.7	176.1	-57.8	0	0	0	0	111.4	L342 M343 F344 R349 I350	L342-S346 VanDerWaalsContact O-CB 3.3Å; L342-S346 WeakPolarHBondContact O-CB 3.41Å; L342-S346 PolarHBondContact O-N 3.13Å; L342-S346 PolarHBondContact O-OG 3.34Å; M343-S346 PolarHBondContact O-N 3.1Å; F344-S346 VanDerWaalsContact C-N 3.27Å; F344-S346 PolarHBondContact O-N 3.16Å; S346-R349 PolarHBondContact O-N 3.39Å; S346-I350 WeakPolarHBondContact O-CG1 3.01Å; S346-I350 PolarHBondContact O-N 3.38Å
347	F	79.8	Confident	79	Confident	18 Å²	18	46.5 Å²	46.5	8%	0.079	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-45.2	178.8	-164.7	-93.4	0	0	0	112.1	F308 M343 F344 R349 I350 H351 V354 L359	F308-F347 HydrophobicContact CB-CD2 4.5Å; F308-F347 HydrophobicContact CD1-CB 4.4Å; F308-F347 AromaticContact CD1-CD2 3.9Å; F308-F347 HydrophobicContact CD1-CD2 3.9Å; F308-F347 AromaticContact CD2-CD2 3.71Å; F308-F347 HydrophobicContact CD2-CD2 3.71Å; F308-F347 HydrophobicContact CD2-CE2 4.08Å; F308-F347 HydrophobicContact CE1-CB 3.91Å; F308-F347 AromaticContact CE1-CD2 3.97Å; F308-F347 HydrophobicContact CE1-CD2 3.97Å; F308-F347 HydrophobicContact CE1-CG 4.47Å; F308-F347 AromaticContact CE2-CD2 3.79Å; F308-F347 HydrophobicContact CE2-CD2 3.79Å; F308-F347 HydrophobicContact CE2-CE2 4.4Å; F308-F347 AromaticContact CG-CD2 3.76Å; F308-F347 HydrophobicContact CG-CD2 3.76Å; F308-F347 HydrophobicContact CG-CE2 4.31Å; F308-F347 HydrophobicContact CZ-CB 4.13Å; F308-F347 AromaticContact CZ-CD2 3.92Å; F308-F347 HydrophobicContact CZ-CD2 3.92Å; M343-F347 VanDerWaalsContact O-CB 3.29Å; M343-F347 WeakPolarHBondContact O-CB 3.39Å; M343-F347 PolarHBondContact O-N 3.11Å; F344-F347 PolarHBondContact O-N 2.97Å; F344-F347 VanDerWaalsContact O-N 3.12Å; F347-R349 VanDerWaalsContact C-N 3.32Å; F347-R349 PolarHBondContact O-N 2.82Å; F347-I350 PolarHBondContact O-N 3.27Å; F347-H351 AromaticContact CD1-ND1 3.81Å; F347-H351 AromaticContact CD2-CE1 3.82Å; F347-H351 AromaticContact CD2-ND1 3.8Å; F347-H351 HydrophobicContact CE1-CB 4.23Å; F347-H351 AromaticContact CE1-CG 3.86Å; F347-H351 AromaticContact CE1-ND1 3.62Å; F347-H351 AromaticContact CE2-CE1 3.38Å; F347-H351 WeakPolarHBondContact CE2-CE1 3.18Å; F347-H351 AromaticContact CE2-ND1 3.64Å; F347-H351 AromaticContact CG-ND1 3.89Å; F347-H351 AromaticContact CZ-CE1 3.54Å; F347-H351 AromaticContact CZ-CG 3.94Å; F347-H351 AromaticContact CZ-ND1 3.54Å; F347-H351 AromaticContact CZ-NE2 3.94Å; F347-H351 PolarHBondContact O-N 3.09Å; F347-H351 PolarHBondContact O-ND1 3.25Å; F347-V354 HydrophobicContact CD1-CG1 4.04Å; F347-V354 HydrophobicContact CD1-CG2 3.87Å; F347-V354 HydrophobicContact CE1-CB 4.15Å; F347-V354 HydrophobicContact CE1-CG1 3.45Å; F347-V354 VanDerWaalsContact CE1-CG1 3.45Å; F347-V354 HydrophobicContact CE1-CG2 3.59Å; F347-V354 HydrophobicContact CZ-CG1 4.48Å; F347-L359 HydrophobicContact CD1-CD2 4.08Å; F347-L359 HydrophobicContact CE1-CD2 4.38Å
348	C	74.7	Confident	78.8	Confident	9 Å²	9	44 Å²	44	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-70.4	-23.8	179.1	-73.1	0	0	0	0	114	F344 I350 M396	F344-C348 VanDerWaalsContact CD1-SG 3.57Å; F344-C348 HydrophobicContact CE1-CB 4.36Å; F344-C348 WeakPolarHBondContact CE1-SG 3.48Å; F344-C348 WeakPolarHBondContact CZ-SG 3.37Å; F344-C348 WeakPolarHBondContact O-CB 3.32Å; F344-C348 PolarHBondContact O-N 3.22Å; F344-C348 PolarHBondContact O-SG 3.49Å; F344-C348 VanDerWaalsContact O-SG 3.4Å; C348-I350 VanDerWaalsContact C-N 3.31Å; C348-M396 HydrophobicContact CB-CE 3.89Å; C348-M396 HydrophobicContact CB-CG 4.28Å; C348-M396 HydrophobicContact CB-SD 3.97Å
349	R	75.9	Confident	78.4	Confident	137 Å²	137	42.9 Å²	42.9	52%	0.517	23%	0.225	S	C	.	.	H	α-helix	trans	-71.9	-27.5	172.2	-80.6	174.8	175.4	165.1	3.9	113	E345 S346 F347	E345-R349 WeakPolarHBondContact O-CB 3.4Å; E345-R349 VanDerWaalsContact O-CG 3.26Å; E345-R349 WeakPolarHBondContact O-CG 3.43Å; E345-R349 PolarHBondContact O-N 2.9Å; E345-R349 VanDerWaalsContact O-N 3.12Å; E345-R349 IonicContact OE1-CZ 3.1Å; E345-R349 IonicContact OE1-NE 3.87Å; E345-R349 IonicContact OE1-NH1 3.49Å; E345-R349 PolarHBondContact OE1-NH1 3.34Å; E345-R349 IonicContact OE1-NH2 2.57Å; E345-R349 PolarHBondContact OE1-NH2 3.36Å; S346-R349 PolarHBondContact O-N 3.39Å; F347-R349 VanDerWaalsContact C-N 3.32Å; F347-R349 PolarHBondContact O-N 2.82Å
350	I	81	Confident	78.2	Confident	93 Å²	93	43.3 Å²	43.3	48%	0.477	23%	0.228	S	C	.	.	H	α-helix	trans	-92.2	-39.5	-177.3	-60.1	170.2	0	0	0	110.7	F306 F308 S346 F347 C348	F306-I350 HydrophobicContact CD1-CD1 3.96Å; F308-I350 HydrophobicContact CE2-CD1 3.9Å; F308-I350 HydrophobicContact CZ-CD1 3.8Å; S346-I350 WeakPolarHBondContact O-CG1 3.01Å; S346-I350 PolarHBondContact O-N 3.38Å; F347-I350 PolarHBondContact O-N 3.27Å; C348-I350 VanDerWaalsContact C-N 3.31Å
351	H	79.2	Confident	78	Confident	70 Å²	70	47 Å²	47	32%	0.324	25%	0.248	S	C	.	.			trans	-102.1	129.3	-172.8	-59.9	85.6	0	0	0	112.3	F347 V354	F347-H351 AromaticContact CD1-ND1 3.81Å; F347-H351 AromaticContact CD2-CE1 3.82Å; F347-H351 AromaticContact CD2-ND1 3.8Å; F347-H351 HydrophobicContact CE1-CB 4.23Å; F347-H351 AromaticContact CE1-CG 3.86Å; F347-H351 AromaticContact CE1-ND1 3.62Å; F347-H351 AromaticContact CE2-CE1 3.38Å; F347-H351 WeakPolarHBondContact CE2-CE1 3.18Å; F347-H351 AromaticContact CE2-ND1 3.64Å; F347-H351 AromaticContact CG-ND1 3.89Å; F347-H351 AromaticContact CZ-CE1 3.54Å; F347-H351 AromaticContact CZ-CG 3.94Å; F347-H351 AromaticContact CZ-ND1 3.54Å; F347-H351 AromaticContact CZ-NE2 3.94Å; F347-H351 PolarHBondContact O-N 3.09Å; F347-H351 PolarHBondContact O-ND1 3.25Å; H351-V354 HydrophobicContact CB-CG2 3.69Å
352	H	74.7	Confident	77.6	Confident	99 Å²	99	46.7 Å²	46.7	46%	0.458	25%	0.245	S	C	.	.	S	Bend	trans	-77.4	-35.4	175.2	-177.8	52.5	0	0	0	112.7	V395 M396	H352-V395 CarbonylContact O-C 3.59Å; H352-V395 WeakPolarHBondContact O-CA 3.34Å; H352-M396 PolarHBondContact CE1-O 2.94Å; H352-M396 PolarHBondContact ND1-O 3.19Å; H352-M396 PolarHBondContact O-N 2.93Å
353	S	75.5	Confident	77.1	Confident	73 Å²	73	46.7 Å²	46.7	51%	0.51	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	127.8	178.4	56.3	0	0	0	0	109.7	I394	S353-I394 CarbonylContact C-O 3.55Å; S353-I394 VanDerWaalsContact CA-O 3.32Å; S353-I394 WeakPolarHBondContact CA-O 3.36Å
354	V	77.5	Confident	76.6	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.03	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	124.9	-178.4	-175.4	0	0	0	0	110.2	F347 H351 L359 V393 I394	F347-V354 HydrophobicContact CD1-CG1 4.04Å; F347-V354 HydrophobicContact CD1-CG2 3.87Å; F347-V354 HydrophobicContact CE1-CB 4.15Å; F347-V354 HydrophobicContact CE1-CG1 3.45Å; F347-V354 VanDerWaalsContact CE1-CG1 3.45Å; F347-V354 HydrophobicContact CE1-CG2 3.59Å; F347-V354 HydrophobicContact CZ-CG1 4.48Å; H351-V354 HydrophobicContact CB-CG2 3.69Å; V354-L359 HydrophobicContact CB-CD1 4.13Å; V354-L359 HydrophobicContact CG1-CD1 3.29Å; V354-L359 HydrophobicContact CG1-CD2 3.9Å; V354-L359 HydrophobicContact CG1-CG 3.38Å; V354-V393 CarbonylContact O-C 3.57Å; V354-V393 WeakPolarHBondContact O-CA 3.32Å; V354-I394 PolarHBondContact N-O 3.25Å; V354-I394 PolarHBondContact O-N 3.49Å
355	G	79.1	Confident	76.4	Confident	27 Å²	27	51.9 Å²	51.9	28%	0.278	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	130.6	171.2	0	0	0	0	0	111.2	S357 V358 L359 G392	G355-S357 PolarHBondContact O-N 3.12Å; G355-V358 PolarHBondContact O-N 2.86Å; G355-L359 PolarHBondContact O-N 2.76Å; G355-G392 CarbonylContact C-O 3.53Å; G355-G392 WeakPolarHBondContact CA-O 3.22Å
356	I	77.9	Confident	76.4	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-62.8	-35.6	179.5	-58.8	173.6	0	0	0	110.2	V358 L359 A360 V367 E371 I387 G392 I394	I356-V358 PolarHBondContact O-N 3.31Å; I356-L359 WeakPolarHBondContact O-CB 3.28Å; I356-L359 PolarHBondContact O-N 3.05Å; I356-L359 VanDerWaalsContact O-N 3.16Å; I356-A360 WeakPolarHBondContact O-CB 3.38Å; I356-A360 PolarHBondContact O-N 3.34Å; I356-V367 HydrophobicContact CG2-CG1 3.82Å; I356-E371 HydrophobicContact CD1-CG 4.06Å; I356-E371 VanDerWaalsContact CD1-OE1 3.31Å; I356-E371 WeakPolarHBondContact CD1-OE1 3.48Å; I356-E371 HydrophobicContact CG2-CG 4.03Å; I356-I387 HydrophobicContact CD1-CG2 4.21Å; I356-G392 WeakPolarHBondContact CG1-O 3.32Å; I356-G392 PolarHBondContact N-O 2.98Å; I356-I394 HydrophobicContact CD1-CG1 4.32Å; I356-I394 HydrophobicContact CG1-CD1 3.92Å; I356-I394 HydrophobicContact CG1-CG1 3.88Å
357	S	76.2	Confident	76.3	Confident	71 Å²	71	55.8 Å²	55.8	50%	0.497	30%	0.296	S	S	.	.	H	α-helix	trans	-60.2	-42.1	176.9	-47.1	0	0	0	0	112.7	G355 L359 A360 E361	G355-S357 PolarHBondContact O-N 3.12Å; S357-L359 VanDerWaalsContact C-N 3.31Å; S357-L359 PolarHBondContact O-N 2.98Å; S357-A360 PolarHBondContact O-N 3.24Å; S357-E361 WeakPolarHBondContact O-CG 3.45Å; S357-E361 PolarHBondContact O-N 3.13Å
358	V	78.4	Confident	76.3	Confident	66 Å²	66	59.6 Å²	59.6	40%	0.4	32%	0.318	S	S	.	.	H	α-helix	trans	-68.5	-34.6	178.3	-179.7	0	0	0	0	110.7	G355 I356 K362	G355-V358 PolarHBondContact O-N 2.86Å; I356-V358 PolarHBondContact O-N 3.31Å; V358-K362 HydrophobicContact CG1-CD 4.17Å; V358-K362 WeakPolarHBondContact O-CB 3.16Å; V358-K362 WeakPolarHBondContact O-CG 3.18Å; V358-K362 PolarHBondContact O-N 3.47Å
359	L	75	Confident	76.5	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-71	-40.4	174.8	-73.3	166.9	0	0	0	112.4	F344 F347 V354 G355 I356 S357 E361 K362 L363 I374 I394	F344-L359 HydrophobicContact CD2-CD1 4.49Å; F344-L359 HydrophobicContact CD2-CD2 3.92Å; F344-L359 HydrophobicContact CE2-CD1 3.75Å; F344-L359 HydrophobicContact CE2-CD2 3.99Å; F344-L359 HydrophobicContact CE2-CG 4.48Å; F347-L359 HydrophobicContact CD1-CD2 4.08Å; F347-L359 HydrophobicContact CE1-CD2 4.38Å; V354-L359 HydrophobicContact CB-CD1 4.13Å; V354-L359 HydrophobicContact CG1-CD1 3.29Å; V354-L359 HydrophobicContact CG1-CD2 3.9Å; V354-L359 HydrophobicContact CG1-CG 3.38Å; G355-L359 PolarHBondContact O-N 2.76Å; I356-L359 WeakPolarHBondContact O-CB 3.28Å; I356-L359 PolarHBondContact O-N 3.05Å; I356-L359 VanDerWaalsContact O-N 3.16Å; S357-L359 VanDerWaalsContact C-N 3.31Å; S357-L359 PolarHBondContact O-N 2.98Å; L359-E361 VanDerWaalsContact C-N 3.33Å; L359-K362 CarbonylContact O-C 3.59Å; L359-K362 PolarHBondContact O-N 2.76Å; L359-L363 VanDerWaalsContact O-CB 3.31Å; L359-L363 WeakPolarHBondContact O-CB 3.27Å; L359-L363 WeakPolarHBondContact O-CG 3.12Å; L359-L363 PolarHBondContact O-N 2.94Å; L359-I374 HydrophobicContact CD1-CD1 3.93Å; L359-I394 HydrophobicContact CD1-CD1 3.7Å
360	A	78.3	Confident	76.6	Confident	8 Å²	8	56.3 Å²	56.3	7%	0.066	31%	0.31	C	S	.	.	H	α-helix	trans	-60.5	-45.5	175.6	0	0	0	0	0	110.5	I356 S357 K362 L363 N364 M365 V367 A370	I356-A360 WeakPolarHBondContact O-CB 3.38Å; I356-A360 PolarHBondContact O-N 3.34Å; S357-A360 PolarHBondContact O-N 3.24Å; A360-K362 VanDerWaalsContact C-N 3.34Å; A360-K362 PolarHBondContact O-N 2.98Å; A360-L363 PolarHBondContact O-N 3.45Å; A360-N364 PolarHBondContact O-N 3.43Å; A360-M365 WeakPolarHBondContact CB-O 3.47Å; A360-M365 PolarHBondContact O-N 3.36Å; A360-M365 VanDerWaalsContact O-N 3.13Å; A360-V367 HydrophobicContact CB-CG2 4.13Å; A360-A370 HydrophobicContact CB-CB 4.29Å
361	E	78.5	Confident	76.5	Confident	140 Å²	140	54.4 Å²	54.4	65%	0.654	30%	0.299	S	S	*	.	H	α-helix	trans	-61.2	-40.6	172.6	-75.1	177.9	-173.9	0	0	112.3	Q312 S357 L359 N364	Q312-E361 PolarHBondContact NE2-O 3.39Å; S357-E361 WeakPolarHBondContact O-CG 3.45Å; S357-E361 PolarHBondContact O-N 3.13Å; L359-E361 VanDerWaalsContact C-N 3.33Å; E361-N364 PolarHBondContact O-OD1 2.86Å
362	K	71.5	Confident	76.5	Confident	43 Å²	43	57 Å²	57	19%	0.187	31%	0.309	C	S	.	.	H	α-helix	trans	-71.9	-30.4	179.1	-76.6	179.9	-176.9	-127.7	0	113.7	D309 Q312 V358 L359 A360	D309-K362 WeakPolarHBondContact OD1-CE 3.34Å; D309-K362 IonicContact OD1-NZ 3.69Å; D309-K362 PolarHBondContact OD1-NZ 3.37Å; Q312-K362 WeakPolarHBondContact CG-O 3.38Å; Q312-K362 PolarHBondContact NE2-O 3.47Å; V358-K362 HydrophobicContact CG1-CD 4.17Å; V358-K362 WeakPolarHBondContact O-CB 3.16Å; V358-K362 WeakPolarHBondContact O-CG 3.18Å; V358-K362 PolarHBondContact O-N 3.47Å; L359-K362 CarbonylContact O-C 3.59Å; L359-K362 PolarHBondContact O-N 2.76Å; A360-K362 VanDerWaalsContact C-N 3.34Å; A360-K362 PolarHBondContact O-N 2.98Å
363	L	70.2	Confident	76.7	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.052	30%	0.295	C	S	.	.	H	α-helix	trans	-94.3	-6.1	-179	-67	170.5	0	0	0	113.2	R340 M343 L359 A360 M365 W373	R340-L363 HydrophobicContact CB-CD2 3.97Å; R340-L363 HydrophobicContact CG-CD2 3.9Å; M343-L363 HydrophobicContact CE-CD2 4.36Å; L359-L363 VanDerWaalsContact O-CB 3.31Å; L359-L363 WeakPolarHBondContact O-CB 3.27Å; L359-L363 WeakPolarHBondContact O-CG 3.12Å; L359-L363 PolarHBondContact O-N 2.94Å; A360-L363 PolarHBondContact O-N 3.45Å; L363-M365 HydrophobicContact CB-CB 4.45Å; L363-M365 HydrophobicContact CB-CG 4.13Å; L363-M365 HydrophobicContact CB-SD 4.21Å; L363-M365 PolarHBondContact O-N 3.12Å; L363-W373 HydrophobicContact CD1-CE3 3.98Å; L363-W373 HydrophobicContact CD1-CZ3 3.83Å
364	N	69.6	Low	76.8	Confident	89 Å²	89	50.7 Å²	50.7	48%	0.476	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	39.1	-170.7	-64.8	-5.8	0	0	0	112.2	Q312 R316 A360 E361	Q312-N364 PolarHBondContact NE2-OD1 3.46Å; Q312-N364 VanDerWaalsContact NE2-OD1 3.08Å; R316-N364 PolarHBondContact NE-ND2 2.93Å; R316-N364 PolarHBondContact NH2-OD1 3.37Å; A360-N364 PolarHBondContact O-N 3.43Å; E361-N364 PolarHBondContact O-OD1 2.86Å
365	M	73	Confident	76.8	Confident	50 Å²	50	52.9 Å²	52.9	25%	0.246	28%	0.283	C	S	.	.			trans	-118	154.7	179.7	-65.1	179.4	70.7	0	0	109.7	A360 L363 D369 A370 W373	A360-M365 WeakPolarHBondContact CB-O 3.47Å; A360-M365 PolarHBondContact O-N 3.36Å; A360-M365 VanDerWaalsContact O-N 3.13Å; L363-M365 HydrophobicContact CB-CB 4.45Å; L363-M365 HydrophobicContact CB-CG 4.13Å; L363-M365 HydrophobicContact CB-SD 4.21Å; L363-M365 PolarHBondContact O-N 3.12Å; M365-D369 HydrophobicContact CE-CB 3.96Å; M365-A370 HydrophobicContact CB-CB 4.36Å; M365-W373 HydrophobicContact CE-CB 4.2Å
366	D	78.9	Confident	76.7	Confident	102 Å²	102	55.8 Å²	55.8	55%	0.545	29%	0.292	S	S	.	.			trans	-64.3	153.3	167.8	-166.8	16.3	0	0	0	110	D368 D369 A370	D366-D368 PolarHBondContact O-N 3.37Å; D366-D369 PolarHBondContact O-N 2.88Å; D366-A370 WeakPolarHBondContact O-CB 3.3Å; D366-A370 PolarHBondContact O-N 3.17Å
367	V	77.8	Confident	76.5	Confident	55 Å²	55	56.9 Å²	56.9	33%	0.333	30%	0.298	S	S	.	.	H	α-helix	trans	-57.4	-41.9	-175.9	-179.1	0	0	0	0	110.4	I356 A360 A370 E371	I356-V367 HydrophobicContact CG2-CG1 3.82Å; A360-V367 HydrophobicContact CB-CG2 4.13Å; V367-A370 PolarHBondContact O-N 2.86Å; V367-E371 WeakPolarHBondContact O-CG 3.37Å; V367-E371 PolarHBondContact O-N 3.49Å
368	D	79	Confident	76.4	Confident	99 Å²	99	55.3 Å²	55.3	53%	0.529	28%	0.284	S	S	.	.	H	α-helix	trans	-68.5	-37.5	-179.2	-70.6	-12.1	0	0	0	112.8	D366 E371 K372	D366-D368 PolarHBondContact O-N 3.37Å; D368-E371 PolarHBondContact O-N 2.95Å; D368-K372 WeakPolarHBondContact O-CG 3.36Å; D368-K372 PolarHBondContact O-N 3.02Å
369	D	80.1	Confident	76.1	Confident	77 Å²	77	61 Å²	61	41%	0.412	30%	0.298	S	S	.	.	H	α-helix	trans	-77.6	-32.9	178.5	-73.7	-20.8	0	0	0	111.5	M365 D366 E371 K372 W373	M365-D369 HydrophobicContact CE-CB 3.96Å; D366-D369 PolarHBondContact O-N 2.88Å; D369-E371 VanDerWaalsContact C-N 3.34Å; D369-K372 PolarHBondContact O-N 3.29Å; D369-K372 IonicContact OD1-NZ 2.87Å; D369-K372 PolarHBondContact OD1-NZ 3.48Å; D369-W373 VanDerWaalsContact O-CB 3.28Å; D369-W373 WeakPolarHBondContact O-CB 3.42Å; D369-W373 PolarHBondContact O-N 2.95Å
370	A	77.1	Confident	75.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-43.3	169.3	0	0	0	0	0	110.8	A360 M365 D366 V367 W373 I374	A360-A370 HydrophobicContact CB-CB 4.29Å; M365-A370 HydrophobicContact CB-CB 4.36Å; D366-A370 WeakPolarHBondContact O-CB 3.3Å; D366-A370 PolarHBondContact O-N 3.17Å; V367-A370 PolarHBondContact O-N 2.86Å; A370-W373 PolarHBondContact O-N 3.38Å; A370-I374 WeakPolarHBondContact O-CB 3.47Å; A370-I374 WeakPolarHBondContact O-CD1 3.25Å; A370-I374 WeakPolarHBondContact O-CG1 3.36Å; A370-I374 PolarHBondContact O-N 3.34Å
371	E	79	Confident	75.1	Confident	52 Å²	52	69.3 Å²	69.3	24%	0.243	35%	0.348	C	S	.	.	H	α-helix	trans	-59.8	-49.2	175.4	-76.8	-165.6	170.4	0	0	112.3	I356 V367 D368 D369 W373 I374 V375	I356-E371 HydrophobicContact CD1-CG 4.06Å; I356-E371 VanDerWaalsContact CD1-OE1 3.31Å; I356-E371 WeakPolarHBondContact CD1-OE1 3.48Å; I356-E371 HydrophobicContact CG2-CG 4.03Å; V367-E371 WeakPolarHBondContact O-CG 3.37Å; V367-E371 PolarHBondContact O-N 3.49Å; D368-E371 PolarHBondContact O-N 2.95Å; D369-E371 VanDerWaalsContact C-N 3.34Å; E371-W373 VanDerWaalsContact C-N 3.3Å; E371-W373 PolarHBondContact O-N 3.23Å; E371-I374 PolarHBondContact O-N 3.27Å; E371-V375 VanDerWaalsContact O-CG2 3.3Å; E371-V375 WeakPolarHBondContact O-CG2 3.27Å; E371-V375 PolarHBondContact O-N 3.4Å
372	K	80.1	Confident	74.3	Confident	124 Å²	124	73.2 Å²	73.2	54%	0.539	36%	0.357	S	S	.	.	H	α-helix	trans	-59.1	-43	177.3	-68.4	171.8	-156.1	149.5	0	111.7	D368 D369 V375 N376	D368-K372 WeakPolarHBondContact O-CG 3.36Å; D368-K372 PolarHBondContact O-N 3.02Å; D369-K372 PolarHBondContact O-N 3.29Å; D369-K372 IonicContact OD1-NZ 2.87Å; D369-K372 PolarHBondContact OD1-NZ 3.48Å; K372-V375 PolarHBondContact O-N 2.93Å; K372-N376 PolarHBondContact O-N 3.29Å
373	W	77.7	Confident	73.9	Confident	41 Å²	41	74.1 Å²	74.1	16%	0.155	36%	0.362	C	S	.	.	H	α-helix	trans	-64	-43.3	179.5	-174.4	84.1	0	0	0	111.7	R340 L341 F344 L363 M365 D369 A370 E371 V375 N376 L377	R340-W373 HydrophobicContact CB-CH2 4.04Å; R340-W373 HydrophobicContact CB-CZ2 3.74Å; L341-W373 HydrophobicContact CD2-CH2 3.92Å; L341-W373 HydrophobicContact CD2-CZ2 3.43Å; L341-W373 VanDerWaalsContact CD2-CZ2 3.43Å; L341-W373 HydrophobicContact CG-CH2 4.44Å; L341-W373 HydrophobicContact CG-CZ2 3.83Å; F344-W373 HydrophobicContact CB-CH2 3.9Å; F344-W373 HydrophobicContact CB-CZ3 3.94Å; F344-W373 AromaticContact CD2-CZ3 3.89Å; F344-W373 HydrophobicContact CD2-CZ3 3.89Å; F344-W373 HydrophobicContact CG-CH2 4.34Å; F344-W373 AromaticContact CG-CZ3 3.92Å; F344-W373 HydrophobicContact CG-CZ3 3.92Å; L363-W373 HydrophobicContact CD1-CE3 3.98Å; L363-W373 HydrophobicContact CD1-CZ3 3.83Å; M365-W373 HydrophobicContact CE-CB 4.2Å; D369-W373 VanDerWaalsContact O-CB 3.28Å; D369-W373 WeakPolarHBondContact O-CB 3.42Å; D369-W373 PolarHBondContact O-N 2.95Å; A370-W373 PolarHBondContact O-N 3.38Å; E371-W373 VanDerWaalsContact C-N 3.3Å; E371-W373 PolarHBondContact O-N 3.23Å; W373-V375 PolarHBondContact O-N 2.88Å; W373-N376 PolarHBondContact O-N 3.15Å; W373-L377 HydrophobicContact CH2-CD2 4.04Å; W373-L377 HydrophobicContact CZ3-CD2 4.02Å; W373-L377 PolarHBondContact O-N 3.26Å
374	I	77.3	Confident	73.6	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-65.3	-40	177.2	-67.5	166.9	0	0	0	111.3	F344 L359 A370 E371 N376 L377 I378 I387 I394	F344-I374 HydrophobicContact CD2-CG1 4.46Å; F344-I374 HydrophobicContact CE2-CD1 3.79Å; F344-I374 HydrophobicContact CE2-CG1 3.66Å; F344-I374 HydrophobicContact CE2-CG2 4.43Å; F344-I374 HydrophobicContact CZ-CB 4.41Å; F344-I374 HydrophobicContact CZ-CD1 4.23Å; F344-I374 HydrophobicContact CZ-CG1 3.87Å; F344-I374 HydrophobicContact CZ-CG2 3.8Å; L359-I374 HydrophobicContact CD1-CD1 3.93Å; A370-I374 WeakPolarHBondContact O-CB 3.47Å; A370-I374 WeakPolarHBondContact O-CD1 3.25Å; A370-I374 WeakPolarHBondContact O-CG1 3.36Å; A370-I374 PolarHBondContact O-N 3.34Å; E371-I374 PolarHBondContact O-N 3.27Å; I374-N376 VanDerWaalsContact C-N 3.33Å; I374-N376 PolarHBondContact O-N 2.86Å; I374-L377 WeakPolarHBondContact O-CB 3.37Å; I374-L377 PolarHBondContact O-N 3.44Å; I374-L377 VanDerWaalsContact O-N 3.14Å; I374-I378 HydrophobicContact CG2-CD1 3.82Å; I374-I378 HydrophobicContact CG2-CG1 4.37Å; I374-I378 WeakPolarHBondContact O-CG1 3.27Å; I374-I378 PolarHBondContact O-N 2.95Å; I374-I387 HydrophobicContact CG2-CD1 4.48Å; I374-I394 HydrophobicContact CD1-CD1 3.55Å; I374-I394 HydrophobicContact CG2-CD1 4.02Å
375	V	77.7	Confident	73.6	Confident	50 Å²	50	75.4 Å²	75.4	30%	0.303	37%	0.373	S	S	.	.	H	α-helix	trans	-62	-42.6	175.7	171.3	0	0	0	0	111	E371 K372 W373 L377 I378 R379 I387	E371-V375 VanDerWaalsContact O-CG2 3.3Å; E371-V375 WeakPolarHBondContact O-CG2 3.27Å; E371-V375 PolarHBondContact O-N 3.4Å; K372-V375 PolarHBondContact O-N 2.93Å; W373-V375 PolarHBondContact O-N 2.88Å; V375-L377 VanDerWaalsContact C-N 3.27Å; V375-L377 PolarHBondContact O-N 3.46Å; V375-I378 PolarHBondContact O-N 2.86Å; V375-R379 WeakPolarHBondContact O-CG 3.43Å; V375-R379 PolarHBondContact O-N 3.33Å; V375-R379 VanDerWaalsContact O-N 3.1Å; V375-I387 HydrophobicContact CG2-CD1 3.74Å
376	N	78.3	Confident	73.6	Confident	88 Å²	88	81 Å²	81	47%	0.471	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-37.4	174.4	-73.1	-20.5	0	0	0	111.6	K372 W373 I374 R379 N380	K372-N376 PolarHBondContact O-N 3.29Å; W373-N376 PolarHBondContact O-N 3.15Å; I374-N376 VanDerWaalsContact C-N 3.33Å; I374-N376 PolarHBondContact O-N 2.86Å; N376-R379 PolarHBondContact O-N 3.38Å; N376-N380 VanDerWaalsContact O-CG 3.29Å; N376-N380 PolarHBondContact O-N 3.37Å; N376-N380 VanDerWaalsContact O-N 3.09Å; N376-N380 PolarHBondContact O-ND2 3.02Å
377	L	73.3	Confident	73.3	Confident	24 Å²	24	79 Å²	79	13%	0.126	38%	0.384	C	S	.	.	H	α-helix	trans	-67.9	-43.8	176.9	-176.7	52.9	0	0	0	113.1	L341 F344 W373 I374 V375 R379 N380 A381	L341-L377 HydrophobicContact CD2-CB 4.45Å; L341-L377 HydrophobicContact CD2-CD1 3.35Å; L341-L377 HydrophobicContact CD2-CD2 3.98Å; L341-L377 HydrophobicContact CD2-CG 4.13Å; F344-L377 HydrophobicContact CB-CD2 4.12Å; F344-L377 HydrophobicContact CD1-CD2 3.1Å; F344-L377 HydrophobicContact CD1-CG 4.33Å; F344-L377 HydrophobicContact CE1-CD2 3.53Å; F344-L377 HydrophobicContact CE1-CG 4.45Å; F344-L377 HydrophobicContact CG-CD2 3.74Å; F344-L377 HydrophobicContact CZ-CD2 4.49Å; W373-L377 HydrophobicContact CH2-CD2 4.04Å; W373-L377 HydrophobicContact CZ3-CD2 4.02Å; W373-L377 PolarHBondContact O-N 3.26Å; I374-L377 WeakPolarHBondContact O-CB 3.37Å; I374-L377 PolarHBondContact O-N 3.44Å; I374-L377 VanDerWaalsContact O-N 3.14Å; V375-L377 VanDerWaalsContact C-N 3.27Å; V375-L377 PolarHBondContact O-N 3.46Å; L377-R379 VanDerWaalsContact C-N 3.27Å; L377-R379 PolarHBondContact O-N 2.73Å; L377-N380 PolarHBondContact O-N 2.91Å; L377-A381 HydrophobicContact CD1-CB 4.05Å; L377-A381 VanDerWaalsContact O-CB 3.23Å; L377-A381 WeakPolarHBondContact O-CB 3.35Å; L377-A381 PolarHBondContact O-N 3.36Å
378	I	73.5	Confident	73.3	Confident	38 Å²	38	79 Å²	79	20%	0.195	38%	0.382	C	S	.	.	H	α-helix	trans	-61.5	-40.1	177.3	-69.4	163.8	0	0	0	110.4	I374 V375 N380 R382 A385 I387	I374-I378 HydrophobicContact CG2-CD1 3.82Å; I374-I378 HydrophobicContact CG2-CG1 4.37Å; I374-I378 WeakPolarHBondContact O-CG1 3.27Å; I374-I378 PolarHBondContact O-N 2.95Å; V375-I378 PolarHBondContact O-N 2.86Å; I378-N380 PolarHBondContact O-N 2.84Å; I378-R382 PolarHBondContact O-N 3.39Å; I378-A385 HydrophobicContact CD1-CB 3.78Å; I378-A385 HydrophobicContact CG1-CB 4.09Å; I378-I387 HydrophobicContact CD1-CD1 4.03Å; I378-I387 HydrophobicContact CD1-CG1 4.25Å
379	R	72.1	Confident	72.9	Confident	187 Å²	187	78 Å²	78	71%	0.706	38%	0.383	S	S	*	.	H	α-helix	trans	-61.6	-41.9	175.4	-73.3	176.6	-179.5	-172.8	1.4	112.2	V375 N376 L377	V375-R379 WeakPolarHBondContact O-CG 3.43Å; V375-R379 PolarHBondContact O-N 3.33Å; V375-R379 VanDerWaalsContact O-N 3.1Å; N376-R379 PolarHBondContact O-N 3.38Å; L377-R379 VanDerWaalsContact C-N 3.27Å; L377-R379 PolarHBondContact O-N 2.73Å
380	N	70.4	Confident	72.6	Confident	137 Å²	137	83.5 Å²	83.5	73%	0.733	41%	0.406	S	S	*	.	H	α-helix	trans	-81.2	-39	-177.2	-69.2	-13.3	0	0	0	113.2	N376 L377 I378	N376-N380 VanDerWaalsContact O-CG 3.29Å; N376-N380 PolarHBondContact O-N 3.37Å; N376-N380 VanDerWaalsContact O-N 3.09Å; N376-N380 PolarHBondContact O-ND2 3.02Å; L377-N380 PolarHBondContact O-N 2.91Å; I378-N380 PolarHBondContact O-N 2.84Å
381	A	62.7	Low	72.4	Confident	49 Å²	49	91.2 Å²	91.2	41%	0.405	44%	0.44	S	S	.	.	H	α-helix	trans	-90.9	-2.5	-171.2	0	0	0	0	0	114.7	L377 M383	L377-A381 HydrophobicContact CD1-CB 4.05Å; L377-A381 VanDerWaalsContact O-CB 3.23Å; L377-A381 WeakPolarHBondContact O-CB 3.35Å; L377-A381 PolarHBondContact O-N 3.36Å; A381-M383 HydrophobicContact CB-CG 3.88Å; A381-M383 PolarHBondContact O-N 3.32Å; A381-M383 VanDerWaalsContact O-N 3.16Å
382	R	61	Low	72.1	Confident	223 Å²	223	89.8 Å²	89.8	84%	0.842	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	40.3	-176.8	-59.5	-176	179	-171	-1.5	112.5	I378	I378-R382 PolarHBondContact O-N 3.39Å
383	M	63.2	Low	72.1	Confident	61 Å²	61	85.8 Å²	85.8	30%	0.3	43%	0.425	S	S	.	.			trans	-90.2	131.6	177.5	-68.6	-63.3	-64	0	0	109.3	A381 A385 M396	A381-M383 HydrophobicContact CB-CG 3.88Å; A381-M383 PolarHBondContact O-N 3.32Å; A381-M383 VanDerWaalsContact O-N 3.16Å; M383-A385 PolarHBondContact O-N 2.85Å; M383-M396 HydrophobicContact CB-CE 4.28Å; M383-M396 HydrophobicContact CE-CE 3.71Å
384	D	64.2	Low	72	Confident	106 Å²	106	83.9 Å²	83.9	57%	0.567	42%	0.418	S	S	*	.			trans	-76.4	88.7	174.4	-63.7	-49.1	0	0	0	108.9	G397	D384-G397 WeakPolarHBondContact O-CA 3.44Å; D384-G397 PolarHBondContact O-N 2.77Å
385	A	70.5	Confident	71.9	Confident	21 Å²	21	86.4 Å²	86.4	17%	0.174	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.1	175.4	0	0	0	0	0	110.3	I378 M383 I394 M396	I378-A385 HydrophobicContact CD1-CB 3.78Å; I378-A385 HydrophobicContact CG1-CB 4.09Å; M383-A385 PolarHBondContact O-N 2.85Å; A385-I394 HydrophobicContact CB-CG2 4.21Å; A385-M396 HydrophobicContact CB-CE 3.96Å; A385-M396 HydrophobicContact CB-SD 3.52Å; A385-M396 VanDerWaalsContact CB-SD 3.52Å
386	K	72.6	Confident	71.6	Confident	166 Å²	166	84.6 Å²	84.6	72%	0.722	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	122	173.3	-68.7	-175.9	178.3	179.9	0	108.8	V395	K386-V395 PolarHBondContact N-O 2.65Å; K386-V395 PolarHBondContact O-N 2.91Å
387	I	72.9	Confident	71.1	Confident	62 Å²	62	82.4 Å²	82.4	32%	0.318	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	114.6	176.9	-53.5	176.8	0	0	0	107.9	I356 I374 V375 I378 S389 I394	I356-I387 HydrophobicContact CD1-CG2 4.21Å; I374-I387 HydrophobicContact CG2-CD1 4.48Å; V375-I387 HydrophobicContact CG2-CD1 3.74Å; I378-I387 HydrophobicContact CD1-CD1 4.03Å; I378-I387 HydrophobicContact CD1-CG1 4.25Å; I387-S389 PolarHBondContact O-N 3.35Å; I387-I394 HydrophobicContact CG1-CG1 4.37Å; I387-I394 HydrophobicContact CG2-CG1 4.43Å
388	D	76.8	Confident	70.5	Confident	55 Å²	55	85.3 Å²	85.3	29%	0.294	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	87.2	168.6	-170.7	-10.9	0	0	0	108.4	Q390 K391 G392 V393	D388-Q390 PolarHBondContact O-N 2.83Å; D388-Q390 PolarHBondContact OD1-N 3.25Å; D388-K391 PolarHBondContact O-N 3.37Å; D388-K391 PolarHBondContact OD1-N 2.86Å; D388-K391 WeakPolarHBondContact OD2-CD 3.47Å; D388-G392 PolarHBondContact O-N 3.42Å; D388-V393 WeakPolarHBondContact CA-O 3.47Å; D388-V393 WeakPolarHBondContact CB-O 3.27Å; D388-V393 PolarHBondContact N-O 3.1Å; D388-V393 PolarHBondContact O-N 3.44Å; D388-V393 VanDerWaalsContact O-N 3.12Å
389	S	71	Confident	69.9	Low	78 Å²	78	90.2 Å²	90.2	55%	0.545	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.5	-178.7	-173.3	0	0	0	0	112.1	I387 G392	I387-S389 PolarHBondContact O-N 3.35Å; S389-G392 PolarHBondContact O-N 3.25Å
390	Q	74.5	Confident	69.5	Low	192 Å²	192	87.7 Å²	87.7	90%	0.897	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-33.1	178.1	-66.1	-173.8	-8	0	0	112.9	D388	D388-Q390 PolarHBondContact O-N 2.83Å; D388-Q390 PolarHBondContact OD1-N 3.25Å
391	K	71.5	Confident	69.5	Low	161 Å²	161	84.4 Å²	84.4	70%	0.7	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-9.4	177.4	-65.5	-174.2	-174.8	171	0	113	D388 V393	D388-K391 PolarHBondContact O-N 3.37Å; D388-K391 PolarHBondContact OD1-N 2.86Å; D388-K391 WeakPolarHBondContact OD2-CD 3.47Å; K391-V393 HydrophobicContact CB-CB 4.39Å; K391-V393 HydrophobicContact CB-CG2 4.12Å; K391-V393 PolarHBondContact O-N 3.49Å
392	G	74.1	Confident	70.2	Confident	22 Å²	22	84.4 Å²	84.4	23%	0.227	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	62	34.5	-170.2	0	0	0	0	0	112	G355 I356 D388 S389	G355-G392 CarbonylContact C-O 3.53Å; G355-G392 WeakPolarHBondContact CA-O 3.22Å; I356-G392 WeakPolarHBondContact CG1-O 3.32Å; I356-G392 PolarHBondContact N-O 2.98Å; D388-G392 PolarHBondContact O-N 3.42Å; S389-G392 PolarHBondContact O-N 3.25Å
393	V	78.9	Confident	71.3	Confident	41 Å²	41	78.1 Å²	78.1	25%	0.248	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.9	-177.4	-178	0	0	0	0	110.8	V354 D388 K391 V395	V354-V393 CarbonylContact O-C 3.57Å; V354-V393 WeakPolarHBondContact O-CA 3.32Å; D388-V393 WeakPolarHBondContact CA-O 3.47Å; D388-V393 WeakPolarHBondContact CB-O 3.27Å; D388-V393 PolarHBondContact N-O 3.1Å; D388-V393 PolarHBondContact O-N 3.44Å; D388-V393 VanDerWaalsContact O-N 3.12Å; K391-V393 HydrophobicContact CB-CB 4.39Å; K391-V393 HydrophobicContact CB-CG2 4.12Å; K391-V393 PolarHBondContact O-N 3.49Å; V393-V395 HydrophobicContact CG1-CG2 4.21Å
394	I	75.7	Confident	72.5	Confident	1 Å²	1	84 Å²	84	1%	0.005	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	118.1	171.1	-59.8	160.9	0	0	0	107.7	S353 V354 I356 L359 I374 A385 I387 M396	S353-I394 CarbonylContact C-O 3.55Å; S353-I394 VanDerWaalsContact CA-O 3.32Å; S353-I394 WeakPolarHBondContact CA-O 3.36Å; V354-I394 PolarHBondContact N-O 3.25Å; V354-I394 PolarHBondContact O-N 3.49Å; I356-I394 HydrophobicContact CD1-CG1 4.32Å; I356-I394 HydrophobicContact CG1-CD1 3.92Å; I356-I394 HydrophobicContact CG1-CG1 3.88Å; L359-I394 HydrophobicContact CD1-CD1 3.7Å; I374-I394 HydrophobicContact CD1-CD1 3.55Å; I374-I394 HydrophobicContact CG2-CD1 4.02Å; A385-I394 HydrophobicContact CB-CG2 4.21Å; I387-I394 HydrophobicContact CG1-CG1 4.37Å; I387-I394 HydrophobicContact CG2-CG1 4.43Å; I394-M396 HydrophobicContact CG2-SD 4.15Å
395	V	75.9	Confident	73.4	Confident	52 Å²	52	84 Å²	84	32%	0.315	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112.5	175.4	-177.1	0	0	0	0	108.9	H352 K386 V393	H352-V395 CarbonylContact O-C 3.59Å; H352-V395 WeakPolarHBondContact O-CA 3.34Å; K386-V395 PolarHBondContact N-O 2.65Å; K386-V395 PolarHBondContact O-N 2.91Å; V393-V395 HydrophobicContact CG1-CG2 4.21Å
396	M	71.4	Confident	74	Confident	13 Å²	13	88 Å²	88	6%	0.064	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	126.3	174.8	-60.6	-58.9	-59.6	0	0	109.5	C348 H352 M383 A385 I394 T398	C348-M396 HydrophobicContact CB-CE 3.89Å; C348-M396 HydrophobicContact CB-CG 4.28Å; C348-M396 HydrophobicContact CB-SD 3.97Å; H352-M396 PolarHBondContact CE1-O 2.94Å; H352-M396 PolarHBondContact ND1-O 3.19Å; H352-M396 PolarHBondContact O-N 2.93Å; M383-M396 HydrophobicContact CB-CE 4.28Å; M383-M396 HydrophobicContact CE-CE 3.71Å; A385-M396 HydrophobicContact CB-CE 3.96Å; A385-M396 HydrophobicContact CB-SD 3.52Å; A385-M396 VanDerWaalsContact CB-SD 3.52Å; I394-M396 HydrophobicContact CG2-SD 4.15Å; M396-T398 PolarHBondContact O-N 3.42Å
397	G	66.4	Low	74.7	Confident	41 Å²	41	84.3 Å²	84.3	42%	0.423	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-61	120.9	170.2	0	0	0	0	0	109.8	D384 Q399	D384-G397 WeakPolarHBondContact O-CA 3.44Å; D384-G397 PolarHBondContact O-N 2.77Å; G397-Q399 PolarHBondContact O-N 3.26Å
398	T	61.9	Low	75.5	Confident	85 Å²	85	85.6 Å²	85.6	52%	0.521	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-67.6	116.6	173.1	43.9	0	0	0	0	108.8	M396 N400	M396-T398 PolarHBondContact O-N 3.42Å; T398-N400 PolarHBondContact O-N 2.95Å
399	Q	60.9	Low	75.9	Confident	141 Å²	141	88.5 Å²	88.5	66%	0.659	47%	0.472	S	S	*	.			trans	-74.3	63.8	162.8	-69.3	-176	-4	0	0	108.9	G397 V401	G397-Q399 PolarHBondContact O-N 3.26Å; Q399-V401 VanDerWaalsContact C-N 3.3Å; Q399-V401 PolarHBondContact O-N 3.37Å
400	N	63.3	Low	76.6	Confident	134 Å²	134	94.2 Å²	94.2	72%	0.717	48%	0.482	S	S	*	.			trans	-72.3	93.5	168.4	-77.2	-1.9	0	0	0	107	T398 S402	T398-N400 PolarHBondContact O-N 2.95Å; N400-S402 PolarHBondContact O-N 3.38Å
401	V	70.5	Confident	77.3	Confident	69 Å²	69	89.2 Å²	89.2	42%	0.418	46%	0.464	S	S	.	.			trans	-63.9	108.9	170.7	-173.3	0	0	0	0	106.8	Q399 Q405 Q406	Q399-V401 VanDerWaalsContact C-N 3.3Å; Q399-V401 PolarHBondContact O-N 3.37Å; V401-Q405 HydrophobicContact CG1-CB 4.02Å; V401-Q405 HydrophobicContact CG1-CG 4.24Å; V401-Q406 HydrophobicContact CG1-CG 3.78Å
402	S	77.4	Confident	78	Confident	48 Å²	48	88.4 Å²	88.4	34%	0.336	46%	0.461	S	S	.	.			trans	-55.4	139	177.5	179.6	0	0	0	0	109.7	N400 Y404 Q405 Q406	N400-S402 PolarHBondContact O-N 3.38Å; S402-Y404 PolarHBondContact O-N 2.89Å; S402-Y404 VanDerWaalsContact O-N 3.07Å; S402-Y404 WeakPolarHBondContact OG-CD2 3.24Å; S402-Q405 WeakPolarHBondContact O-CA 3.26Å; S402-Q405 WeakPolarHBondContact O-CB 3.35Å; S402-Q405 PolarHBondContact O-N 3.44Å; S402-Q406 PolarHBondContact O-N 3.02Å
403	P	84.5	Confident	78.5	Confident	92 Å²	92	91 Å²	91	60%	0.597	48%	0.475	S	S	*	.	H	α-helix	trans	-51.3	-34.5	175.4	-27.3	34.2	0	0	0	112.5	Q405 Q406 V407	P403-Q405 VanDerWaalsContact C-N 3.3Å; P403-Q405 PolarHBondContact O-N 3.43Å; P403-Q406 PolarHBondContact O-N 3.28Å; P403-V407 WeakPolarHBondContact O-CG2 3.49Å; P403-V407 PolarHBondContact O-N 3.41Å
404	Y	87.1	Confident	78.8	Confident	183 Å²	183	92.7 Å²	92.7	72%	0.718	49%	0.489	S	S	*	.	H	α-helix	trans	-59.8	-38.8	174.5	-63	-67.6	0	0	0	112.8	S402 V407 I408	S402-Y404 PolarHBondContact O-N 2.89Å; S402-Y404 VanDerWaalsContact O-N 3.07Å; S402-Y404 WeakPolarHBondContact OG-CD2 3.24Å; Y404-V407 PolarHBondContact O-N 3.23Å; Y404-I408 WeakPolarHBondContact O-CB 3.25Å; Y404-I408 WeakPolarHBondContact O-CD1 3.23Å; Y404-I408 WeakPolarHBondContact O-CG1 3.31Å; Y404-I408 PolarHBondContact O-N 3.29Å
405	Q	84.4	Confident	79.5	Confident	106 Å²	106	94.4 Å²	94.4	50%	0.495	51%	0.507	S	S	.	.	H	α-helix	trans	-70.6	-38.1	178.9	-169.3	160	-14.3	0	0	111.5	V401 S402 P403 V407 I408 E409	V401-Q405 HydrophobicContact CG1-CB 4.02Å; V401-Q405 HydrophobicContact CG1-CG 4.24Å; S402-Q405 WeakPolarHBondContact O-CA 3.26Å; S402-Q405 WeakPolarHBondContact O-CB 3.35Å; S402-Q405 PolarHBondContact O-N 3.44Å; P403-Q405 VanDerWaalsContact C-N 3.3Å; P403-Q405 PolarHBondContact O-N 3.43Å; Q405-V407 VanDerWaalsContact C-N 3.33Å; Q405-V407 PolarHBondContact O-N 3.23Å; Q405-I408 PolarHBondContact O-N 2.81Å; Q405-E409 WeakPolarHBondContact O-CG 3.4Å; Q405-E409 PolarHBondContact O-N 3.41Å
406	Q	83	Confident	80.2	Confident	107 Å²	107	96 Å²	96	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-62.7	-40.4	171.9	-64.9	-176	-1	0	0	112	V401 S402 P403 E409 R410	V401-Q406 HydrophobicContact CG1-CG 3.78Å; S402-Q406 PolarHBondContact O-N 3.02Å; P403-Q406 PolarHBondContact O-N 3.28Å; Q406-E409 PolarHBondContact O-N 2.96Å; Q406-R410 WeakPolarHBondContact O-CG 3.45Å; Q406-R410 PolarHBondContact O-N 2.86Å; Q406-R410 VanDerWaalsContact O-N 3.07Å
407	V	87.7	Confident	80.9	Confident	87 Å²	87	99.3 Å²	99.3	53%	0.527	54%	0.541	S	S	.	.	H	α-helix	trans	-63.3	-47.2	174.3	174.1	0	0	0	0	110	P403 Y404 Q405 E409 R410 T411	P403-V407 WeakPolarHBondContact O-CG2 3.49Å; P403-V407 PolarHBondContact O-N 3.41Å; Y404-V407 PolarHBondContact O-N 3.23Å; Q405-V407 VanDerWaalsContact C-N 3.33Å; Q405-V407 PolarHBondContact O-N 3.23Å; V407-E409 VanDerWaalsContact C-N 3.34Å; V407-E409 PolarHBondContact O-N 2.89Å; V407-R410 PolarHBondContact O-N 2.84Å; V407-T411 WeakPolarHBondContact O-CB 3.37Å; V407-T411 PolarHBondContact O-N 3.4Å; V407-T411 PolarHBondContact O-OG1 2.93Å
408	I	88.5	Confident	82	Confident	89 Å²	89	100 Å²	100	46%	0.456	54%	0.542	S	S	.	.	H	α-helix	trans	-59.6	-42.6	177.9	-69.6	161.9	0	0	0	111.5	Y404 Q405 T411 K412	Y404-I408 WeakPolarHBondContact O-CB 3.25Å; Y404-I408 WeakPolarHBondContact O-CD1 3.23Å; Y404-I408 WeakPolarHBondContact O-CG1 3.31Å; Y404-I408 PolarHBondContact O-N 3.29Å; Q405-I408 PolarHBondContact O-N 2.81Å; I408-T411 PolarHBondContact O-N 3.06Å; I408-K412 HydrophobicContact CG2-CD 4.1Å; I408-K412 HydrophobicContact CG2-CG 4.27Å; I408-K412 WeakPolarHBondContact O-CB 3.33Å; I408-K412 VanDerWaalsContact O-CG 3.32Å; I408-K412 WeakPolarHBondContact O-CG 3.48Å; I408-K412 PolarHBondContact O-N 3.33Å
409	E	85.5	Confident	83.3	Confident	117 Å²	117	101.2 Å²	101.2	55%	0.547	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-45.5	177.9	-77.4	179.6	-179.1	0	0	112	Q405 Q406 V407 K412 S413	Q405-E409 WeakPolarHBondContact O-CG 3.4Å; Q405-E409 PolarHBondContact O-N 3.41Å; Q406-E409 PolarHBondContact O-N 2.96Å; V407-E409 VanDerWaalsContact C-N 3.34Å; V407-E409 PolarHBondContact O-N 2.89Å; E409-K412 PolarHBondContact O-N 3.4Å; E409-S413 PolarHBondContact O-N 3.48Å
410	R	85.3	Confident	84.7	Confident	198 Å²	198	101.3 Å²	101.3	75%	0.747	54%	0.54	S	S	*	.	H	α-helix	trans	-64.8	-39	174.4	-72.5	-170.4	178.2	-166.7	1.5	112.2	Q406 V407 S413 S414	Q406-R410 WeakPolarHBondContact O-CG 3.45Å; Q406-R410 PolarHBondContact O-N 2.86Å; Q406-R410 VanDerWaalsContact O-N 3.07Å; V407-R410 PolarHBondContact O-N 2.84Å; R410-S413 PolarHBondContact O-OG 3.28Å; R410-S414 VanDerWaalsContact O-CB 3.3Å; R410-S414 WeakPolarHBondContact O-CB 3.32Å; R410-S414 PolarHBondContact O-N 3.06Å
411	T	89.1	Confident	86	Confident	86 Å²	86	99.8 Å²	99.8	53%	0.528	53%	0.531	S	S	.	.	H	α-helix	trans	-72.1	-32	178.6	-58.7	0	0	0	0	111.9	V407 I408 G415	V407-T411 WeakPolarHBondContact O-CB 3.37Å; V407-T411 PolarHBondContact O-N 3.4Å; V407-T411 PolarHBondContact O-OG1 2.93Å; I408-T411 PolarHBondContact O-N 3.06Å; T411-G415 WeakPolarHBondContact O-CA 3.31Å; T411-G415 PolarHBondContact O-N 3.1Å
412	K	87.3	Confident	86.9	Confident	144 Å²	144	101.6 Å²	101.6	63%	0.626	54%	0.538	S	S	*	.	H	α-helix	trans	-65.6	-44.9	174.7	-82.5	179.5	178.5	-179.6	0	112	I408 E409 T416	I408-K412 HydrophobicContact CG2-CD 4.1Å; I408-K412 HydrophobicContact CG2-CG 4.27Å; I408-K412 WeakPolarHBondContact O-CB 3.33Å; I408-K412 VanDerWaalsContact O-CG 3.32Å; I408-K412 WeakPolarHBondContact O-CG 3.48Å; I408-K412 PolarHBondContact O-N 3.33Å; E409-K412 PolarHBondContact O-N 3.4Å; K412-T416 WeakPolarHBondContact O-CB 3.32Å; K412-T416 WeakPolarHBondContact O-CG2 3.5Å; K412-T416 PolarHBondContact O-N 3.16Å; K412-T416 PolarHBondContact O-OG1 3.39Å
413	S	84.7	Confident	87.5	Confident	76 Å²	76	104.2 Å²	104.2	53%	0.531	55%	0.545	S	S	.	.	H	α-helix	trans	-68.3	-42.2	177.4	63.3	0	0	0	0	111.6	E409 R410 T416 C417	E409-S413 PolarHBondContact O-N 3.48Å; R410-S413 PolarHBondContact O-OG 3.28Å; S413-T416 PolarHBondContact O-OG1 2.91Å; S413-C417 WeakPolarHBondContact O-CB 3.11Å; S413-C417 PolarHBondContact O-N 3.22Å
414	S	85.5	Confident	87.7	Confident	78 Å²	78	108.6 Å²	108.6	55%	0.545	55%	0.549	S	S	.	.	H	α-helix	trans	-65.2	-42.7	174.9	-175.7	0	0	0	0	112.1	R410 C417 A418	R410-S414 VanDerWaalsContact O-CB 3.3Å; R410-S414 WeakPolarHBondContact O-CB 3.32Å; R410-S414 PolarHBondContact O-N 3.06Å; S414-C417 WeakPolarHBondContact O-CB 3.31Å; S414-C417 PolarHBondContact O-N 2.96Å; S414-A418 WeakPolarHBondContact O-CB 3.44Å; S414-A418 PolarHBondContact O-N 3.39Å
415	G	89.8	Confident	87.7	Confident	36 Å²	36	104.1 Å²	104.1	37%	0.371	54%	0.537	S	S	.	.	H	α-helix	trans	-67.3	-41	-179.9	0	0	0	0	0	113	T411 A418 H419	T411-G415 WeakPolarHBondContact O-CA 3.31Å; T411-G415 PolarHBondContact O-N 3.1Å; G415-A418 PolarHBondContact O-N 2.89Å; G415-H419 WeakPolarHBondContact O-CB 3.25Å; G415-H419 PolarHBondContact O-N 2.94Å
416	T	89.1	Confident	87.8	Confident	85 Å²	85	108.4 Å²	108.4	52%	0.521	55%	0.549	S	S	.	.	H	α-helix	trans	-66.2	-38	172.4	46.4	0	0	0	0	112.1	K412 S413 H419 K420	K412-T416 WeakPolarHBondContact O-CB 3.32Å; K412-T416 WeakPolarHBondContact O-CG2 3.5Å; K412-T416 PolarHBondContact O-N 3.16Å; K412-T416 PolarHBondContact O-OG1 3.39Å; S413-T416 PolarHBondContact O-OG1 2.91Å; T416-H419 PolarHBondContact O-N 3.4Å; T416-K420 WeakPolarHBondContact O-CG 3.44Å; T416-K420 PolarHBondContact O-N 2.8Å
417	C	86.7	Confident	87.7	Confident	84 Å²	84	112.2 Å²	112.2	57%	0.568	56%	0.559	S	S	*	*	H	α-helix	trans	-63.6	-46.1	173.3	-169.4	0	0	0	0	111.8	S413 S414 H419 K420 L421	S413-C417 WeakPolarHBondContact O-CB 3.11Å; S413-C417 PolarHBondContact O-N 3.22Å; S414-C417 WeakPolarHBondContact O-CB 3.31Å; S414-C417 PolarHBondContact O-N 2.96Å; C417-H419 VanDerWaalsContact C-N 3.34Å; C417-H419 PolarHBondContact O-N 3.31Å; C417-K420 PolarHBondContact O-N 3.44Å; C417-L421 WeakPolarHBondContact O-CB 3.44Å; C417-L421 PolarHBondContact O-N 3.32Å
418	A	89.8	Confident	87.5	Confident	55 Å²	55	113.5 Å²	113.5	46%	0.455	56%	0.559	S	S	.	*	H	α-helix	trans	-62.1	-40.3	176.9	0	0	0	0	0	112	S414 G415 L421 L422	S414-A418 WeakPolarHBondContact O-CB 3.44Å; S414-A418 PolarHBondContact O-N 3.39Å; G415-A418 PolarHBondContact O-N 2.89Å; A418-L421 PolarHBondContact O-N 2.84Å; A418-L422 WeakPolarHBondContact O-CB 3.17Å; A418-L422 PolarHBondContact O-N 3.45Å
419	H	90	Very high	87.1	Confident	111 Å²	111	116.6 Å²	116.6	51%	0.514	57%	0.569	S	S	.	*	H	α-helix	trans	-64.4	-46.1	175.7	-167.9	71	0	0	0	112	G415 T416 C417 L421 L422 E423	G415-H419 WeakPolarHBondContact O-CB 3.25Å; G415-H419 PolarHBondContact O-N 2.94Å; T416-H419 PolarHBondContact O-N 3.4Å; C417-H419 VanDerWaalsContact C-N 3.34Å; C417-H419 PolarHBondContact O-N 3.31Å; H419-L421 VanDerWaalsContact C-N 3.3Å; H419-L421 PolarHBondContact O-N 2.9Å; H419-L422 PolarHBondContact O-N 3.31Å; H419-L422 VanDerWaalsContact O-N 3.15Å; H419-E423 IonicContact NE2-OE1 3.73Å; H419-E423 PolarHBondContact O-N 2.66Å
420	K	89.9	Confident	86.7	Confident	143 Å²	143	113.4 Å²	113.4	62%	0.622	56%	0.56	S	S	*	*	H	α-helix	trans	-60.2	-39.1	174.5	-75.6	-179.9	178.5	-177	0	112.5	T416 C417 E423 R424	T416-K420 WeakPolarHBondContact O-CG 3.44Å; T416-K420 PolarHBondContact O-N 2.8Å; C417-K420 PolarHBondContact O-N 3.44Å; K420-E423 PolarHBondContact O-N 3.15Å; K420-R424 PolarHBondContact O-N 2.9Å
421	L	91	Very high	86	Confident	101 Å²	101	108.1 Å²	108.1	53%	0.529	55%	0.546	S	S	.	.	H	α-helix	trans	-65.7	-41.8	175.6	-175.9	66.4	0	0	0	111.1	C417 A418 H419 R424 L425	C417-L421 WeakPolarHBondContact O-CB 3.44Å; C417-L421 PolarHBondContact O-N 3.32Å; A418-L421 PolarHBondContact O-N 2.84Å; H419-L421 VanDerWaalsContact C-N 3.3Å; H419-L421 PolarHBondContact O-N 2.9Å; L421-R424 PolarHBondContact O-N 3.38Å; L421-L425 HydrophobicContact CG-CD1 4.18Å; L421-L425 WeakPolarHBondContact O-CG 3.32Å; L421-L425 PolarHBondContact O-N 3.34Å
422	L	89.5	Confident	85.1	Confident	108 Å²	108	108 Å²	108	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-64.3	-41.6	176.9	-164.4	154.4	0	0	0	111.4	A418 H419 L425 R426	A418-L422 WeakPolarHBondContact O-CB 3.17Å; A418-L422 PolarHBondContact O-N 3.45Å; H419-L422 PolarHBondContact O-N 3.31Å; H419-L422 VanDerWaalsContact O-N 3.15Å; L422-L425 PolarHBondContact O-N 3Å; L422-R426 WeakPolarHBondContact O-CB 3.49Å; L422-R426 PolarHBondContact O-N 2.83Å
423	E	89.3	Confident	84.2	Confident	102 Å²	102	105.5 Å²	105.5	48%	0.477	54%	0.539	S	S	.	.	H	α-helix	trans	-61	-43	172.8	-73.6	-170.5	146.5	0	0	112.2	H419 K420 R426 W427	H419-E423 IonicContact NE2-OE1 3.73Å; H419-E423 PolarHBondContact O-N 2.66Å; K420-E423 PolarHBondContact O-N 3.15Å; E423-R426 PolarHBondContact O-N 2.9Å; E423-W427 PolarHBondContact O-N 3.27Å
424	R	88.3	Confident	83.1	Confident	184 Å²	184	107.8 Å²	107.8	69%	0.694	54%	0.541	S	S	*	.	H	α-helix	trans	-60.8	-48.2	174.3	-80.3	-174.3	180	-178.6	-0.9	112.3	K420 L421 R426 W427 E428	K420-R424 PolarHBondContact O-N 2.9Å; L421-R424 PolarHBondContact O-N 3.38Å; R424-R426 VanDerWaalsContact C-N 3.26Å; R424-R426 PolarHBondContact O-N 2.77Å; R424-W427 WeakPolarHBondContact O-CB 3.4Å; R424-W427 PolarHBondContact O-N 2.94Å; R424-E428 PolarHBondContact O-N 3.17Å
425	L	88.5	Confident	81.8	Confident	89 Å²	89	108.8 Å²	108.8	47%	0.466	54%	0.54	S	S	.	.	H	α-helix	trans	-64.2	-31.9	178.1	-70.6	171.1	0	0	0	112.2	L421 L422 K429	L421-L425 HydrophobicContact CG-CD1 4.18Å; L421-L425 WeakPolarHBondContact O-CG 3.32Å; L421-L425 PolarHBondContact O-N 3.34Å; L422-L425 PolarHBondContact O-N 3Å; L425-K429 WeakPolarHBondContact O-CB 3.16Å; L425-K429 WeakPolarHBondContact O-CG 3.47Å; L425-K429 PolarHBondContact O-N 2.91Å
426	R	84.5	Confident	80.2	Confident	196 Å²	196	115.7 Å²	115.7	74%	0.74	56%	0.555	S	S	*	*	H	α-helix	trans	-69.4	-40.2	174.8	-169.2	178.7	-173.9	-167.6	1.2	111.5	L422 E423 R424 S430	L422-R426 WeakPolarHBondContact O-CB 3.49Å; L422-R426 PolarHBondContact O-N 2.83Å; E423-R426 PolarHBondContact O-N 2.9Å; R424-R426 VanDerWaalsContact C-N 3.26Å; R424-R426 PolarHBondContact O-N 2.77Å; R426-S430 WeakPolarHBondContact O-CB 3.37Å; R426-S430 PolarHBondContact O-N 3.34Å
427	W	82.7	Confident	78.7	Confident	187 Å²	187	114.5 Å²	114.5	71%	0.708	55%	0.55	S	S	*	*	H	α-helix	trans	-62.7	-47.2	172.2	-90.4	106.8	0	0	0	111.8	E423 R424 K429 S430 I431	E423-W427 PolarHBondContact O-N 3.27Å; R424-W427 WeakPolarHBondContact O-CB 3.4Å; R424-W427 PolarHBondContact O-N 2.94Å; W427-K429 PolarHBondContact O-N 2.66Å; W427-S430 WeakPolarHBondContact O-CB 3.19Å; W427-S430 PolarHBondContact O-N 2.82Å; W427-S430 VanDerWaalsContact O-N 3.15Å; W427-I431 WeakPolarHBondContact O-CG1 3.49Å; W427-I431 PolarHBondContact O-N 3.05Å
428	E	82.7	Confident	77.2	Confident	115 Å²	115	114 Å²	114	54%	0.537	55%	0.547	S	S	.	.	H	α-helix	trans	-60.2	-44.4	176.5	-74.8	177.8	172.1	0	0	111.9	R424 S430 I431 D432	R424-E428 PolarHBondContact O-N 3.17Å; E428-S430 VanDerWaalsContact C-N 3.33Å; E428-S430 PolarHBondContact O-N 3.32Å; E428-I431 PolarHBondContact O-N 3.43Å; E428-D432 PolarHBondContact O-N 2.95Å
429	K	81	Confident	75.4	Confident	153 Å²	153	114.9 Å²	114.9	67%	0.665	55%	0.55	S	S	*	*	H	α-helix	trans	-64.6	-34.3	174.7	-79.6	-171.2	175.7	-173.6	0	113.4	L425 W427 D432 T433	L425-K429 WeakPolarHBondContact O-CB 3.16Å; L425-K429 WeakPolarHBondContact O-CG 3.47Å; L425-K429 PolarHBondContact O-N 2.91Å; W427-K429 PolarHBondContact O-N 2.66Å; K429-D432 PolarHBondContact O-N 3.48Å; K429-T433 WeakPolarHBondContact O-CB 3.21Å; K429-T433 PolarHBondContact O-N 3.14Å; K429-T433 PolarHBondContact O-OG1 3.14Å
430	S	75.7	Confident	73.5	Confident	50 Å²	50	115 Å²	115	35%	0.35	56%	0.555	S	S	.	*	H	α-helix	trans	-65.8	-42.3	176	-160.9	0	0	0	0	110.8	R426 W427 E428 T433 E434	R426-S430 WeakPolarHBondContact O-CB 3.37Å; R426-S430 PolarHBondContact O-N 3.34Å; W427-S430 WeakPolarHBondContact O-CB 3.19Å; W427-S430 PolarHBondContact O-N 2.82Å; W427-S430 VanDerWaalsContact O-N 3.15Å; E428-S430 VanDerWaalsContact C-N 3.33Å; E428-S430 PolarHBondContact O-N 3.32Å; S430-T433 PolarHBondContact O-N 2.98Å; S430-E434 WeakPolarHBondContact O-CG 3.45Å; S430-E434 PolarHBondContact O-N 3.47Å
431	I	72.2	Confident	71.6	Confident	87 Å²	87	115 Å²	115	45%	0.446	56%	0.561	S	S	.	*	H	α-helix	trans	-63.1	-45.3	175.9	-66.3	164.6	0	0	0	110.3	W427 E428 T433 E434 L435	W427-I431 WeakPolarHBondContact O-CG1 3.49Å; W427-I431 PolarHBondContact O-N 3.05Å; E428-I431 PolarHBondContact O-N 3.43Å; I431-T433 PolarHBondContact O-N 3.42Å; I431-E434 PolarHBondContact O-N 2.87Å; I431-L435 HydrophobicContact CG2-CD1 3.85Å; I431-L435 WeakPolarHBondContact O-CD1 3.39Å; I431-L435 WeakPolarHBondContact O-CG 3.48Å; I431-L435 PolarHBondContact O-N 3.21Å
432	D	69.5	Low	69.6	Low	84 Å²	84	118.7 Å²	118.7	45%	0.449	58%	0.575	S	S	.	*	H	α-helix	trans	-59.6	-47.7	174.5	-77.2	-20	0	0	0	110.5	E428 K429 E434 L435 W436	E428-D432 PolarHBondContact O-N 2.95Å; K429-D432 PolarHBondContact O-N 3.48Å; D432-E434 VanDerWaalsContact C-N 3.3Å; D432-E434 PolarHBondContact O-N 3.41Å; D432-L435 CarbonylContact O-C 3.51Å; D432-L435 WeakPolarHBondContact O-CA 3.39Å; D432-L435 WeakPolarHBondContact O-CB 3.38Å; D432-L435 PolarHBondContact O-N 3.43Å; D432-W436 PolarHBondContact O-N 2.84Å
433	T	68	Low	67.5	Low	92 Å²	92	118.9 Å²	118.9	56%	0.564	58%	0.58	S	S	*	*	H	α-helix	trans	-63.5	-36.1	-178.5	-44.5	0	0	0	0	111.9	K429 S430 I431 W436 S437	K429-T433 WeakPolarHBondContact O-CB 3.21Å; K429-T433 PolarHBondContact O-N 3.14Å; K429-T433 PolarHBondContact O-OG1 3.14Å; S430-T433 PolarHBondContact O-N 2.98Å; I431-T433 PolarHBondContact O-N 3.42Å; T433-W436 PolarHBondContact O-N 2.92Å; T433-S437 WeakPolarHBondContact O-CB 3.35Å; T433-S437 PolarHBondContact O-N 2.99Å; T433-S437 PolarHBondContact O-OG 2.9Å; T433-S437 VanDerWaalsContact O-OG 3.11Å
434	E	61.3	Low	65.2	Low	124 Å²	124	128.4 Å²	128.4	58%	0.579	61%	0.614	S	S	*	*	H	α-helix	trans	-65.5	-41.1	172	-76.3	178.9	-169.6	0	0	111.8	S430 I431 D432 S437 S438	S430-E434 WeakPolarHBondContact O-CG 3.45Å; S430-E434 PolarHBondContact O-N 3.47Å; I431-E434 PolarHBondContact O-N 2.87Å; D432-E434 VanDerWaalsContact C-N 3.3Å; D432-E434 PolarHBondContact O-N 3.41Å; E434-S437 WeakPolarHBondContact CA-OG 3.4Å; E434-S437 PolarHBondContact O-N 3.17Å; E434-S437 PolarHBondContact O-OG 2.97Å; E434-S438 WeakPolarHBondContact O-CB 3.5Å; E434-S438 PolarHBondContact O-N 3.24Å; E434-S438 PolarHBondContact O-OG 2.65Å
435	L	58.6	Low	64	Low	98 Å²	98	125.6 Å²	125.6	51%	0.513	61%	0.61	S	S	.	*	H	α-helix	trans	-63.1	-42.3	173	-80.1	153.4	0	0	0	112.3	I431 D432 S438 S439	I431-L435 HydrophobicContact CG2-CD1 3.85Å; I431-L435 WeakPolarHBondContact O-CD1 3.39Å; I431-L435 WeakPolarHBondContact O-CG 3.48Å; I431-L435 PolarHBondContact O-N 3.21Å; D432-L435 CarbonylContact O-C 3.51Å; D432-L435 WeakPolarHBondContact O-CA 3.39Å; D432-L435 WeakPolarHBondContact O-CB 3.38Å; D432-L435 PolarHBondContact O-N 3.43Å; L435-S438 WeakPolarHBondContact CA-OG 3.39Å; L435-S438 PolarHBondContact O-OG 3.25Å; L435-S439 WeakPolarHBondContact O-CB 3.31Å; L435-S439 PolarHBondContact O-N 2.78Å; L435-S439 PolarHBondContact O-OG 2.96Å
436	W	56.6	Low	62.7	Low	181 Å²	181	127.5 Å²	127.5	69%	0.686	62%	0.618	S	S	*	*	H	α-helix	trans	-69.6	-37.5	177.3	-72.4	101.7	0	0	0	112.3	D432 T433 S439 N440	D432-W436 PolarHBondContact O-N 2.84Å; T433-W436 PolarHBondContact O-N 2.92Å; W436-S439 PolarHBondContact O-N 3.19Å; W436-N440 PolarHBondContact O-N 2.9Å; W436-N440 PolarHBondContact O-ND2 3.03Å
437	S	56.8	Low	61.5	Low	61 Å²	61	123.7 Å²	123.7	43%	0.427	61%	0.611	S	S	.	*	H	α-helix	trans	-72.2	-38.8	178.1	66.7	0	0	0	0	112.8	T433 E434 S439 N440 L441	T433-S437 WeakPolarHBondContact O-CB 3.35Å; T433-S437 PolarHBondContact O-N 2.99Å; T433-S437 PolarHBondContact O-OG 2.9Å; T433-S437 VanDerWaalsContact O-OG 3.11Å; E434-S437 WeakPolarHBondContact CA-OG 3.4Å; E434-S437 PolarHBondContact O-N 3.17Å; E434-S437 PolarHBondContact O-OG 2.97Å; S437-S439 VanDerWaalsContact C-N 3.32Å; S437-N440 PolarHBondContact O-N 3.06Å; S437-L441 PolarHBondContact O-N 3.26Å
438	S	55	Low	60.3	Low	72 Å²	72	120 Å²	120	50%	0.503	61%	0.605	S	S	.	*	H	α-helix	trans	-69.2	-30.3	173.9	46.8	0	0	0	0	112.4	E434 L435	E434-S438 WeakPolarHBondContact O-CB 3.5Å; E434-S438 PolarHBondContact O-N 3.24Å; E434-S438 PolarHBondContact O-OG 2.65Å; L435-S438 WeakPolarHBondContact CA-OG 3.39Å; L435-S438 PolarHBondContact O-OG 3.25Å
439	S	51.8	Low	58.9	Low	75 Å²	75	120.3 Å²	120.3	52%	0.524	61%	0.609	S	S	.	*	H	α-helix	trans	-68.5	-34.1	172.4	-58.4	0	0	0	0	112.9	L435 W436 S437	L435-S439 WeakPolarHBondContact O-CB 3.31Å; L435-S439 PolarHBondContact O-N 2.78Å; L435-S439 PolarHBondContact O-OG 2.96Å; W436-S439 PolarHBondContact O-N 3.19Å; S437-S439 VanDerWaalsContact C-N 3.32Å
440	N	50	Low	57.4	Low	114 Å²	114	118.1 Å²	118.1	61%	0.61	61%	0.605	S	S	*	*	H	α-helix	trans	-84.8	-16.9	-177.9	-77.5	-31.8	0	0	0	114.4	W436 S437 H442	W436-N440 PolarHBondContact O-N 2.9Å; W436-N440 PolarHBondContact O-ND2 3.03Å; S437-N440 PolarHBondContact O-N 3.06Å; N440-H442 VanDerWaalsContact C-N 3.27Å; N440-H442 PolarHBondContact O-N 2.73Å
441	L	50.4	Low	56.1	Low	142 Å²	142	123 Å²	123	74%	0.743	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-2.5	178.4	-95.6	148.2	0	0	0	114.4	S437	S437-L441 PolarHBondContact O-N 3.26Å
442	H	48.7	Very low	54.8	Low	178 Å²	178	125.8 Å²	125.8	82%	0.824	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	13.8	175.6	-88.3	-6.4	0	0	0	114.8	N440	N440-H442 VanDerWaalsContact C-N 3.27Å; N440-H442 PolarHBondContact O-N 2.73Å
443	V	46.3	Very low	53.6	Low	112 Å²	112	129.3 Å²	129.3	68%	0.679	65%	0.653	S	S	*	*			trans	-125.3	69.9	175	-167	0	0	0	0	109.8
444	Y	39.9	Very low	52.3	Low	302 Å²	302	132.6 Å²	132.6	100%	1.184	66%	0.661	S	S	*	*			trans	-144.1	0	155.2	-90.9	-74	0	0	0	109.9

Retrieved 444 of 444 residues in 882.2 ms (Link to these results)

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