A0A077Z397_TRITR Loading...

Endoplasmic oxidoreductin-1

AlphaFold DB , UniProt , Accession A0A077Z397, Species TRITR (Trichuris trichiura, Whipworm), 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	36.8	Very low	31.6	Very low	253 Å²	253	147.9 Å²	147.9	100%	1.246	83%	0.825	S	S	*	*				0	123.2	0	-66.6	-167.3	-149.7	0	0	107.6
2	G	35.5	Very low	31.3	Very low	77 Å²	77	151.3 Å²	151.3	79%	0.794	83%	0.825	S	S	*	*			trans	105.4	78.6	-179.1	0	0	0	0	0	113.8	L4	G2-L4 PolarHBondContact O-N 3.29Å
3	H	33.4	Very low	30.9	Very low	197 Å²	197	150.5 Å²	150.5	91%	0.912	82%	0.82	S	S	*	*			trans	-71.6	104.2	165.9	-82.2	-78.7	0	0	0	108.8
4	L	32	Very low	30.6	Very low	170 Å²	170	152.7 Å²	152.7	89%	0.89	83%	0.829	S	S	*	*			trans	-88	113.8	170.4	-145.3	92.5	0	0	0	108.3	G2 L6	G2-L4 PolarHBondContact O-N 3.29Å; L4-L6 PolarHBondContact O-N 3.05Å
5	V	35.5	Very low	30.3	Very low	117 Å²	117	155.6 Å²	155.6	71%	0.709	83%	0.831	S	S	*	*			trans	-70.5	117.8	177.7	173.5	0	0	0	0	109.2	F7	V5-F7 HydrophobicContact CG1-CD2 4.21Å; V5-F7 PolarHBondContact O-N 2.85Å
6	L	30.3	Very low	30.1	Very low	154 Å²	154	151.3 Å²	151.3	81%	0.806	82%	0.816	S	S	*	*			trans	-65.7	107.1	167.5	-100.2	125.4	0	0	0	109.7	L4 V8	L4-L6 PolarHBondContact O-N 3.05Å; L6-V8 HydrophobicContact CD2-CG2 3.86Å
7	F	29.2	Very low	30	Very low	183 Å²	183	148.6 Å²	148.6	80%	0.803	82%	0.82	S	S	*	*			trans	-94.8	94.9	161	-112.2	-86.9	0	0	0	108.6	V5 V9	V5-F7 HydrophobicContact CG1-CD2 4.21Å; V5-F7 PolarHBondContact O-N 2.85Å; F7-V9 HydrophobicContact CD1-CG2 3.82Å; F7-V9 HydrophobicContact CE1-CG2 4.45Å; F7-V9 PolarHBondContact O-N 3.06Å
8	V	28.6	Very low	30	Very low	122 Å²	122	146.8 Å²	146.8	74%	0.739	82%	0.82	S	S	*	*			trans	-86.7	97.1	164	177	0	0	0	0	106.5	L6	L6-V8 HydrophobicContact CD2-CG2 3.86Å
9	V	32	Very low	29.9	Very low	120 Å²	120	143.1 Å²	143.1	73%	0.727	80%	0.804	S	S	*	*			trans	-93.1	109.3	164.6	-178.9	0	0	0	0	107.4	F7 L11	F7-V9 HydrophobicContact CD1-CG2 3.82Å; F7-V9 HydrophobicContact CE1-CG2 4.45Å; F7-V9 PolarHBondContact O-N 3.06Å; V9-L11 PolarHBondContact O-N 3.24Å
10	A	29.2	Very low	29.9	Very low	74 Å²	74	145 Å²	145	61%	0.612	81%	0.806	S	S	*	*			trans	-65.9	124.4	175.3	0	0	0	0	0	111.4	F12	A10-F12 PolarHBondContact O-N 2.63Å
11	L	25.4	Very low	30.1	Very low	160 Å²	160	141.4 Å²	141.4	84%	0.838	79%	0.785	S	S	*	*				19.5	97.9	128.4	-65.3	163.8	0	0	0	116.3	V9	V9-L11 PolarHBondContact O-N 3.24Å
12	F	27.7	Very low	29.9	Very low	189 Å²	189	133.2 Å²	133.2	83%	0.829	74%	0.743	S	S	*	*			trans	-154.7	107.7	138.5	-94.8	-74.2	0	0	0	109.7	A10	A10-F12 PolarHBondContact O-N 2.63Å
13	N	25.8	Very low	29.5	Very low	140 Å²	140	136.9 Å²	136.9	75%	0.749	74%	0.739	S	S	*	*			trans	25.1	97.1	154.2	-63.4	-47.9	0	0	0	118.9
14	L	27.3	Very low	29.6	Very low	182 Å²	182	133.7 Å²	133.7	95%	0.953	74%	0.739	S	S	*	*			trans	-112.8	28.6	157.9	-109.8	130.8	0	0	0	111.7
15	K	25.6	Very low	29.8	Very low	196 Å²	196	128.5 Å²	128.5	85%	0.852	72%	0.717	S	S	*	*	S	Bend	trans	-113.3	73.5	172.7	-77.2	-171.6	175.2	-176.4	0	110.2
16	S	27	Very low	30.2	Very low	86 Å²	86	125.4 Å²	125.4	60%	0.601	70%	0.697	S	S	*	*			trans	158.8	77.1	156.1	57	0	0	0	0	110.2
17	A	28.9	Very low	31.3	Very low	106 Å²	106	119.5 Å²	119.5	88%	0.876	67%	0.668	S	S	*	*	S	Bend	trans	-114.5	10	165.1	0	0	0	0	0	111.9
18	S	29	Very low	32	Very low	117 Å²	117	111 Å²	111	82%	0.818	63%	0.631	S	S	*	*	S	Bend	trans	-106.3	2.3	176.2	45.8	0	0	0	0	113.4
19	S	28.2	Very low	32.8	Very low	75 Å²	75	105.9 Å²	105.9	52%	0.524	60%	0.599	S	S	.	*	S	Bend	trans	-104.2	0.9	-176.1	63.2	0	0	0	0	115.5
20	E	30.7	Very low	33.5	Very low	182 Å²	182	102.6 Å²	102.6	85%	0.85	58%	0.58	S	S	*	*	S	Bend	trans	-92.8	3.1	178.9	-72.5	-171.6	165.9	0	0	113.7
21	L	33.7	Very low	34.4	Very low	69 Å²	69	100.9 Å²	100.9	36%	0.361	56%	0.559	S	S	.	*	S	Bend	trans	-68.8	-42.6	-176.6	-144.7	74.7	0	0	0	111.9	D269	L21-D269 WeakPolarHBondContact CD1-OD2 3.35Å
22	F	32.1	Very low	35	Very low	81 Å²	81	95.3 Å²	95.3	36%	0.355	53%	0.534	S	S	.	.			trans	-164.8	104	-178.9	-86.1	-87.8	0	0	0	105.3	S24 D26 P27	F22-S24 PolarHBondContact O-N 3.24Å; F22-D26 WeakPolarHBondContact CD1-O 3.49Å; F22-P27 HydrophobicContact CD1-CB 4.26Å; F22-P27 HydrophobicContact CD1-CG 4.08Å; F22-P27 HydrophobicContact CE1-CB 3.88Å; F22-P27 HydrophobicContact CE1-CG 3.94Å
23	Q	28.5	Very low	35.7	Very low	154 Å²	154	87 Å²	87	72%	0.72	50%	0.498	S	S	*	.			trans	-58.8	128.4	167.1	-154.6	161.6	8.2	0	0	105.8	S25 D26	Q23-S25 PolarHBondContact O-N 2.96Å; Q23-D26 PolarHBondContact O-N 2.86Å
24	S	35.3	Very low	36.2	Very low	131 Å²	131	83 Å²	83	92%	0.916	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-3.2	-171.9	58.3	0	0	0	0	115	F22	F22-S24 PolarHBondContact O-N 3.24Å
25	S	35.6	Very low	37	Very low	61 Å²	61	79.8 Å²	79.8	43%	0.427	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-10.3	177.1	50.9	0	0	0	0	115.6	Q23	Q23-S25 PolarHBondContact O-N 2.96Å
26	D	44.1	Very low	38.1	Very low	51 Å²	51	71 Å²	71	27%	0.273	43%	0.433	S	S	.	.			trans	-143	116.2	-179.8	-82.9	-39.8	0	0	0	111.5	F22 Q23 S38 C39	F22-D26 WeakPolarHBondContact CD1-O 3.49Å; Q23-D26 PolarHBondContact O-N 2.86Å; D26-S38 VanDerWaalsContact OD1-C 3.3Å; D26-S38 VanDerWaalsContact OD1-CB 3.3Å; D26-S38 WeakPolarHBondContact OD1-CB 3.45Å; D26-S38 VanDerWaalsContact OD2-CB 3.24Å; D26-S38 WeakPolarHBondContact OD2-CB 3.34Å; D26-S38 PolarHBondContact OD2-OG 3.4Å; D26-C39 PolarHBondContact OD1-N 2.65Å
27	P	52.3	Low	39	Very low	30 Å²	30	72 Å²	72	20%	0.195	43%	0.427	C	S	.	.				-148.5	68.2	94	40	-22.2	0	0	0	111.9	F22 Q438	F22-P27 HydrophobicContact CD1-CB 4.26Å; F22-P27 HydrophobicContact CD1-CG 4.08Å; F22-P27 HydrophobicContact CE1-CB 3.88Å; F22-P27 HydrophobicContact CE1-CG 3.94Å; P27-Q438 VanDerWaalsContact CG-CD 3.5Å
28	C	44.6	Very low	39.8	Very low	4 Å²	4	70.1 Å²	70.1	3%	0.027	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	136	155.6	-79	0	0	0	0	108.7	C39 C41	C28-C39 WeakPolarHBondContact CB-O 3.28Å; C28-C39 PolarHBondContact O-N 3.38Å; C28-C39 VanDerWaalsContact O-O 3.11Å; C28-C41 HydrophobicContact CB-CB 3.8Å; C28-C41 WeakPolarHBondContact CB-SG 3.42Å; C28-C41 WeakPolarHBondContact SG-CA 3.28Å; C28-C41 WeakPolarHBondContact SG-CB 3.37Å; C28-C41 CovalentContact SG-SG 2.01Å; C28-C41 PolarHBondContact SG-SG 3.23Å
29	F	46.6	Very low	40.6	Very low	16 Å²	16	65.7 Å²	65.7	7%	0.07	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.9	178.2	-68.5	-76	0	0	0	109.9	L36 H37 K282 Y285	F29-L36 HydrophobicContact CB-CD2 3.8Å; F29-L36 HydrophobicContact CD1-CB 4.36Å; F29-L36 HydrophobicContact CD1-CD2 4.47Å; F29-L36 HydrophobicContact CG-CD2 4.34Å; F29-H37 WeakPolarHBondContact CA-O 3.28Å; F29-K282 HydrophobicContact CD1-CG 3.99Å; F29-K282 HydrophobicContact CE1-CD 4.13Å; F29-K282 HydrophobicContact CE1-CG 3.39Å; F29-K282 HydrophobicContact CZ-CG 3.83Å; F29-Y285 HydrophobicContact CD2-CD1 4.44Å; F29-Y285 AromaticContact CD2-CD2 3.56Å; F29-Y285 HydrophobicContact CD2-CD2 3.56Å; F29-Y285 HydrophobicContact CD2-CE1 4.29Å; F29-Y285 AromaticContact CD2-CE2 3.44Å; F29-Y285 HydrophobicContact CD2-CE2 3.44Å; F29-Y285 VanDerWaalsContact CD2-CE2 3.44Å; F29-Y285 HydrophobicContact CD2-CG 4.1Å; F29-Y285 AromaticContact CD2-CZ 3.82Å; F29-Y285 AromaticContact CE2-CD2 3.83Å; F29-Y285 HydrophobicContact CE2-CD2 3.83Å; F29-Y285 AromaticContact CE2-CE2 3.52Å; F29-Y285 HydrophobicContact CE2-CE2 3.52Å; F29-Y285 HydrophobicContact CG-CD2 4.39Å
30	C	45.9	Very low	41.5	Very low	50 Å²	50	69.3 Å²	69.3	34%	0.338	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	135.1	172.1	-79.3	0	0	0	0	109.7	H37 C39	C30-H37 PolarHBondContact N-O 3.02Å; C30-C39 WeakPolarHBondContact CA-SG 3.41Å; C30-C39 HydrophobicContact CB-CB 3.58Å; C30-C39 WeakPolarHBondContact CB-SG 3.47Å; C30-C39 PolarHBondContact N-SG 3.33Å; C30-C39 WeakPolarHBondContact SG-CB 3.44Å; C30-C39 CovalentContact SG-SG 2.01Å; C30-C39 PolarHBondContact SG-SG 2.88Å
31	H	48.8	Very low	42.4	Very low	38 Å²	38	64.3 Å²	64.3	18%	0.176	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.7	-165.3	-134	-101.2	0	0	0	114	L33 L36 L289	H31-L33 WeakPolarHBondContact CE1-CD1 3.27Å; H31-L36 WeakPolarHBondContact CD2-CD2 3.48Å; H31-L36 VanDerWaalsContact NE2-CD2 3.35Å; H31-L36 WeakPolarHBondContact NE2-CD2 3.49Å; H31-L289 WeakPolarHBondContact CD2-CD1 3.41Å; H31-L289 WeakPolarHBondContact CE1-CD1 3.49Å; H31-L289 VanDerWaalsContact CG-CD1 3.49Å; H31-L289 WeakPolarHBondContact NE2-CD1 3.14Å
32	S	37.4	Very low	43.5	Very low	44 Å²	44	64.3 Å²	64.3	31%	0.308	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	137.4	133.3	91.6	0	0	0	0	108.6	G34 E35	S32-G34 PolarHBondContact O-N 3.38Å; S32-E35 PolarHBondContact N-O 3.18Å; S32-E35 CarbonylContact O-C 3.59Å; S32-E35 PolarHBondContact O-N 3.47Å
33	L	41.3	Very low	44.7	Very low	13 Å²	13	68.8 Å²	68.8	7%	0.068	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	110.6	177.5	-94.6	99.1	0	0	0	111.9	H31 F286 F336 L341	H31-L33 WeakPolarHBondContact CE1-CD1 3.27Å; L33-F286 HydrophobicContact CD2-CD2 3.78Å; L33-F286 HydrophobicContact CD2-CE2 3.22Å; L33-F286 HydrophobicContact CD2-CZ 3.92Å; L33-F286 HydrophobicContact CG-CD2 4.23Å; L33-F286 HydrophobicContact CG-CE2 4.06Å; L33-F336 HydrophobicContact CD1-CB 4.18Å; L33-F336 HydrophobicContact CD1-CD1 4.09Å; L33-F336 HydrophobicContact CD1-CD2 2.98Å; L33-F336 HydrophobicContact CD1-CE1 4.22Å; L33-F336 HydrophobicContact CD1-CE2 3.13Å; L33-F336 HydrophobicContact CD1-CG 3.49Å; L33-F336 VanDerWaalsContact CD1-CG 3.49Å; L33-F336 HydrophobicContact CD1-CZ 3.8Å; L33-F336 HydrophobicContact CD2-CD2 3.99Å; L33-F336 HydrophobicContact CD2-CE1 3.91Å; L33-F336 HydrophobicContact CD2-CE2 3.17Å; L33-F336 HydrophobicContact CD2-CZ 3.15Å; L33-F336 HydrophobicContact CG-CD2 4.08Å; L33-F336 HydrophobicContact CG-CE2 3.75Å; L33-F336 HydrophobicContact CG-CZ 4.06Å; L33-L341 HydrophobicContact CB-CD1 4.43Å; L33-L341 HydrophobicContact CD2-CD1 3.15Å; L33-L341 HydrophobicContact CG-CD1 4.4Å
34	G	37.7	Very low	46.4	Very low	57 Å²	57	69.9 Å²	69.9	59%	0.588	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	138.8	-34.5	-171.5	0	0	0	0	0	110	S32	S32-G34 PolarHBondContact O-N 3.38Å
35	E	42.7	Very low	48.5	Very low	114 Å²	114	63.6 Å²	63.6	53%	0.533	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	103.6	-177.8	-68.6	177.8	178.5	0	0	110	S32 H37	S32-E35 PolarHBondContact N-O 3.18Å; S32-E35 CarbonylContact O-C 3.59Å; S32-E35 PolarHBondContact O-N 3.47Å; E35-H37 VanDerWaalsContact CB-NE2 3.32Å; E35-H37 WeakPolarHBondContact CB-NE2 3.39Å; E35-H37 PolarHBondContact O-N 3Å; E35-H37 IonicContact OE2-CD2 2.69Å; E35-H37 IonicContact OE2-CE1 2.86Å; E35-H37 IonicContact OE2-NE2 2.7Å; E35-H37 PolarHBondContact OE2-NE2 3.18Å
36	L	50.3	Low	50.9	Low	13 Å²	13	60.8 Å²	60.8	7%	0.068	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	98.9	164.7	-84.8	162.5	0	0	0	106.8	F29 H31 K282 F286	F29-L36 HydrophobicContact CB-CD2 3.8Å; F29-L36 HydrophobicContact CD1-CB 4.36Å; F29-L36 HydrophobicContact CD1-CD2 4.47Å; F29-L36 HydrophobicContact CG-CD2 4.34Å; H31-L36 WeakPolarHBondContact CD2-CD2 3.48Å; H31-L36 VanDerWaalsContact NE2-CD2 3.35Å; H31-L36 WeakPolarHBondContact NE2-CD2 3.49Å; L36-K282 HydrophobicContact CB-CB 4.38Å; L36-K282 HydrophobicContact CB-CD 4.21Å; L36-K282 HydrophobicContact CB-CG 4.1Å; L36-K282 HydrophobicContact CD1-CB 3.69Å; L36-K282 HydrophobicContact CD1-CG 4.25Å; L36-K282 WeakPolarHBondContact CD1-O 3.3Å; L36-F286 HydrophobicContact CD1-CB 4.37Å
37	H	46	Very low	53	Low	105 Å²	105	59 Å²	59	49%	0.486	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	146.6	175.7	-67.6	-57.2	0	0	0	109.8	F29 C30 E35	F29-H37 WeakPolarHBondContact CA-O 3.28Å; C30-H37 PolarHBondContact N-O 3.02Å; E35-H37 VanDerWaalsContact CB-NE2 3.32Å; E35-H37 WeakPolarHBondContact CB-NE2 3.39Å; E35-H37 PolarHBondContact O-N 3Å; E35-H37 IonicContact OE2-CD2 2.69Å; E35-H37 IonicContact OE2-CE1 2.86Å; E35-H37 IonicContact OE2-NE2 2.7Å; E35-H37 PolarHBondContact OE2-NE2 3.18Å
38	S	44.3	Very low	54.7	Low	67 Å²	67	59.4 Å²	59.4	47%	0.469	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	136.5	167.1	69	0	0	0	0	108.7	D26	D26-S38 VanDerWaalsContact OD1-C 3.3Å; D26-S38 VanDerWaalsContact OD1-CB 3.3Å; D26-S38 WeakPolarHBondContact OD1-CB 3.45Å; D26-S38 VanDerWaalsContact OD2-CB 3.24Å; D26-S38 WeakPolarHBondContact OD2-CB 3.34Å; D26-S38 PolarHBondContact OD2-OG 3.4Å
39	C	46.3	Very low	56.9	Low	25 Å²	25	59.6 Å²	59.6	17%	0.169	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	166.1	-179.7	70.8	0	0	0	0	111.9	D26 C28 C30 C41	D26-C39 PolarHBondContact OD1-N 2.65Å; C28-C39 WeakPolarHBondContact CB-O 3.28Å; C28-C39 PolarHBondContact O-N 3.38Å; C28-C39 VanDerWaalsContact O-O 3.11Å; C30-C39 WeakPolarHBondContact CA-SG 3.41Å; C30-C39 HydrophobicContact CB-CB 3.58Å; C30-C39 WeakPolarHBondContact CB-SG 3.47Å; C30-C39 PolarHBondContact N-SG 3.33Å; C30-C39 WeakPolarHBondContact SG-CB 3.44Å; C30-C39 CovalentContact SG-SG 2.01Å; C30-C39 PolarHBondContact SG-SG 2.88Å; C39-C41 PolarHBondContact O-N 3.44Å
40	E	47.9	Very low	59.2	Low	151 Å²	151	58.9 Å²	58.9	71%	0.706	32%	0.323	S	S	*	.			trans	-59	133.7	172.2	-76.6	-178.5	157.3	0	0	111.9	T42	E40-T42 PolarHBondContact O-N 2.72Å
41	C	49.6	Very low	61.5	Low	77 Å²	77	57.7 Å²	57.7	52%	0.52	31%	0.313	S	S	.	.			trans	-66	74.4	175.5	-66.5	0	0	0	0	112.5	C28 C39	C28-C41 HydrophobicContact CB-CB 3.8Å; C28-C41 WeakPolarHBondContact CB-SG 3.42Å; C28-C41 WeakPolarHBondContact SG-CA 3.28Å; C28-C41 WeakPolarHBondContact SG-CB 3.37Å; C28-C41 CovalentContact SG-SG 2.01Å; C28-C41 PolarHBondContact SG-SG 3.23Å; C39-C41 PolarHBondContact O-N 3.44Å
42	T	56.5	Low	63.6	Low	68 Å²	68	60.6 Å²	60.6	42%	0.417	33%	0.334	S	S	.	.			trans	-84	170.1	170.9	58.3	0	0	0	0	111	E40 K44 S45	E40-T42 PolarHBondContact O-N 2.72Å; T42-K44 PolarHBondContact O-N 3.32Å; T42-S45 WeakPolarHBondContact O-CB 3.42Å; T42-S45 PolarHBondContact O-N 3.3Å; T42-S45 PolarHBondContact O-OG 3.44Å
43	E	56.7	Low	66.2	Low	175 Å²	175	62.4 Å²	62.4	82%	0.818	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-16.7	173.5	-69.6	-169.8	159.5	0	0	113.7
44	K	64.7	Low	68.8	Low	177 Å²	177	61.8 Å²	61.8	77%	0.77	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	1.5	177.2	-62.4	-175.2	179.2	180	0	113.6	T42	T42-K44 PolarHBondContact O-N 3.32Å
45	S	78.8	Confident	71.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.314	C	S	.	.	S	Bend	trans	-74.2	150.1	177.6	82.6	0	0	0	0	111.5	T42 D47 V48 F49	T42-S45 WeakPolarHBondContact O-CB 3.42Å; T42-S45 PolarHBondContact O-N 3.3Å; T42-S45 PolarHBondContact O-OG 3.44Å; S45-D47 PolarHBondContact O-N 3Å; S45-V48 PolarHBondContact O-N 3.47Å; S45-V48 WeakPolarHBondContact OG-CG2 3.31Å; S45-V48 PolarHBondContact OG-N 2.92Å; S45-V48 VanDerWaalsContact OG-N 3.17Å; S45-F49 WeakPolarHBondContact O-CB 3.34Å; S45-F49 PolarHBondContact O-N 3.24Å
46	V	86.3	Confident	74.1	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-33.5	177.5	-174.1	0	0	0	0	110.8	N50 Y285 F288 L289 I431	V46-N50 VanDerWaalsContact O-CB 3.23Å; V46-N50 WeakPolarHBondContact O-CB 3.49Å; V46-N50 PolarHBondContact O-N 2.96Å; V46-Y285 HydrophobicContact CB-CD1 4.01Å; V46-Y285 HydrophobicContact CB-CE1 4.32Å; V46-Y285 HydrophobicContact CG1-CD1 3.76Å; V46-Y285 HydrophobicContact CG1-CE1 4.25Å; V46-F288 HydrophobicContact CG1-CD1 3.77Å; V46-F288 HydrophobicContact CG1-CE1 3.83Å; V46-L289 HydrophobicContact CG1-CD1 4.25Å; V46-L289 HydrophobicContact CG1-CD2 4.29Å; V46-L289 HydrophobicContact CG1-CG 4.39Å; V46-L289 HydrophobicContact CG2-CD1 3.75Å; V46-L289 HydrophobicContact CG2-CD2 4.42Å; V46-I431 HydrophobicContact CG1-CD1 4.48Å
47	D	88.3	Confident	76.3	Confident	12 Å²	12	59.7 Å²	59.7	6%	0.064	32%	0.324	C	S	.	.	H	α-helix	trans	-65.6	-47.1	178.4	-63.6	-65.4	0	0	0	112.2	S45 N51 Y285 I431	S45-D47 PolarHBondContact O-N 3Å; D47-N51 WeakPolarHBondContact O-CB 3.25Å; D47-N51 PolarHBondContact O-N 3.4Å; D47-N51 PolarHBondContact O-ND2 3.26Å; D47-Y285 VanDerWaalsContact OD1-CE1 3.27Å; D47-Y285 WeakPolarHBondContact OD1-CE1 3.36Å; D47-Y285 PolarHBondContact OD1-OH 3.47Å; D47-I431 WeakPolarHBondContact OD1-CG2 3.26Å
48	V	88.6	Confident	78.7	Confident	40 Å²	40	54.7 Å²	54.7	24%	0.242	30%	0.301	C	S	.	.	H	α-helix	trans	-64.8	-47.7	177.6	174	0	0	0	0	109.6	S45 N50 N51 V52	S45-V48 PolarHBondContact O-N 3.47Å; S45-V48 WeakPolarHBondContact OG-CG2 3.31Å; S45-V48 PolarHBondContact OG-N 2.92Å; S45-V48 VanDerWaalsContact OG-N 3.17Å; V48-N50 PolarHBondContact O-N 2.85Å; V48-N51 PolarHBondContact O-N 2.68Å; V48-V52 HydrophobicContact CG1-CG2 4.13Å; V48-V52 WeakPolarHBondContact O-CB 3.28Å; V48-V52 WeakPolarHBondContact O-CG2 3.48Å; V48-V52 PolarHBondContact O-N 3.46Å
49	F	90.6	Very high	81.2	Confident	8 Å²	8	53.8 Å²	53.8	4%	0.035	29%	0.293	C	S	.	.	I	π-helix	trans	-54.9	-51.8	177.3	172	-114.8	0	0	0	112.4	S45 H53 I54 M292 K328 I329 F332	S45-F49 WeakPolarHBondContact O-CB 3.34Å; S45-F49 PolarHBondContact O-N 3.24Å; F49-H53 HydrophobicContact CD2-CB 4.48Å; F49-H53 WeakPolarHBondContact O-CB 3.36Å; F49-H53 PolarHBondContact O-N 3.06Å; F49-H53 VanDerWaalsContact O-N 3.1Å; F49-I54 HydrophobicContact CD1-CG1 4.27Å; F49-I54 HydrophobicContact CD2-CG1 3.98Å; F49-I54 HydrophobicContact CE1-CD1 4.46Å; F49-I54 HydrophobicContact CE1-CG1 3.78Å; F49-I54 HydrophobicContact CE2-CD1 3.68Å; F49-I54 HydrophobicContact CE2-CG1 3.43Å; F49-I54 VanDerWaalsContact CE2-CG1 3.43Å; F49-I54 HydrophobicContact CG-CG1 4.37Å; F49-I54 HydrophobicContact CZ-CD1 3.61Å; F49-I54 HydrophobicContact CZ-CG1 3.34Å; F49-I54 PolarHBondContact O-N 3.4Å; F49-M292 HydrophobicContact CE1-CE 3.72Å; F49-M292 HydrophobicContact CZ-CE 3.86Å; F49-K328 WeakPolarHBondContact CE2-O 3.46Å; F49-I329 HydrophobicContact CZ-CG1 4.34Å; F49-F332 HydrophobicContact CB-CD2 3.74Å; F49-F332 HydrophobicContact CB-CE2 3.55Å; F49-F332 HydrophobicContact CB-CZ 4.19Å; F49-F332 HydrophobicContact CD1-CD1 4.07Å; F49-F332 HydrophobicContact CD1-CD2 4.07Å; F49-F332 HydrophobicContact CD1-CE1 4.17Å; F49-F332 HydrophobicContact CD1-CE2 4.19Å; F49-F332 HydrophobicContact CD1-CG 4.01Å; F49-F332 HydrophobicContact CD1-CZ 4.23Å; F49-F332 HydrophobicContact CD2-CB 3.83Å; F49-F332 AromaticContact CD2-CD2 3.55Å; F49-F332 HydrophobicContact CD2-CD2 3.55Å; F49-F332 HydrophobicContact CD2-CE2 4.26Å; F49-F332 AromaticContact CD2-CG 3.75Å; F49-F332 HydrophobicContact CD2-CG 3.75Å; F49-F332 HydrophobicContact CE1-CB 4.39Å; F49-F332 HydrophobicContact CE1-CD1 4.04Å; F49-F332 HydrophobicContact CE1-CE1 4.48Å; F49-F332 HydrophobicContact CE1-CG 4.09Å; F49-F332 HydrophobicContact CE2-CB 3.51Å; F49-F332 HydrophobicContact CE2-CD2 4.14Å; F49-F332 AromaticContact CE2-CG 3.85Å; F49-F332 HydrophobicContact CE2-CG 3.85Å; F49-F332 HydrophobicContact CG-CB 4.4Å; F49-F332 HydrophobicContact CG-CD1 4.32Å; F49-F332 AromaticContact CG-CD2 3.5Å; F49-F332 HydrophobicContact CG-CD2 3.5Å; F49-F332 AromaticContact CG-CE2 3.75Å; F49-F332 HydrophobicContact CG-CE2 3.75Å; F49-F332 AromaticContact CG-CG 3.82Å; F49-F332 HydrophobicContact CG-CG 3.82Å; F49-F332 HydrophobicContact CG-CZ 4.25Å; F49-F332 HydrophobicContact CZ-CB 3.8Å; F49-F332 HydrophobicContact CZ-CD1 4.29Å; F49-F332 AromaticContact CZ-CG 4Å; F49-F332 HydrophobicContact CZ-CG 4Å
50	N	94	Very high	83.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.305	C	S	.	.	I	π-helix	trans	-65.3	-56.8	179.2	-179.2	66.5	0	0	0	111.5	V46 V48 V52 I54 H55 F288 S428 I431	V46-N50 VanDerWaalsContact O-CB 3.23Å; V46-N50 WeakPolarHBondContact O-CB 3.49Å; V46-N50 PolarHBondContact O-N 2.96Å; V48-N50 PolarHBondContact O-N 2.85Å; N50-V52 VanDerWaalsContact C-N 3.35Å; N50-V52 PolarHBondContact O-N 3.37Å; N50-I54 PolarHBondContact O-N 3.44Å; N50-H55 WeakPolarHBondContact O-CB 3.46Å; N50-H55 PolarHBondContact O-N 2.98Å; N50-F288 HydrophobicContact CB-CE1 4.21Å; N50-F288 HydrophobicContact CB-CZ 4.1Å; N50-F288 WeakPolarHBondContact OD1-CZ 3.33Å; N50-S428 PolarHBondContact ND2-O 2.84Å; N50-S428 WeakPolarHBondContact OD1-CA 3.18Å; N50-S428 WeakPolarHBondContact OD1-CB 3.26Å; N50-S428 PolarHBondContact OD1-OG 3.36Å; N50-I431 HydrophobicContact CB-CG2 4.11Å
51	N	94.2	Very high	85.9	Confident	25 Å²	25	50.1 Å²	50.1	13%	0.134	27%	0.271	C	S	.	.	I	π-helix	trans	-74	-25	-166.2	-63.7	-25.6	0	0	0	113.4	D47 V48 R432	D47-N51 WeakPolarHBondContact O-CB 3.25Å; D47-N51 PolarHBondContact O-N 3.4Å; D47-N51 PolarHBondContact O-ND2 3.26Å; V48-N51 PolarHBondContact O-N 2.68Å; N51-R432 WeakPolarHBondContact OD1-CA 3.49Å; N51-R432 WeakPolarHBondContact OD1-CB 3.31Å; N51-R432 PolarHBondContact OD1-N 3.21Å
52	V	93.3	Very high	88.1	Confident	100 Å²	100	47.6 Å²	47.6	61%	0.606	25%	0.252	S	S	*	.	I	π-helix	trans	-102.6	-41.2	-178.2	-174.8	0	0	0	0	111.8	V48 N50	V48-V52 HydrophobicContact CG1-CG2 4.13Å; V48-V52 WeakPolarHBondContact O-CB 3.28Å; V48-V52 WeakPolarHBondContact O-CG2 3.48Å; V48-V52 PolarHBondContact O-N 3.46Å; N50-V52 VanDerWaalsContact C-N 3.35Å; N50-V52 PolarHBondContact O-N 3.37Å
53	H	92.6	Very high	89.9	Confident	81 Å²	81	50.4 Å²	50.4	38%	0.375	26%	0.259	S	S	.	.	I	π-helix	trans	-104.8	-30.9	-168.5	-58.6	-50.2	0	0	0	114.8	F49 L57	F49-H53 HydrophobicContact CD2-CB 4.48Å; F49-H53 WeakPolarHBondContact O-CB 3.36Å; F49-H53 PolarHBondContact O-N 3.06Å; F49-H53 VanDerWaalsContact O-N 3.1Å; H53-L57 WeakPolarHBondContact O-CD1 3.18Å
54	I	94.4	Very high	91.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.223	C	C	.	.	I	π-helix	trans	-110.5	-43.3	-168.3	-63.5	-65.5	0	0	0	112.9	F49 N50 G56 L57 L58 M292 L325 K328 I329	F49-I54 HydrophobicContact CD1-CG1 4.27Å; F49-I54 HydrophobicContact CD2-CG1 3.98Å; F49-I54 HydrophobicContact CE1-CD1 4.46Å; F49-I54 HydrophobicContact CE1-CG1 3.78Å; F49-I54 HydrophobicContact CE2-CD1 3.68Å; F49-I54 HydrophobicContact CE2-CG1 3.43Å; F49-I54 VanDerWaalsContact CE2-CG1 3.43Å; F49-I54 HydrophobicContact CG-CG1 4.37Å; F49-I54 HydrophobicContact CZ-CD1 3.61Å; F49-I54 HydrophobicContact CZ-CG1 3.34Å; F49-I54 PolarHBondContact O-N 3.4Å; N50-I54 PolarHBondContact O-N 3.44Å; I54-G56 PolarHBondContact O-N 3.2Å; I54-L57 PolarHBondContact O-N 3.09Å; I54-L57 VanDerWaalsContact O-N 3.1Å; I54-L58 HydrophobicContact CG2-CD1 3.41Å; I54-L58 VanDerWaalsContact CG2-CD1 3.41Å; I54-L58 HydrophobicContact CG2-CG 3.82Å; I54-L58 PolarHBondContact O-N 3.49Å; I54-M292 HydrophobicContact CD1-CE 4.38Å; I54-M292 HydrophobicContact CG1-CE 4.35Å; I54-M292 HydrophobicContact CG2-CE 4.07Å; I54-L325 HydrophobicContact CD1-CD1 3.77Å; I54-L325 HydrophobicContact CG2-CD1 3.92Å; I54-K328 HydrophobicContact CD1-CB 3.6Å; I54-I329 HydrophobicContact CD1-CG1 4.16Å
55	H	96.6	Very high	92.6	Very high	37 Å²	37	36.3 Å²	36.3	17%	0.171	20%	0.197	C	C	.	.	H	α-helix	trans	-58.9	-43	-169	-178.5	64.8	0	0	0	113.4	N50 T59 S428	N50-H55 WeakPolarHBondContact O-CB 3.46Å; N50-H55 PolarHBondContact O-N 2.98Å; H55-T59 WeakPolarHBondContact O-CB 3.42Å; H55-T59 PolarHBondContact O-N 3.49Å; H55-T59 PolarHBondContact O-OG1 2.72Å; H55-S428 PolarHBondContact ND1-OG 2.9Å
56	G	97	Very high	93	Very high	52 Å²	52	36.4 Å²	36.4	54%	0.536	20%	0.198	S	C	.	.	H	α-helix	trans	-64.4	-41.5	177.1	0	0	0	0	0	113	I54 T59 K60	I54-G56 PolarHBondContact O-N 3.2Å; G56-T59 PolarHBondContact O-N 3.42Å; G56-K60 PolarHBondContact O-N 3.18Å; G56-K60 VanDerWaalsContact O-N 3.13Å
57	L	96.1	Very high	93.2	Very high	51 Å²	51	36.4 Å²	36.4	27%	0.267	20%	0.197	S	C	.	.	H	α-helix	trans	-65.1	-47.9	176.7	-66.9	177.1	0	0	0	110.9	H53 I54 T59 K60 L61 L325 K328	H53-L57 WeakPolarHBondContact O-CD1 3.18Å; I54-L57 PolarHBondContact O-N 3.09Å; I54-L57 VanDerWaalsContact O-N 3.1Å; L57-T59 PolarHBondContact O-N 2.89Å; L57-K60 PolarHBondContact O-N 3.01Å; L57-L61 WeakPolarHBondContact O-CB 3.47Å; L57-L61 PolarHBondContact O-N 3.29Å; L57-L325 HydrophobicContact CB-CD1 4.47Å; L57-K328 HydrophobicContact CD1-CG 4.44Å
58	L	96.6	Very high	93.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58	-47.5	176.4	-76.4	174.6	0	0	0	111.4	I54 K60 L61 L62 L325 I424	I54-L58 HydrophobicContact CG2-CD1 3.41Å; I54-L58 VanDerWaalsContact CG2-CD1 3.41Å; I54-L58 HydrophobicContact CG2-CG 3.82Å; I54-L58 PolarHBondContact O-N 3.49Å; L58-K60 VanDerWaalsContact C-N 3.28Å; L58-K60 PolarHBondContact O-N 3.03Å; L58-L61 PolarHBondContact O-N 3.06Å; L58-L61 VanDerWaalsContact O-N 3.13Å; L58-L62 WeakPolarHBondContact O-CB 3.44Å; L58-L62 WeakPolarHBondContact O-CG 3.33Å; L58-L62 PolarHBondContact O-N 2.65Å; L58-L325 HydrophobicContact CD2-CD1 4.11Å; L58-L325 HydrophobicContact CD2-CD2 3.66Å; L58-L325 HydrophobicContact CG-CD1 4.11Å; L58-I424 HydrophobicContact CD1-CG2 3.73Å; L58-I424 HydrophobicContact CD2-CG2 4.23Å
59	T	96.5	Very high	93.4	Very high	49 Å²	49	36.6 Å²	36.6	30%	0.301	19%	0.193	S	C	.	.	H	α-helix	trans	-64.7	-32.9	-177.3	-60.6	0	0	0	0	112.3	H55 G56 L57 K63	H55-T59 WeakPolarHBondContact O-CB 3.42Å; H55-T59 PolarHBondContact O-N 3.49Å; H55-T59 PolarHBondContact O-OG1 2.72Å; G56-T59 PolarHBondContact O-N 3.42Å; L57-T59 PolarHBondContact O-N 2.89Å; T59-K63 WeakPolarHBondContact O-CG 3.49Å
60	K	96.4	Very high	93.4	Very high	97 Å²	97	36.4 Å²	36.4	42%	0.422	19%	0.192	S	C	.	.	H	α-helix	trans	-68	-48.8	171.5	-173.3	-167.5	173.8	-142.8	0	110.6	G56 L57 L58 L62 K63 D317 D321	G56-K60 PolarHBondContact O-N 3.18Å; G56-K60 VanDerWaalsContact O-N 3.13Å; L57-K60 PolarHBondContact O-N 3.01Å; L58-K60 VanDerWaalsContact C-N 3.28Å; L58-K60 PolarHBondContact O-N 3.03Å; K60-L62 PolarHBondContact O-N 3.28Å; K60-K63 PolarHBondContact O-N 2.93Å; K60-D317 IonicContact NZ-OD2 2.86Å; K60-D321 IonicContact NZ-OD1 3.62Å; K60-D321 PolarHBondContact NZ-OD1 3.43Å; K60-D321 IonicContact NZ-OD2 3.49Å; K60-D321 PolarHBondContact NZ-OD2 3.39Å
61	L	95.7	Very high	93.1	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-40.9	-175	-167.4	70.1	0	0	0	112.3	L57 L58 K63 K64 L67 T318 D321 I322 L325 F421	L57-L61 WeakPolarHBondContact O-CB 3.47Å; L57-L61 PolarHBondContact O-N 3.29Å; L58-L61 PolarHBondContact O-N 3.06Å; L58-L61 VanDerWaalsContact O-N 3.13Å; L61-K63 PolarHBondContact O-N 3.04Å; L61-K63 VanDerWaalsContact O-N 3.17Å; L61-K64 HydrophobicContact CD1-CD 4.29Å; L61-K64 WeakPolarHBondContact O-CB 3.38Å; L61-K64 PolarHBondContact O-N 3.28Å; L61-K64 VanDerWaalsContact O-N 3.09Å; L61-L67 HydrophobicContact CD2-CD1 3.88Å; L61-L67 HydrophobicContact CG-CD1 3.65Å; L61-T318 HydrophobicContact CD1-CG2 4.08Å; L61-D321 HydrophobicContact CD1-CB 3.79Å; L61-I322 HydrophobicContact CD1-CG1 4.04Å; L61-I322 HydrophobicContact CD2-CG1 3.82Å; L61-L325 HydrophobicContact CD2-CD2 4.26Å; L61-F421 HydrophobicContact CD2-CD1 3.77Å; L61-F421 HydrophobicContact CD2-CE1 3.62Å
62	L	96	Very high	92.8	Very high	23 Å²	23	36.6 Å²	36.6	12%	0.12	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-11.5	-179.4	-64.4	172.9	0	0	0	114.3	L58 K60 L67 F421 N422	L58-L62 WeakPolarHBondContact O-CB 3.44Å; L58-L62 WeakPolarHBondContact O-CG 3.33Å; L58-L62 PolarHBondContact O-N 2.65Å; K60-L62 PolarHBondContact O-N 3.28Å; L62-L67 HydrophobicContact CD2-CB 4.45Å; L62-L67 HydrophobicContact CD2-CD1 4.07Å; L62-F421 HydrophobicContact CD2-CB 3.96Å; L62-N422 HydrophobicContact CD2-CB 4.36Å
63	K	94.5	Very high	92.6	Very high	128 Å²	128	32.3 Å²	32.3	56%	0.557	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-12.2	174.1	-68.8	175.3	-178.1	-178.1	0	113.2	T59 K60 L61 V172	T59-K63 WeakPolarHBondContact O-CG 3.49Å; K60-K63 PolarHBondContact O-N 2.93Å; L61-K63 PolarHBondContact O-N 3.04Å; L61-K63 VanDerWaalsContact O-N 3.17Å; K63-V172 HydrophobicContact CG-CG2 4.33Å
64	K	91.4	Very high	92.3	Very high	16 Å²	16	29.5 Å²	29.5	7%	0.07	15%	0.153	C	C	.	.	S	Bend	trans	-71.9	151.8	178.8	-61	-162.6	-179	-171.8	0	110.9	L61 C66 L67 R68 D317 T318 D321	L61-K64 HydrophobicContact CD1-CD 4.29Å; L61-K64 WeakPolarHBondContact O-CB 3.38Å; L61-K64 PolarHBondContact O-N 3.28Å; L61-K64 VanDerWaalsContact O-N 3.09Å; K64-C66 PolarHBondContact O-N 3.02Å; K64-C66 VanDerWaalsContact O-N 3.11Å; K64-L67 PolarHBondContact O-N 2.86Å; K64-R68 WeakPolarHBondContact O-CB 3.34Å; K64-R68 PolarHBondContact O-N 3.01Å; K64-D317 PolarHBondContact NZ-O 3.22Å; K64-D317 IonicContact NZ-OD2 3.79Å; K64-D317 PolarHBondContact NZ-OD2 2.77Å; K64-T318 HydrophobicContact CD-CG2 4.4Å; K64-T318 WeakPolarHBondContact CD-OG1 3.08Å; K64-D321 WeakPolarHBondContact CE-OD2 3.26Å; K64-D321 IonicContact NZ-OD2 3.73Å; K64-D321 PolarHBondContact NZ-OD2 3.05Å
65	D	86.8	Confident	91.9	Very high	40 Å²	40	36.2 Å²	36.2	21%	0.214	19%	0.185	C	C	.	.	H	α-helix	trans	-59.9	-29.5	-174.7	-78.7	-2.4	0	0	0	112.5	L67 R68 Y69 P102 T309 E314	D65-L67 VanDerWaalsContact C-N 3.26Å; D65-L67 PolarHBondContact O-N 3.48Å; D65-R68 WeakPolarHBondContact OD1-CD 3.08Å; D65-R68 IonicContact OD1-NH1 3.32Å; D65-R68 PolarHBondContact OD1-NH1 3.31Å; D65-Y69 HydrophobicContact CB-CE2 4.21Å; D65-Y69 WeakPolarHBondContact O-CD2 3.4Å; D65-P102 HydrophobicContact CB-CG 3.94Å; D65-T309 HydrophobicContact CB-CG2 4.17Å; D65-E314 PolarHBondContact N-OE1 3.36Å
66	C	87	Confident	91.5	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-27.4	178.4	66.4	0	0	0	0	114.3	K64 F307 T309 T318 R414	K64-C66 PolarHBondContact O-N 3.02Å; K64-C66 VanDerWaalsContact O-N 3.11Å; C66-F307 HydrophobicContact CB-CB 4.31Å; C66-F307 HydrophobicContact CB-CD1 4.47Å; C66-F307 WeakPolarHBondContact CB-O 3.14Å; C66-T309 HydrophobicContact CB-CG2 3.72Å; C66-T318 WeakPolarHBondContact SG-CG2 3Å; C66-R414 VanDerWaalsContact CA-NH2 3.34Å; C66-R414 PolarHBondContact O-NH2 3.18Å
67	L	91.7	Very high	91.1	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-120.2	-16.7	-173.8	-70.1	-178.9	0	0	0	114.7	L61 L62 K64 D65 F307 V417 V418 F421 N422	L61-L67 HydrophobicContact CD2-CD1 3.88Å; L61-L67 HydrophobicContact CG-CD1 3.65Å; L62-L67 HydrophobicContact CD2-CB 4.45Å; L62-L67 HydrophobicContact CD2-CD1 4.07Å; K64-L67 PolarHBondContact O-N 2.86Å; D65-L67 VanDerWaalsContact C-N 3.26Å; D65-L67 PolarHBondContact O-N 3.48Å; L67-F307 HydrophobicContact CD2-CE1 4.29Å; L67-V417 HydrophobicContact CD2-CG1 4.39Å; L67-V418 HydrophobicContact CD2-CG2 4.28Å; L67-F421 HydrophobicContact CD1-CB 3.95Å; L67-F421 HydrophobicContact CD1-CD1 3.93Å; L67-F421 HydrophobicContact CD1-CG 4.03Å; L67-F421 HydrophobicContact CD2-CB 4.02Å; L67-F421 HydrophobicContact CD2-CD2 4.48Å; L67-F421 HydrophobicContact CD2-CG 4.24Å; L67-N422 PolarHBondContact O-ND2 2.6Å
68	R	92	Very high	90.9	Very high	48 Å²	48	39.1 Å²	39.1	18%	0.181	19%	0.188	C	C	.	.	H	α-helix	trans	-75.8	-23.8	-178.4	75.5	-176.2	-70.2	-172	-2	113.9	K64 D65 D170 L171 V172	K64-R68 WeakPolarHBondContact O-CB 3.34Å; K64-R68 PolarHBondContact O-N 3.01Å; D65-R68 WeakPolarHBondContact OD1-CD 3.08Å; D65-R68 IonicContact OD1-NH1 3.32Å; D65-R68 PolarHBondContact OD1-NH1 3.31Å; R68-D170 IonicContact CZ-OD1 2.65Å; R68-D170 IonicContact CZ-OD2 2.97Å; R68-D170 IonicContact NE-OD1 2.79Å; R68-D170 PolarHBondContact NE-OD1 3.29Å; R68-D170 IonicContact NE-OD2 2.68Å; R68-D170 VanDerWaalsContact NH2-CG 3.33Å; R68-D170 IonicContact NH2-OD1 3.99Å; R68-D170 PolarHBondContact NH2-OD1 3.15Å; R68-D170 IonicContact NH2-OD2 4Å; R68-D170 PolarHBondContact NH2-OD2 3.14Å; R68-L171 VanDerWaalsContact O-CB 3.27Å; R68-L171 WeakPolarHBondContact O-CB 3.28Å; R68-L171 WeakPolarHBondContact O-CG 3.34Å; R68-L171 PolarHBondContact O-N 3.05Å; R68-V172 HydrophobicContact CB-CG2 3.94Å
69	Y	88.9	Confident	90.6	Very high	9 Å²	9	43 Å²	43	4%	0.035	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	122.4	-176.5	-62.5	-70.5	0	0	0	110.4	D65 V101 F105 V169 D170	D65-Y69 HydrophobicContact CB-CE2 4.21Å; D65-Y69 WeakPolarHBondContact O-CD2 3.4Å; Y69-V101 HydrophobicContact CD1-CG1 3.63Å; Y69-V101 HydrophobicContact CD2-CG1 4.23Å; Y69-V101 HydrophobicContact CE1-CG1 3.92Å; Y69-V101 HydrophobicContact CG-CG1 3.8Å; Y69-F105 AromaticContact CD2-CE2 3.95Å; Y69-F105 HydrophobicContact CD2-CE2 3.95Å; Y69-V169 WeakPolarHBondContact CA-O 3.26Å; Y69-D170 HydrophobicContact CD1-CB 4.1Å; Y69-D170 HydrophobicContact CE1-CB 3.9Å
70	Y	90.1	Very high	90.2	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.7	177.2	-177.8	-119.3	0	0	0	110.4	T72 V169 L377 L381 H384 N415 V418 A419	Y70-T72 HydrophobicContact CD1-CG2 4.15Å; Y70-T72 HydrophobicContact CE1-CG2 4.25Å; Y70-V169 PolarHBondContact N-O 3.4Å; Y70-V169 PolarHBondContact O-N 3.32Å; Y70-L377 HydrophobicContact CD1-CD1 4.09Å; Y70-L381 HydrophobicContact CD1-CB 4.38Å; Y70-L381 HydrophobicContact CD1-CD1 4.19Å; Y70-L381 HydrophobicContact CD2-CD1 4.48Å; Y70-L381 HydrophobicContact CE1-CB 4.13Å; Y70-L381 HydrophobicContact CG-CD1 4.08Å; Y70-H384 AromaticContact CE2-ND1 3.87Å; Y70-H384 AromaticContact CZ-ND1 3.84Å; Y70-H384 PolarHBondContact OH-ND1 3.09Å; Y70-N415 HydrophobicContact CE2-CB 4.32Å; Y70-V418 HydrophobicContact CD2-CB 4.4Å; Y70-V418 HydrophobicContact CD2-CG1 3.85Å; Y70-V418 HydrophobicContact CG-CG1 4.44Å; Y70-A419 HydrophobicContact CE2-CB 4.13Å
71	K	87.7	Confident	89.9	Confident	21 Å²	21	43.3 Å²	43.3	9%	0.091	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.3	-179.1	-144.9	-170.6	179	176	0	109.8	E161 L166 H167 Y168 N415	K71-E161 PolarHBondContact NZ-O 2.84Å; K71-L166 HydrophobicContact CD-CB 3.9Å; K71-L166 HydrophobicContact CD-CD1 4.43Å; K71-L166 WeakPolarHBondContact CE-O 3.35Å; K71-L166 HydrophobicContact CG-CB 3.92Å; K71-H167 CarbonylContact C-O 3.32Å; K71-H167 WeakPolarHBondContact CA-O 3.45Å; K71-Y168 HydrophobicContact CB-CD1 3.96Å; K71-Y168 HydrophobicContact CB-CE1 3.79Å; K71-Y168 HydrophobicContact CD-CE1 4.23Å; K71-Y168 HydrophobicContact CD-CE2 4.03Å; K71-Y168 HydrophobicContact CG-CD1 3.96Å; K71-Y168 HydrophobicContact CG-CD2 4.18Å; K71-Y168 HydrophobicContact CG-CE1 3.85Å; K71-Y168 HydrophobicContact CG-CE2 4.08Å; K71-Y168 HydrophobicContact CG-CG 4.13Å; K71-N415 WeakPolarHBondContact CB-OD1 3.42Å; K71-N415 PolarHBondContact N-OD1 3.12Å; K71-N415 PolarHBondContact O-ND2 3.03Å
72	T	88.3	Confident	89.4	Confident	8 Å²	8	52 Å²	52	5%	0.049	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	152	-178.2	-160.8	0	0	0	0	112.7	Y70 M74 H167 V169 L377	Y70-T72 HydrophobicContact CD1-CG2 4.15Å; Y70-T72 HydrophobicContact CE1-CG2 4.25Å; T72-M74 HydrophobicContact CG2-CG 3.78Å; T72-M74 HydrophobicContact CG2-SD 3.6Å; T72-H167 PolarHBondContact N-O 3.28Å; T72-H167 PolarHBondContact O-N 2.77Å; T72-H167 VanDerWaalsContact O-N 3.09Å; T72-V169 HydrophobicContact CG2-CG2 4.25Å; T72-L377 HydrophobicContact CG2-CD1 3.87Å
73	D	88.9	Confident	88.3	Confident	10 Å²	10	52.4 Å²	52.4	5%	0.053	25%	0.254	C	S	.	.			trans	-90.5	104.9	172.9	177.5	-9.1	0	0	0	107.9	E75 K76 L166 K380	D73-E75 WeakPolarHBondContact OD1-CA 3.38Å; D73-E75 PolarHBondContact OD1-N 2.9Å; D73-K76 PolarHBondContact OD1-N 3.45Å; D73-L166 HydrophobicContact CB-CD2 4.05Å; D73-K380 PolarHBondContact O-NZ 3.01Å
74	M	86.5	Confident	87.1	Confident	22 Å²	22	51.1 Å²	51.1	11%	0.108	25%	0.254	C	S	.	.	S	Bend	trans	-89.7	-5.6	175.2	-64.2	-56.7	-63.8	0	0	112.7	T72 R85 I94 D373 R376 L377	T72-M74 HydrophobicContact CG2-CG 3.78Å; T72-M74 HydrophobicContact CG2-SD 3.6Å; M74-R85 PolarHBondContact O-NH1 2.91Å; M74-R85 VanDerWaalsContact O-NH1 3.15Å; M74-I94 HydrophobicContact CE-CD1 3.84Å; M74-D373 HydrophobicContact CE-CB 4.38Å; M74-D373 WeakPolarHBondContact CE-O 3.07Å; M74-R376 HydrophobicContact CE-CB 3.91Å; M74-R376 HydrophobicContact CE-CG 3.72Å; M74-R376 PolarHBondContact O-NH1 3.14Å; M74-R376 HydrophobicContact SD-CG 4.46Å; M74-L377 HydrophobicContact CE-CB 4.17Å; M74-L377 HydrophobicContact SD-CB 4.32Å; M74-L377 HydrophobicContact SD-CD1 4.43Å
75	E	85.8	Confident	86.1	Confident	140 Å²	140	54.4 Å²	54.4	65%	0.654	27%	0.266	S	S	*	.	S	Bend	trans	-92.5	-20.4	-177.9	-62.2	-157	157.4	0	0	113.1	D73 D77 R85	D73-E75 WeakPolarHBondContact OD1-CA 3.38Å; D73-E75 PolarHBondContact OD1-N 2.9Å; E75-D77 PolarHBondContact O-N 3.3Å; E75-R85 VanDerWaalsContact C-NH2 3.32Å; E75-R85 PolarHBondContact O-NH1 3.18Å; E75-R85 PolarHBondContact O-NH2 3.24Å
76	K	87.2	Confident	85	Confident	50 Å²	50	60.5 Å²	60.5	22%	0.217	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-50.1	126.2	-178.7	-166.6	167.3	175.5	-177.7	0	115.1	D73 R85 D157 D368 R376	D73-K76 PolarHBondContact OD1-N 3.45Å; K76-R85 VanDerWaalsContact C-NH2 3.27Å; K76-R85 PolarHBondContact O-NH2 3.47Å; K76-D157 IonicContact NZ-OD2 3.24Å; K76-D157 PolarHBondContact NZ-OD2 3.05Å; K76-D368 WeakPolarHBondContact CD-OD2 3.48Å; K76-D368 WeakPolarHBondContact CE-OD2 3.36Å; K76-D368 IonicContact NZ-OD2 3.86Å; K76-R376 PolarHBondContact O-NH2 3.01Å
77	D	89.1	Confident	83.9	Confident	132 Å²	132	62.7 Å²	62.7	71%	0.706	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-69.8	152.9	-179.2	-69.7	-43.1	0	0	0	113.8	E75 P79	E75-D77 PolarHBondContact O-N 3.3Å; D77-P79 WeakPolarHBondContact O-CD 3.45Å
78	C	91	Very high	82.5	Confident	19 Å²	19	69.3 Å²	69.3	13%	0.128	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-66.7	122	173.4	173.9	0	0	0	0	110.7	F80 W81 C369	C78-F80 VanDerWaalsContact C-N 3.29Å; C78-F80 PolarHBondContact O-N 3.34Å; C78-W81 WeakPolarHBondContact CB-O 3.19Å; C78-W81 PolarHBondContact SG-N 3.1Å; C78-W81 VanDerWaalsContact SG-N 3.4Å; C78-W81 PolarHBondContact SG-O 3.4Å; C78-C369 VanDerWaalsContact CA-SG 3.59Å; C78-C369 HydrophobicContact CB-CB 3.79Å; C78-C369 WeakPolarHBondContact CB-SG 3.5Å; C78-C369 WeakPolarHBondContact SG-CB 3.46Å; C78-C369 CovalentContact SG-SG 2.02Å; C78-C369 PolarHBondContact SG-SG 3.44Å
79	P	90.4	Very high	81.2	Confident	81 Å²	81	69.2 Å²	69.2	53%	0.526	35%	0.349	S	S	.	.	S	Bend	trans	-78.5	-10.4	-178.1	30.1	-34.7	0	0	0	114	D77 R365	D77-P79 WeakPolarHBondContact O-CD 3.45Å; P79-R365 HydrophobicContact CG-CB 4.24Å
80	F	89.9	Confident	80.1	Confident	100 Å²	100	80 Å²	80	44%	0.439	39%	0.39	S	S	.	.	S	Bend	trans	-106.7	-32.2	-169.5	-57.8	-62.6	0	0	0	114.5	C78 R365 I366	C78-F80 VanDerWaalsContact C-N 3.29Å; C78-F80 PolarHBondContact O-N 3.34Å; F80-R365 HydrophobicContact CE2-CB 4.07Å; F80-R365 HydrophobicContact CZ-CB 4.18Å; F80-I366 HydrophobicContact CD2-CG1 4.11Å; F80-I366 HydrophobicContact CE2-CB 4.31Å; F80-I366 HydrophobicContact CE2-CG1 3.5Å; F80-I366 HydrophobicContact CZ-CG1 4.21Å
81	W	90	Very high	79.1	Confident	53 Å²	53	82 Å²	82	20%	0.201	40%	0.399	C	S	.	.	S	Bend	trans	-154.5	160.7	178	53.4	81.4	0	0	0	110.7	C78 S83 R188 V189 C192 C369	C78-W81 WeakPolarHBondContact CB-O 3.19Å; C78-W81 PolarHBondContact SG-N 3.1Å; C78-W81 VanDerWaalsContact SG-N 3.4Å; C78-W81 PolarHBondContact SG-O 3.4Å; W81-S83 PolarHBondContact O-N 3.2Å; W81-S83 VanDerWaalsContact O-N 3.14Å; W81-R188 HydrophobicContact CH2-CG 4.08Å; W81-R188 HydrophobicContact CZ2-CG 4.06Å; W81-R188 HydrophobicContact CZ3-CG 4.44Å; W81-V189 HydrophobicContact CZ2-CG2 4.22Å; W81-C192 HydrophobicContact CH2-CB 4.3Å; W81-C192 VanDerWaalsContact CZ3-SG 3.59Å; W81-C369 HydrophobicContact CH2-CB 4.1Å; W81-C369 HydrophobicContact CZ2-CB 3.39Å
82	Q	83.5	Confident	78.3	Confident	186 Å²	186	81.5 Å²	81.5	87%	0.869	40%	0.398	S	S	*	.			trans	-66	115.5	168.8	-72.8	178.2	-10.7	0	0	109
83	S	73.1	Confident	77.4	Confident	30 Å²	30	82.3 Å²	82.3	21%	0.21	41%	0.408	C	S	.	.			trans	-104.1	126.5	172.3	153.2	0	0	0	0	107.2	W81 D371	W81-S83 PolarHBondContact O-N 3.2Å; W81-S83 VanDerWaalsContact O-N 3.14Å; S83-D371 WeakPolarHBondContact CB-OD1 3.39Å; S83-D371 PolarHBondContact OG-OD1 3.15Å
84	N	70.1	Confident	76.7	Confident	101 Å²	101	83.5 Å²	83.5	54%	0.54	41%	0.414	S	S	.	.			trans	-96.3	101.2	169.8	-67.3	-13.8	0	0	0	107.1	Y86	N84-Y86 HydrophobicContact CB-CD2 3.67Å; N84-Y86 HydrophobicContact CB-CE2 3.17Å; N84-Y86 WeakPolarHBondContact O-CD2 3.35Å; N84-Y86 PolarHBondContact O-N 2.95Å
85	R	69.3	Low	75.9	Confident	85 Å²	85	89.9 Å²	89.9	32%	0.321	44%	0.444	S	S	.	.			trans	-63	109.7	176.1	-64.7	-170.9	-170	147.5	12.9	109.4	M74 E75 K76	M74-R85 PolarHBondContact O-NH1 2.91Å; M74-R85 VanDerWaalsContact O-NH1 3.15Å; E75-R85 VanDerWaalsContact C-NH2 3.32Å; E75-R85 PolarHBondContact O-NH1 3.18Å; E75-R85 PolarHBondContact O-NH2 3.24Å; K76-R85 VanDerWaalsContact C-NH2 3.27Å; K76-R85 PolarHBondContact O-NH2 3.47Å
86	Y	64.9	Low	75.4	Confident	169 Å²	169	87.1 Å²	87.1	66%	0.663	43%	0.433	S	S	*	.			trans	-126.4	95.7	175.8	-69.8	-65.8	0	0	0	109.3	N84	N84-Y86 HydrophobicContact CB-CD2 3.67Å; N84-Y86 HydrophobicContact CB-CE2 3.17Å; N84-Y86 WeakPolarHBondContact O-CD2 3.35Å; N84-Y86 PolarHBondContact O-N 2.95Å
87	C	64.7	Low	75	Confident	47 Å²	47	85.2 Å²	85.2	32%	0.318	43%	0.426	S	S	.	.			trans	-93.7	100.6	165	177.6	0	0	0	0	109.4	S89 C92 G93	C87-S89 PolarHBondContact SG-O 2.97Å; C87-C92 WeakPolarHBondContact CA-SG 3.37Å; C87-C92 HydrophobicContact CB-CB 4.13Å; C87-C92 WeakPolarHBondContact CB-SG 3.39Å; C87-C92 VanDerWaalsContact SG-CA 3.57Å; C87-C92 WeakPolarHBondContact SG-CB 3.47Å; C87-C92 CovalentContact SG-SG 2.04Å; C87-C92 PolarHBondContact SG-SG 2.83Å; C87-G93 PolarHBondContact SG-N 3.2Å
88	T	61.5	Low	74.3	Confident	140 Å²	140	81.3 Å²	81.3	86%	0.859	41%	0.405	S	S	*	.			trans	-90.6	-7.5	-177.5	52.4	0	0	0	0	113.9
89	S	64.3	Low	73.7	Confident	46 Å²	46	87.5 Å²	87.5	32%	0.322	44%	0.437	S	S	.	.	S	Bend	trans	-122.3	149	-178.7	76	0	0	0	0	110.9	C87 E91 C92	C87-S89 PolarHBondContact SG-O 2.97Å; S89-E91 PolarHBondContact O-N 2.95Å; S89-E91 PolarHBondContact OG-N 3.46Å; S89-C92 PolarHBondContact O-N 3.09Å; S89-C92 PolarHBondContact O-SG 2.79Å; S89-C92 PolarHBondContact OG-N 2.79Å; S89-C92 PolarHBondContact OG-SG 2.77Å
90	R	65.7	Low	73.2	Confident	237 Å²	237	88 Å²	88	89%	0.894	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-20.1	169.6	-66.9	-176.2	178.4	-176.6	-1.7	112.3
91	E	69.8	Low	72.4	Confident	46 Å²	46	83.5 Å²	83.5	22%	0.215	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-18.7	-176.5	-58.1	-52.1	147.4	0	0	114.5	S89 R177 W257 K374	S89-E91 PolarHBondContact O-N 2.95Å; S89-E91 PolarHBondContact OG-N 3.46Å; E91-R177 IonicContact OE2-CZ 2.84Å; E91-R177 IonicContact OE2-NE 3.33Å; E91-R177 IonicContact OE2-NH2 2.67Å; E91-R177 PolarHBondContact OE2-NH2 2.91Å; E91-W257 HydrophobicContact CG-CZ2 4.43Å; E91-W257 WeakPolarHBondContact OE2-CZ2 3.48Å; E91-K374 VanDerWaalsContact O-CD 3.22Å; E91-K374 WeakPolarHBondContact O-CD 3.49Å; E91-K374 WeakPolarHBondContact O-CE 3.42Å; E91-K374 PolarHBondContact O-NZ 3.19Å
92	C	69.8	Low	71.8	Confident	9 Å²	9	82 Å²	82	6%	0.061	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-18.1	179	48.7	0	0	0	0	114.8	C87 S89 D373 K374	C87-C92 WeakPolarHBondContact CA-SG 3.37Å; C87-C92 HydrophobicContact CB-CB 4.13Å; C87-C92 WeakPolarHBondContact CB-SG 3.39Å; C87-C92 VanDerWaalsContact SG-CA 3.57Å; C87-C92 WeakPolarHBondContact SG-CB 3.47Å; C87-C92 CovalentContact SG-SG 2.04Å; C87-C92 PolarHBondContact SG-SG 2.83Å; S89-C92 PolarHBondContact O-N 3.09Å; S89-C92 PolarHBondContact O-SG 2.79Å; S89-C92 PolarHBondContact OG-N 2.79Å; S89-C92 PolarHBondContact OG-SG 2.77Å; C92-D373 WeakPolarHBondContact O-CB 3.37Å; C92-K374 PolarHBondContact O-N 2.88Å
93	G	70.2	Confident	71.3	Confident	26 Å²	26	78.6 Å²	78.6	27%	0.268	40%	0.397	S	S	.	.			trans	-79.7	154.2	-172.5	0	0	0	0	0	113.3	C87 K374	C87-G93 PolarHBondContact SG-N 3.2Å; G93-K374 WeakPolarHBondContact O-CE 3.43Å
94	I	73.8	Confident	71.3	Confident	34 Å²	34	78.4 Å²	78.4	17%	0.174	40%	0.397	C	S	.	.			trans	-125	145.2	176	-63.2	166.2	0	0	0	108.5	M74 V169 D373 K374 L377	M74-I94 HydrophobicContact CE-CD1 3.84Å; I94-V169 HydrophobicContact CG2-CB 4.43Å; I94-V169 HydrophobicContact CG2-CG1 3.5Å; I94-V169 HydrophobicContact CG2-CG2 4.01Å; I94-D373 HydrophobicContact CD1-CB 3.85Å; I94-D373 WeakPolarHBondContact CD1-O 3.43Å; I94-D373 HydrophobicContact CG1-CB 4.08Å; I94-K374 HydrophobicContact CD1-CG 4.3Å; I94-K374 HydrophobicContact CG1-CG 3.78Å; I94-L377 HydrophobicContact CD1-CB 3.48Å; I94-L377 VanDerWaalsContact CD1-CB 3.48Å; I94-L377 HydrophobicContact CD1-CD2 3.73Å; I94-L377 HydrophobicContact CD1-CG 4.14Å; I94-L377 HydrophobicContact CG1-CD2 4.4Å
95	E	71	Confident	71.4	Confident	157 Å²	157	74 Å²	74	73%	0.734	37%	0.373	S	S	*	.			trans	-111.7	139.9	170.8	-68.4	177.1	177.8	0	0	110.6
96	N	74.3	Confident	71.3	Confident	82 Å²	82	74.6 Å²	74.6	44%	0.439	38%	0.378	S	S	.	.			trans	-71.7	145.8	171.3	-64.7	-12.5	0	0	0	109.5	H167	N96-H167 HydrophobicContact CB-CB 4.26Å
97	C	78.8	Confident	70.9	Confident	10 Å²	10	72.6 Å²	72.6	7%	0.068	37%	0.37	C	S	.	.			trans	-133	30	-175	66.7	0	0	0	0	113.4	D99 E100 V101 Y168 D170	C97-D99 PolarHBondContact O-N 3.4Å; C97-E100 HydrophobicContact CB-CB 4.4Å; C97-E100 PolarHBondContact O-N 3.01Å; C97-V101 PolarHBondContact O-N 3.43Å; C97-Y168 PolarHBondContact N-O 3.49Å; C97-Y168 PolarHBondContact SG-O 3.1Å; C97-D170 PolarHBondContact SG-N 2.86Å
98	D	75	Confident	70.1	Confident	50 Å²	50	73.7 Å²	73.7	27%	0.267	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.8	-179.8	-64.9	-42.1	0	0	0	113.5	V101 K106 H167 Y168	D98-V101 WeakPolarHBondContact O-CG2 3.45Å; D98-K106 WeakPolarHBondContact O-CE 3.47Å; D98-K106 PolarHBondContact O-NZ 3.24Å; D98-H167 IonicContact OD2-CE1 2.72Å; D98-H167 IonicContact OD2-CG 2.67Å; D98-H167 IonicContact OD2-ND1 2.66Å; D98-H167 PolarHBondContact OD2-ND1 3.27Å; D98-Y168 WeakPolarHBondContact OD1-CB 2.98Å; D98-Y168 WeakPolarHBondContact OD1-CD2 3.47Å; D98-Y168 PolarHBondContact OD1-N 3.01Å
99	D	78.4	Confident	69.3	Low	148 Å²	148	75.7 Å²	75.7	79%	0.791	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-28.7	176.3	-67.1	-34.2	0	0	0	112.8	C97 K106	C97-D99 PolarHBondContact O-N 3.4Å; D99-K106 PolarHBondContact O-NZ 2.79Å
100	E	78.5	Confident	68.1	Low	92 Å²	92	84.2 Å²	84.2	43%	0.43	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-13.7	-172.4	-58.5	-172.3	-170.5	0	0	114.2	C97 R173	C97-E100 HydrophobicContact CB-CB 4.4Å; C97-E100 PolarHBondContact O-N 3.01Å; E100-R173 IonicContact OE1-CZ 3.85Å; E100-R173 IonicContact OE1-NH1 2.81Å; E100-R173 PolarHBondContact OE1-NH1 3.49Å; E100-R173 IonicContact OE1-NH2 3.15Å; E100-R173 PolarHBondContact OE1-NH2 2.84Å; E100-R173 IonicContact OE2-CZ 2.77Å; E100-R173 IonicContact OE2-NH1 2.68Å; E100-R173 PolarHBondContact OE2-NH1 3.48Å; E100-R173 VanDerWaalsContact OE2-NH1 3.14Å; E100-R173 IonicContact OE2-NH2 3.33Å; E100-R173 PolarHBondContact OE2-NH2 3.33Å
101	V	74.8	Confident	66.6	Low	6 Å²	6	79.3 Å²	79.3	4%	0.036	39%	0.386	C	S	.	.	S	Bend	trans	-70.4	150.7	-178.5	-61	0	0	0	0	112.6	Y69 C97 D98 I103 F105 K106 Y168	Y69-V101 HydrophobicContact CD1-CG1 3.63Å; Y69-V101 HydrophobicContact CD2-CG1 4.23Å; Y69-V101 HydrophobicContact CE1-CG1 3.92Å; Y69-V101 HydrophobicContact CG-CG1 3.8Å; C97-V101 PolarHBondContact O-N 3.43Å; D98-V101 WeakPolarHBondContact O-CG2 3.45Å; V101-I103 PolarHBondContact O-N 3.11Å; V101-F105 HydrophobicContact CB-CD2 3.95Å; V101-F105 HydrophobicContact CG1-CD2 4.5Å; V101-F105 HydrophobicContact CG2-CB 4.24Å; V101-K106 HydrophobicContact CG2-CG 4.02Å; V101-K106 WeakPolarHBondContact O-CE 3.49Å; V101-Y168 HydrophobicContact CG1-CD1 4.2Å; V101-Y168 HydrophobicContact CG1-CD2 3.98Å; V101-Y168 HydrophobicContact CG1-CG 3.66Å; V101-Y168 HydrophobicContact CG2-CD2 4.02Å; V101-Y168 HydrophobicContact CG2-CE2 4.33Å
102	P	77.1	Confident	65.2	Low	20 Å²	20	81.3 Å²	81.3	13%	0.13	40%	0.401	C	S	.	.			trans	-48.7	137.3	173.4	-28.2	33	0	0	0	112.3	D65 A104 F105 T309	D65-P102 HydrophobicContact CB-CG 3.94Å; P102-A104 PolarHBondContact O-N 3.5Å; P102-A104 VanDerWaalsContact O-N 3.08Å; P102-F105 HydrophobicContact CB-CD1 4.34Å; P102-F105 HydrophobicContact CB-CE1 4.2Å; P102-F105 HydrophobicContact CB-CE2 4.44Å; P102-F105 HydrophobicContact CB-CG 4.45Å; P102-F105 HydrophobicContact CB-CZ 4.23Å; P102-F105 HydrophobicContact CG-CD2 4.37Å; P102-F105 HydrophobicContact CG-CE1 4.31Å; P102-F105 HydrophobicContact CG-CE2 3.92Å; P102-F105 HydrophobicContact CG-CZ 3.84Å; P102-F105 WeakPolarHBondContact O-CB 3.46Å; P102-F105 PolarHBondContact O-N 3.21Å; P102-T309 VanDerWaalsContact CB-O 3.26Å; P102-T309 WeakPolarHBondContact CB-O 3.48Å
103	I	72	Confident	63.6	Low	116 Å²	116	89 Å²	89	60%	0.595	44%	0.437	S	S	*	.	H	α-helix	trans	-55.1	-34.8	-175.2	-67.8	173.3	0	0	0	111.4	V101 F105 K106 Y107	V101-I103 PolarHBondContact O-N 3.11Å; I103-F105 PolarHBondContact O-N 2.79Å; I103-F105 VanDerWaalsContact O-N 3.15Å; I103-K106 PolarHBondContact O-N 2.84Å; I103-Y107 HydrophobicContact CG2-CD2 3.84Å; I103-Y107 HydrophobicContact CG2-CE2 3.27Å; I103-Y107 VanDerWaalsContact O-CD2 3.25Å; I103-Y107 WeakPolarHBondContact O-CD2 3.36Å
104	A	72.9	Confident	61.8	Low	26 Å²	26	94.6 Å²	94.6	22%	0.215	46%	0.46	C	S	.	.	H	α-helix	trans	-56.7	-28.4	176.4	0	0	0	0	0	113.8	P102 Y308 T309	P102-A104 PolarHBondContact O-N 3.5Å; P102-A104 VanDerWaalsContact O-N 3.08Å; A104-Y308 HydrophobicContact CB-CD1 4.09Å; A104-Y308 HydrophobicContact CB-CE1 3.59Å; A104-T309 WeakPolarHBondContact CB-O 2.99Å
105	F	72.2	Confident	59.9	Low	8 Å²	8	96.9 Å²	96.9	4%	0.035	48%	0.484	C	S	.	.	H	α-helix	trans	-77	-25.9	-179.7	-62.2	0.7	0	0	0	112.2	Y69 V101 P102 I103 Y107 Y168 Y308 T309	Y69-F105 AromaticContact CD2-CE2 3.95Å; Y69-F105 HydrophobicContact CD2-CE2 3.95Å; V101-F105 HydrophobicContact CB-CD2 3.95Å; V101-F105 HydrophobicContact CG1-CD2 4.5Å; V101-F105 HydrophobicContact CG2-CB 4.24Å; P102-F105 HydrophobicContact CB-CD1 4.34Å; P102-F105 HydrophobicContact CB-CE1 4.2Å; P102-F105 HydrophobicContact CB-CE2 4.44Å; P102-F105 HydrophobicContact CB-CG 4.45Å; P102-F105 HydrophobicContact CB-CZ 4.23Å; P102-F105 HydrophobicContact CG-CD2 4.37Å; P102-F105 HydrophobicContact CG-CE1 4.31Å; P102-F105 HydrophobicContact CG-CE2 3.92Å; P102-F105 HydrophobicContact CG-CZ 3.84Å; P102-F105 WeakPolarHBondContact O-CB 3.46Å; P102-F105 PolarHBondContact O-N 3.21Å; I103-F105 PolarHBondContact O-N 2.79Å; I103-F105 VanDerWaalsContact O-N 3.15Å; F105-Y107 VanDerWaalsContact C-N 3.32Å; F105-Y168 HydrophobicContact CB-CE2 4.22Å; F105-Y168 HydrophobicContact CD2-CE1 4.21Å; F105-Y308 WeakPolarHBondContact CE1-O 3.16Å; F105-T309 HydrophobicContact CE1-CG2 4.1Å; F105-T309 HydrophobicContact CZ-CG2 3.93Å
106	K	67.9	Low	58.2	Low	97 Å²	97	99.1 Å²	99.1	42%	0.422	49%	0.487	S	S	.	.	H	α-helix	trans	-76.1	-22.3	-179.3	-54.5	-171.1	-169.4	-164.6	0	112.1	D98 D99 V101 I103 T108	D98-K106 WeakPolarHBondContact O-CE 3.47Å; D98-K106 PolarHBondContact O-NZ 3.24Å; D99-K106 PolarHBondContact O-NZ 2.79Å; V101-K106 HydrophobicContact CG2-CG 4.02Å; V101-K106 WeakPolarHBondContact O-CE 3.49Å; I103-K106 PolarHBondContact O-N 2.84Å; K106-T108 PolarHBondContact O-N 2.88Å
107	Y	55.8	Low	56.2	Low	127 Å²	127	106 Å²	106	50%	0.498	51%	0.507	S	S	.	.			trans	-96.4	70.2	-178.8	-64.7	-67.3	0	0	0	112.3	I103 F105 K109	I103-Y107 HydrophobicContact CG2-CD2 3.84Å; I103-Y107 HydrophobicContact CG2-CE2 3.27Å; I103-Y107 VanDerWaalsContact O-CD2 3.25Å; I103-Y107 WeakPolarHBondContact O-CD2 3.36Å; F105-Y107 VanDerWaalsContact C-N 3.32Å; Y107-K109 PolarHBondContact O-N 3.4Å
108	T	49.7	Very low	54	Low	70 Å²	70	110.2 Å²	110.2	43%	0.429	54%	0.537	S	S	.	.			trans	-79.3	108.3	172.9	42.1	0	0	0	0	111.4	K106 Y110	K106-T108 PolarHBondContact O-N 2.88Å; T108-Y110 PolarHBondContact O-N 3.15Å
109	K	43.3	Very low	51.9	Low	183 Å²	183	112.6 Å²	112.6	80%	0.796	56%	0.557	S	S	*	*	S	Bend	trans	63.9	-22	163.1	-79	178.9	178.4	168.9	0	121.7	Y107	Y107-K109 PolarHBondContact O-N 3.4Å
110	Y	38.7	Very low	49.6	Very low	225 Å²	225	117.5 Å²	117.5	88%	0.882	56%	0.564	S	S	*	*	S	Bend	trans	-91	-3.2	-174.6	-83.7	-79.4	0	0	0	117.2	T108	T108-Y110 PolarHBondContact O-N 3.15Å
111	Q	35.7	Very low	47.2	Very low	133 Å²	133	118.7 Å²	118.7	62%	0.621	58%	0.582	S	S	*	*	S	Bend	trans	-131	-1.9	-177.4	-72.1	-175.4	-16.1	0	0	116	Q113	Q111-Q113 VanDerWaalsContact C-N 3.25Å; Q111-Q113 PolarHBondContact O-N 3.08Å
112	V	39.7	Very low	45.1	Very low	88 Å²	88	126.3 Å²	126.3	53%	0.533	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.9	-3.9	-178.1	-173.3	0	0	0	0	112.8	D114	V112-D114 VanDerWaalsContact C-N 3.29Å; V112-D114 PolarHBondContact O-N 3.43Å
113	Q	35.6	Very low	42.9	Very low	172 Å²	172	134.4 Å²	134.4	80%	0.804	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-17.5	178.6	-118.2	166.4	0.5	0	0	114.3	Q111	Q111-Q113 VanDerWaalsContact C-N 3.25Å; Q111-Q113 PolarHBondContact O-N 3.08Å
114	D	32.4	Very low	40.9	Very low	142 Å²	142	133.3 Å²	133.3	76%	0.759	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-12.6	-177	-74.7	-35.6	0	0	0	114.9	V112	V112-D114 VanDerWaalsContact C-N 3.29Å; V112-D114 PolarHBondContact O-N 3.43Å
115	A	33.3	Very low	38.7	Very low	82 Å²	82	139 Å²	139	68%	0.678	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-16	-174.6	0	0	0	0	0	115.2
116	Y	36.7	Very low	36.7	Very low	205 Å²	205	148.4 Å²	148.4	80%	0.804	73%	0.732	S	S	*	*	S	Bend	trans	-107.6	28.8	-174.9	-131.3	-92	0	0	0	114.1
117	R	32.5	Very low	34.9	Very low	227 Å²	227	151.1 Å²	151.1	86%	0.857	75%	0.749	S	S	*	*			trans	-91.9	11.3	173	-107.1	-179.2	178.7	164	-0.5	114.2
118	S	31.5	Very low	34	Very low	98 Å²	98	150.8 Å²	150.8	69%	0.685	76%	0.756	S	S	*	*	S	Bend	trans	-115.4	103.3	-179.9	-170.8	0	0	0	0	112.5
119	S	31.2	Very low	33.3	Very low	99 Å²	99	153.3 Å²	153.3	69%	0.692	77%	0.773	S	S	*	*			trans	43.5	97.5	151.3	74.8	0	0	0	0	119.2
120	R	30.9	Very low	33	Very low	252 Å²	252	151 Å²	151	95%	0.951	77%	0.769	S	S	*	*				-159.7	130	126	-107.5	171.7	-162.9	-173.5	5.8	109.7
121	C	28.2	Very low	33	Very low	117 Å²	117	146 Å²	146	79%	0.791	76%	0.758	S	S	*	*			trans	-78.5	125.6	-172.3	-35.9	0	0	0	0	109.5
122	D	30.3	Very low	33.6	Very low	166 Å²	166	148.9 Å²	148.9	89%	0.888	77%	0.768	S	S	*	*			trans	-119.9	91.9	152.9	-95.2	-25.3	0	0	0	107.6	S124	D122-S124 PolarHBondContact O-N 3.06Å
123	E	29.9	Very low	33.9	Very low	190 Å²	190	149.7 Å²	149.7	89%	0.888	77%	0.773	S	S	*	*			trans	-74.8	92.7	159.9	-75.8	-178.3	153.4	0	0	108.4
124	S	30	Very low	34.8	Very low	92 Å²	92	145 Å²	145	64%	0.643	75%	0.753	S	S	*	*			trans	177	105.5	142	54.6	0	0	0	0	110.3	D122	D122-S124 PolarHBondContact O-N 3.06Å
125	N	28.3	Very low	36.5	Very low	146 Å²	146	142.1 Å²	142.1	78%	0.781	74%	0.741	S	S	*	*			trans	162.6	89	133.5	-77.3	-27.1	0	0	0	108.6	I127	N125-I127 PolarHBondContact O-N 3.37Å
126	E	28.9	Very low	38.1	Very low	206 Å²	206	142 Å²	142	96%	0.963	74%	0.739	S	S	*	*			trans	-61.1	100.9	160.9	-81.1	-175.7	140.3	0	0	109.3
127	I	30.8	Very low	39.6	Very low	153 Å²	153	134.3 Å²	134.3	79%	0.785	72%	0.723	S	S	*	*			trans	-133.3	108	159.8	-58.9	179.4	0	0	0	107.2	N125	N125-I127 PolarHBondContact O-N 3.37Å
128	D	36	Very low	40.6	Very low	120 Å²	120	128.1 Å²	128.1	64%	0.642	70%	0.704	S	S	*	*			trans	46.8	108.8	162.1	-160	6.9	0	0	0	118.3	L130	D128-L130 PolarHBondContact O-N 3.27Å
129	P	36.2	Very low	41.8	Very low	123 Å²	123	129.8 Å²	129.8	80%	0.799	70%	0.695	S	S	*	*			trans	-75.6	79.5	172.2	33.9	-31.3	0	0	0	109.4	D131	P129-D131 PolarHBondContact O-N 2.69Å
130	L	35.9	Very low	43.3	Very low	135 Å²	135	133.9 Å²	133.9	71%	0.707	70%	0.695	S	S	*	*			trans	-58.4	126.6	165.4	-134.3	90.7	0	0	0	108.1	D128 K132	D128-L130 PolarHBondContact O-N 3.27Å; L130-K132 WeakPolarHBondContact O-CG 3.22Å; L130-K132 PolarHBondContact O-N 2.99Å
131	D	38.6	Very low	44.4	Very low	120 Å²	120	128.1 Å²	128.1	64%	0.642	68%	0.677	S	S	*	*			trans	-47.9	113.2	179.3	-173.5	-7.2	0	0	0	111.2	P129 T133	P129-D131 PolarHBondContact O-N 2.69Å; D131-T133 VanDerWaalsContact C-N 3.25Å; D131-T133 VanDerWaalsContact CG-OG1 3.24Å; D131-T133 PolarHBondContact O-N 2.82Å; D131-T133 WeakPolarHBondContact OD1-CB 3.47Å; D131-T133 WeakPolarHBondContact OD1-CG2 3.39Å; D131-T133 PolarHBondContact OD1-N 3.32Å; D131-T133 PolarHBondContact OD1-OG1 3.16Å; D131-T133 PolarHBondContact OD2-OG1 3.21Å
132	K	48.3	Very low	45.7	Very low	193 Å²	193	126 Å²	126	84%	0.839	66%	0.657	S	S	*	*			trans	-84.4	4.9	-178.2	-65.2	-176.4	-178.2	175.2	0	112.7	L130 I134	L130-K132 WeakPolarHBondContact O-CG 3.22Å; L130-K132 PolarHBondContact O-N 2.99Å; K132-I134 PolarHBondContact O-N 2.81Å
133	T	47.2	Very low	46.8	Very low	105 Å²	105	123.4 Å²	123.4	64%	0.644	64%	0.64	S	S	*	*			trans	-79.7	65.1	179.2	63.3	0	0	0	0	111.9	D131 T135	D131-T133 VanDerWaalsContact C-N 3.25Å; D131-T133 VanDerWaalsContact CG-OG1 3.24Å; D131-T133 PolarHBondContact O-N 2.82Å; D131-T133 WeakPolarHBondContact OD1-CB 3.47Å; D131-T133 WeakPolarHBondContact OD1-CG2 3.39Å; D131-T133 PolarHBondContact OD1-N 3.32Å; D131-T133 PolarHBondContact OD1-OG1 3.16Å; D131-T133 PolarHBondContact OD2-OG1 3.21Å; T133-T135 PolarHBondContact O-N 3.32Å
134	I	53.1	Low	48.1	Very low	73 Å²	73	121.3 Å²	121.3	37%	0.374	63%	0.628	S	S	.	*			trans	-76.2	108.5	168.8	-57.7	175.2	0	0	0	107.5	K132 Q138 R139 L142	K132-I134 PolarHBondContact O-N 2.81Å; I134-Q138 HydrophobicContact CG2-CB 3.68Å; I134-R139 HydrophobicContact CG2-CB 3.93Å; I134-L142 HydrophobicContact CD1-CD1 3.85Å; I134-L142 HydrophobicContact CG1-CD1 4.49Å; I134-L142 HydrophobicContact CG2-CD1 3.92Å
135	T	68	Low	48.8	Very low	83 Å²	83	124.6 Å²	124.6	51%	0.509	63%	0.627	S	S	.	*			trans	-58.5	152	172.8	55.2	0	0	0	0	110.7	T133 G137 Q138 R139	T133-T135 PolarHBondContact O-N 3.32Å; T135-G137 PolarHBondContact O-N 2.86Å; T135-Q138 VanDerWaalsContact N-OE1 3.07Å; T135-Q138 WeakPolarHBondContact O-CA 3.44Å; T135-Q138 PolarHBondContact O-N 3.28Å; T135-Q138 VanDerWaalsContact OG1-CD 3.26Å; T135-Q138 VanDerWaalsContact OG1-CG 3.31Å; T135-Q138 WeakPolarHBondContact OG1-CG 3.44Å; T135-Q138 PolarHBondContact OG1-N 3.18Å; T135-Q138 PolarHBondContact OG1-OE1 3.23Å; T135-R139 PolarHBondContact O-N 3.04Å
136	A	68.3	Low	49.8	Very low	78 Å²	78	120.6 Å²	120.6	65%	0.645	61%	0.607	S	S	*	*	H	α-helix	trans	-53.6	-32.9	179.5	0	0	0	0	0	113	R140	A136-R140 PolarHBondContact O-N 3.03Å; A136-R140 VanDerWaalsContact O-N 3.16Å
137	G	66.8	Low	50.9	Low	45 Å²	45	115.4 Å²	115.4	46%	0.464	58%	0.583	S	S	.	*	H	α-helix	trans	-69.9	-37.2	174.2	0	0	0	0	0	114.1	T135 K141	T135-G137 PolarHBondContact O-N 2.86Å; G137-K141 PolarHBondContact O-N 3.1Å
138	Q	53.7	Low	52	Low	96 Å²	96	113.1 Å²	113.1	45%	0.449	57%	0.569	S	S	.	*	H	α-helix	trans	-71.6	-34.6	173.6	-73.6	165.5	-44.8	0	0	111.6	I134 T135 K141 L142	I134-Q138 HydrophobicContact CG2-CB 3.68Å; T135-Q138 VanDerWaalsContact N-OE1 3.07Å; T135-Q138 WeakPolarHBondContact O-CA 3.44Å; T135-Q138 PolarHBondContact O-N 3.28Å; T135-Q138 VanDerWaalsContact OG1-CD 3.26Å; T135-Q138 VanDerWaalsContact OG1-CG 3.31Å; T135-Q138 WeakPolarHBondContact OG1-CG 3.44Å; T135-Q138 PolarHBondContact OG1-N 3.18Å; T135-Q138 PolarHBondContact OG1-OE1 3.23Å; Q138-K141 PolarHBondContact O-N 3.28Å; Q138-L142 WeakPolarHBondContact O-CB 3.43Å; Q138-L142 WeakPolarHBondContact O-CG 3.48Å; Q138-L142 PolarHBondContact O-N 2.93Å
139	R	56.6	Low	52.2	Low	134 Å²	134	111 Å²	111	51%	0.506	56%	0.558	S	S	.	*	H	α-helix	trans	-61.2	-46.6	174.4	-167.1	176.2	-66.6	161.4	0.9	111.3	I134 T135 K141 L142 E143	I134-R139 HydrophobicContact CG2-CB 3.93Å; T135-R139 PolarHBondContact O-N 3.04Å; R139-K141 VanDerWaalsContact C-N 3.29Å; R139-K141 PolarHBondContact O-N 3.1Å; R139-L142 PolarHBondContact O-N 3.23Å; R139-E143 WeakPolarHBondContact O-CB 3.38Å; R139-E143 WeakPolarHBondContact O-CG 3.41Å; R139-E143 PolarHBondContact O-N 3.27Å
140	R	63.2	Low	52.9	Low	185 Å²	185	109.6 Å²	109.6	70%	0.698	54%	0.54	S	S	*	.	H	α-helix	trans	-61.1	-33.4	173.5	-76.3	-177	178.7	-179.7	0	113.7	A136 K144	A136-R140 PolarHBondContact O-N 3.03Å; A136-R140 VanDerWaalsContact O-N 3.16Å; R140-K144 WeakPolarHBondContact O-CB 3.17Å; R140-K144 WeakPolarHBondContact O-CG 3.38Å; R140-K144 PolarHBondContact O-N 3.5Å
141	K	54	Low	53.7	Low	131 Å²	131	110.2 Å²	110.2	57%	0.57	53%	0.533	S	S	*	.	H	α-helix	trans	-71.9	-43	175.2	-75.7	-179.5	179.8	180	0	111.5	G137 Q138 R139 K144 W145	G137-K141 PolarHBondContact O-N 3.1Å; Q138-K141 PolarHBondContact O-N 3.28Å; R139-K141 VanDerWaalsContact C-N 3.29Å; R139-K141 PolarHBondContact O-N 3.1Å; K141-K144 PolarHBondContact O-N 2.8Å; K141-W145 VanDerWaalsContact O-CD1 3.28Å; K141-W145 PolarHBondContact O-N 3.44Å
142	L	55.7	Low	54.3	Low	71 Å²	71	108.3 Å²	108.3	37%	0.372	52%	0.523	S	S	.	.	H	α-helix	trans	-64.8	-38.9	175.5	-73.7	165.5	0	0	0	111.7	I134 Q138 R139 W145 T146	I134-L142 HydrophobicContact CD1-CD1 3.85Å; I134-L142 HydrophobicContact CG1-CD1 4.49Å; I134-L142 HydrophobicContact CG2-CD1 3.92Å; Q138-L142 WeakPolarHBondContact O-CB 3.43Å; Q138-L142 WeakPolarHBondContact O-CG 3.48Å; Q138-L142 PolarHBondContact O-N 2.93Å; R139-L142 PolarHBondContact O-N 3.23Å; L142-W145 HydrophobicContact CD2-CE3 3.94Å; L142-W145 HydrophobicContact CD2-CZ3 4.24Å; L142-W145 PolarHBondContact O-N 3.29Å; L142-T146 WeakPolarHBondContact O-CB 3.34Å; L142-T146 PolarHBondContact O-N 2.84Å; L142-T146 PolarHBondContact O-OG1 2.94Å
143	E	53.8	Low	54.6	Low	112 Å²	112	100.9 Å²	100.9	52%	0.523	49%	0.492	S	S	.	.	H	α-helix	trans	-60.4	-48.9	170.8	-76.4	164.3	-174.7	0	0	110.7	R139 W145 T146 E147	R139-E143 WeakPolarHBondContact O-CB 3.38Å; R139-E143 WeakPolarHBondContact O-CG 3.41Å; R139-E143 PolarHBondContact O-N 3.27Å; E143-W145 VanDerWaalsContact C-N 3.3Å; E143-W145 PolarHBondContact O-N 3.31Å; E143-T146 PolarHBondContact O-N 3.29Å; E143-E147 WeakPolarHBondContact O-CB 3.37Å; E143-E147 PolarHBondContact O-N 2.92Å
144	K	56	Low	55.3	Low	146 Å²	146	98.1 Å²	98.1	64%	0.635	48%	0.475	S	S	*	.	H	α-helix	trans	-60	-36.7	174.6	-83.7	-173.3	174.2	-172	0	113.6	R140 K141 H148	R140-K144 WeakPolarHBondContact O-CB 3.17Å; R140-K144 WeakPolarHBondContact O-CG 3.38Å; R140-K144 PolarHBondContact O-N 3.5Å; K141-K144 PolarHBondContact O-N 2.8Å; K144-H148 WeakPolarHBondContact O-CB 3.4Å; K144-H148 PolarHBondContact O-N 3.13Å
145	W	46.4	Very low	55.8	Low	162 Å²	162	95 Å²	95	61%	0.614	46%	0.459	S	S	*	.	H	α-helix	trans	-71.2	-41.6	176.6	-65.5	-8.7	0	0	0	111.2	K141 L142 E143 H148 D149	K141-W145 VanDerWaalsContact O-CD1 3.28Å; K141-W145 PolarHBondContact O-N 3.44Å; L142-W145 HydrophobicContact CD2-CE3 3.94Å; L142-W145 HydrophobicContact CD2-CZ3 4.24Å; L142-W145 PolarHBondContact O-N 3.29Å; E143-W145 VanDerWaalsContact C-N 3.3Å; E143-W145 PolarHBondContact O-N 3.31Å; W145-H148 PolarHBondContact O-N 3.49Å; W145-D149 VanDerWaalsContact O-CB 3.3Å; W145-D149 WeakPolarHBondContact O-CB 3.48Å; W145-D149 VanDerWaalsContact O-CG 3.25Å; W145-D149 PolarHBondContact O-N 3.41Å
146	T	48.9	Very low	55.3	Low	62 Å²	62	91.3 Å²	91.3	38%	0.38	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-45.6	174.7	-52.9	0	0	0	0	110.2	L142 E143 H148 D149 E150	L142-T146 WeakPolarHBondContact O-CB 3.34Å; L142-T146 PolarHBondContact O-N 2.84Å; L142-T146 PolarHBondContact O-OG1 2.94Å; E143-T146 PolarHBondContact O-N 3.29Å; T146-H148 VanDerWaalsContact C-N 3.32Å; T146-H148 PolarHBondContact O-N 2.94Å; T146-D149 PolarHBondContact O-N 2.88Å; T146-E150 HydrophobicContact CG2-CG 4.2Å; T146-E150 WeakPolarHBondContact CG2-OE1 3.48Å; T146-E150 VanDerWaalsContact O-CB 3.28Å; T146-E150 WeakPolarHBondContact O-CB 3.42Å; T146-E150 VanDerWaalsContact O-CG 3.26Å; T146-E150 WeakPolarHBondContact O-CG 3.2Å; T146-E150 PolarHBondContact O-N 3.13Å
147	E	51.6	Low	55.3	Low	96 Å²	96	89.7 Å²	89.7	45%	0.449	42%	0.416	S	S	.	.	H	α-helix	trans	-66	-31.7	176.7	-163.6	-157.9	148.3	0	0	112.8	E143 R151	E143-E147 WeakPolarHBondContact O-CB 3.37Å; E143-E147 PolarHBondContact O-N 2.92Å; E147-R151 WeakPolarHBondContact O-CB 3.33Å; E147-R151 WeakPolarHBondContact O-CG 3.39Å; E147-R151 PolarHBondContact O-N 2.97Å; E147-R151 PolarHBondContact O-NE 2.68Å; E147-R151 IonicContact OE1-CZ 2.67Å; E147-R151 VanDerWaalsContact OE1-CZ 3.29Å; E147-R151 IonicContact OE1-NH1 3.2Å; E147-R151 IonicContact OE1-NH2 3.32Å; E147-R151 PolarHBondContact OE1-NH2 2.81Å; E147-R151 IonicContact OE2-NH2 3.42Å
148	H	52.7	Low	55.1	Low	106 Å²	106	89.8 Å²	89.8	49%	0.491	41%	0.408	S	S	.	.	H	α-helix	trans	-71.3	-45.1	172	-177.4	75.7	0	0	0	111.1	K144 W145 T146 R151 L152	K144-H148 WeakPolarHBondContact O-CB 3.4Å; K144-H148 PolarHBondContact O-N 3.13Å; W145-H148 PolarHBondContact O-N 3.49Å; T146-H148 VanDerWaalsContact C-N 3.32Å; T146-H148 PolarHBondContact O-N 2.94Å; H148-R151 PolarHBondContact O-N 3.33Å; H148-L152 WeakPolarHBondContact O-CG 3.21Å; H148-L152 PolarHBondContact O-N 3.17Å
149	D	40.2	Very low	55.3	Low	75 Å²	75	87.4 Å²	87.4	40%	0.401	40%	0.397	S	S	.	.	H	α-helix	trans	-72.4	-36.1	-176.4	-73.2	-21	0	0	0	112.7	W145 T146 L152	W145-D149 VanDerWaalsContact O-CB 3.3Å; W145-D149 WeakPolarHBondContact O-CB 3.48Å; W145-D149 VanDerWaalsContact O-CG 3.25Å; W145-D149 PolarHBondContact O-N 3.41Å; T146-D149 PolarHBondContact O-N 2.88Å; D149-L152 PolarHBondContact O-N 3.27Å
150	E	51.3	Low	55.6	Low	94 Å²	94	86.5 Å²	86.5	44%	0.439	40%	0.402	S	S	.	.	H	α-helix	trans	-65.6	-39.4	173.8	-75.9	176.1	169.9	0	0	111.1	T146 L152 D153 V154	T146-E150 HydrophobicContact CG2-CG 4.2Å; T146-E150 WeakPolarHBondContact CG2-OE1 3.48Å; T146-E150 VanDerWaalsContact O-CB 3.28Å; T146-E150 WeakPolarHBondContact O-CB 3.42Å; T146-E150 VanDerWaalsContact O-CG 3.26Å; T146-E150 WeakPolarHBondContact O-CG 3.2Å; T146-E150 PolarHBondContact O-N 3.13Å; E150-L152 PolarHBondContact O-N 3.4Å; E150-D153 PolarHBondContact O-N 3.4Å; E150-V154 VanDerWaalsContact O-CG2 3.27Å; E150-V154 WeakPolarHBondContact O-CG2 3.44Å
151	R	52.6	Low	55.6	Low	148 Å²	148	79.4 Å²	79.4	56%	0.558	38%	0.377	S	S	*	.	H	α-helix	trans	-62.4	-23.9	174.4	-87.3	-175.5	-76.3	-155	-10.1	113.9	E147 H148	E147-R151 WeakPolarHBondContact O-CB 3.33Å; E147-R151 WeakPolarHBondContact O-CG 3.39Å; E147-R151 PolarHBondContact O-N 2.97Å; E147-R151 PolarHBondContact O-NE 2.68Å; E147-R151 IonicContact OE1-CZ 2.67Å; E147-R151 VanDerWaalsContact OE1-CZ 3.29Å; E147-R151 IonicContact OE1-NH1 3.2Å; E147-R151 IonicContact OE1-NH2 3.32Å; E147-R151 PolarHBondContact OE1-NH2 2.81Å; E147-R151 IonicContact OE2-NH2 3.42Å; H148-R151 PolarHBondContact O-N 3.33Å
152	L	52	Low	55.9	Low	79 Å²	79	76.6 Å²	76.6	41%	0.414	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-19.5	-179.2	-68.5	171.5	0	0	0	113.6	H148 D149 E150	H148-L152 WeakPolarHBondContact O-CG 3.21Å; H148-L152 PolarHBondContact O-N 3.17Å; D149-L152 PolarHBondContact O-N 3.27Å; E150-L152 PolarHBondContact O-N 3.4Å
153	D	55	Low	56.6	Low	38 Å²	38	74.6 Å²	74.6	20%	0.203	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	26.8	-172.9	-78.4	-60.3	0	0	0	113	E150 Y155 K353 K408	E150-D153 PolarHBondContact O-N 3.4Å; D153-Y155 WeakPolarHBondContact O-CD2 3.35Å; D153-K353 IonicContact OD1-NZ 3.58Å; D153-K353 PolarHBondContact OD1-NZ 3.09Å; D153-K408 IonicContact OD2-NZ 2.66Å; D153-K408 PolarHBondContact OD2-NZ 3.46Å
154	V	60.5	Low	57.6	Low	47 Å²	47	78.1 Å²	78.1	29%	0.285	38%	0.382	S	S	.	.			trans	-83.4	113.8	179.6	-177.9	0	0	0	0	111.3	E150 C156 R357 L361	E150-V154 VanDerWaalsContact O-CG2 3.27Å; E150-V154 WeakPolarHBondContact O-CG2 3.44Å; V154-C156 WeakPolarHBondContact CG1-O 3.36Å; V154-R357 WeakPolarHBondContact O-CD 3.38Å; V154-R357 WeakPolarHBondContact O-CG 3.36Å; V154-R357 PolarHBondContact O-NH1 3.09Å; V154-L361 HydrophobicContact CG1-CD1 4.32Å
155	Y	64.7	Low	58.8	Low	8 Å²	8	77.2 Å²	77.2	3%	0.031	38%	0.378	C	S	.	.			trans	-91.9	-17.2	178.2	-78.6	-106.2	0	0	0	113.7	D153 K353 R357 F360 L361 L390 K391	D153-Y155 WeakPolarHBondContact O-CD2 3.35Å; Y155-K353 WeakPolarHBondContact OH-CE 3.41Å; Y155-K353 WeakPolarHBondContact OH-CG 3.49Å; Y155-R357 HydrophobicContact CD1-CB 3.93Å; Y155-R357 HydrophobicContact CD1-CG 4.02Å; Y155-R357 HydrophobicContact CD2-CB 4.47Å; Y155-R357 HydrophobicContact CD2-CG 3.81Å; Y155-R357 HydrophobicContact CE1-CB 3.77Å; Y155-R357 HydrophobicContact CE1-CG 4.17Å; Y155-R357 HydrophobicContact CE2-CB 4.33Å; Y155-R357 HydrophobicContact CE2-CG 3.97Å; Y155-R357 HydrophobicContact CG-CB 4.28Å; Y155-R357 HydrophobicContact CG-CG 3.84Å; Y155-F360 CarbonylContact O-C 3.57Å; Y155-F360 VanDerWaalsContact O-CB 3.24Å; Y155-F360 WeakPolarHBondContact O-CB 3.15Å; Y155-L361 WeakPolarHBondContact O-CA 3.49Å; Y155-L361 PolarHBondContact O-N 3.29Å; Y155-L390 HydrophobicContact CD1-CB 4.37Å; Y155-L390 HydrophobicContact CE1-CB 4.11Å; Y155-K391 HydrophobicContact CD2-CB 3.56Å; Y155-K391 HydrophobicContact CD2-CD 4.15Å; Y155-K391 HydrophobicContact CD2-CG 3.88Å; Y155-K391 HydrophobicContact CE2-CB 3.46Å; Y155-K391 VanDerWaalsContact CE2-CB 3.46Å; Y155-K391 HydrophobicContact CE2-CD 4.42Å; Y155-K391 HydrophobicContact CE2-CG 3.69Å; Y155-K391 HydrophobicContact CG-CB 4.17Å
156	C	58.4	Low	60.5	Low	4 Å²	4	69.9 Å²	69.9	3%	0.027	35%	0.351	C	S	.	.	S	Bend	trans	-138.1	149.2	-176.9	-60.7	0	0	0	0	108.9	V154 V158 H384	V154-C156 WeakPolarHBondContact CG1-O 3.36Å; C156-V158 HydrophobicContact CB-CG2 3.61Å; C156-V158 PolarHBondContact O-N 3.37Å; C156-H384 VanDerWaalsContact SG-CA 3.53Å
157	D	66.6	Low	62.2	Low	44 Å²	44	69.3 Å²	69.3	24%	0.235	34%	0.344	C	S	.	.			trans	-80.8	58.7	-176.3	-162.9	31.7	0	0	0	109.9	K76 L361 S364 R365	K76-D157 IonicContact NZ-OD2 3.24Å; K76-D157 PolarHBondContact NZ-OD2 3.05Å; D157-L361 HydrophobicContact CB-CD1 3.76Å; D157-S364 PolarHBondContact N-OG 3.35Å; D157-R365 HydrophobicContact CB-CG 3.87Å; D157-R365 IonicContact OD1-NH2 2.73Å; D157-R365 WeakPolarHBondContact OD2-CG 3.19Å; D157-R365 IonicContact OD2-NE 3.61Å; D157-R365 PolarHBondContact OD2-NE 3.32Å
158	V	62.6	Low	63.8	Low	47 Å²	47	65.4 Å²	65.4	29%	0.285	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-87.8	123.9	178	-154.7	0	0	0	0	106.5	C156	C156-V158 HydrophobicContact CB-CG2 3.61Å; C156-V158 PolarHBondContact O-N 3.37Å
159	E	59.4	Low	65.5	Low	47 Å²	47	60.4 Å²	60.4	22%	0.22	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-63.2	157.3	171.1	-57.1	-165.2	158	0	0	109.5	E161 S163 L166	E159-E161 PolarHBondContact O-N 3.07Å; E159-S163 WeakPolarHBondContact OE2-CB 3.49Å; E159-S163 PolarHBondContact OE2-OG 3.42Å; E159-L166 HydrophobicContact CB-CD1 4.09Å; E159-L166 HydrophobicContact CB-CD2 4.27Å; E159-L166 HydrophobicContact CB-CG 4.21Å
160	D	62	Low	67.8	Low	115 Å²	115	56.9 Å²	56.9	62%	0.615	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-51.8	134.1	170.7	-179.5	0.4	0	0	0	108.7	S162 S163 L166	D160-S162 PolarHBondContact O-N 2.69Å; D160-S162 PolarHBondContact OD1-N 2.87Å; D160-S162 PolarHBondContact OD1-OG 3.08Å; D160-S162 PolarHBondContact OD2-OG 2.67Å; D160-S163 VanDerWaalsContact O-CB 3.26Å; D160-S163 WeakPolarHBondContact O-CB 3.4Å; D160-S163 PolarHBondContact O-N 2.86Å; D160-L166 WeakPolarHBondContact O-CD1 3.41Å
161	E	62.7	Low	69.7	Low	35 Å²	35	52.8 Å²	52.8	16%	0.164	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-18.2	179.8	-70.9	-170.6	167.7	0	0	112.2	K71 E159 Q413 R414 N415	K71-E161 PolarHBondContact NZ-O 2.84Å; E159-E161 PolarHBondContact O-N 3.07Å; E161-Q413 WeakPolarHBondContact OE1-CB 3.49Å; E161-R414 PolarHBondContact OE1-N 3.14Å; E161-N415 WeakPolarHBondContact OE1-CB 3.44Å; E161-N415 PolarHBondContact OE1-N 3.16Å
162	S	60.1	Low	71.5	Confident	73 Å²	73	49.1 Å²	49.1	51%	0.51	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-11.7	173.4	75.7	0	0	0	0	115.4	D160 E164	D160-S162 PolarHBondContact O-N 2.69Å; D160-S162 PolarHBondContact OD1-N 2.87Å; D160-S162 PolarHBondContact OD1-OG 3.08Å; D160-S162 PolarHBondContact OD2-OG 2.67Å; S162-E164 PolarHBondContact O-N 2.98Å
163	S	71.6	Confident	73.1	Confident	28 Å²	28	52 Å²	52	20%	0.196	26%	0.264	C	S	.	.			trans	-62	131.2	-179.2	-179.8	0	0	0	0	111.6	E159 D160 K165 L166	E159-S163 WeakPolarHBondContact OE2-CB 3.49Å; E159-S163 PolarHBondContact OE2-OG 3.42Å; D160-S163 VanDerWaalsContact O-CB 3.26Å; D160-S163 WeakPolarHBondContact O-CB 3.4Å; D160-S163 PolarHBondContact O-N 2.86Å; S163-K165 PolarHBondContact O-N 3.32Å; S163-K165 PolarHBondContact OG-N 2.93Å; S163-L166 PolarHBondContact O-N 3.02Å
164	E	74.9	Confident	74.7	Confident	187 Å²	187	50.8 Å²	50.8	87%	0.874	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-13.6	176.1	-65.4	-178.1	173	0	0	113	S162	S162-E164 PolarHBondContact O-N 2.98Å
165	K	81.7	Confident	76.3	Confident	126 Å²	126	50.7 Å²	50.7	55%	0.548	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-13.8	177.9	-57.7	-178.9	-178.5	177.4	0	113.7	S163 H167	S163-K165 PolarHBondContact O-N 3.32Å; S163-K165 PolarHBondContact OG-N 2.93Å; K165-H167 PolarHBondContact O-CD2 2.93Å
166	L	81.7	Confident	77.7	Confident	9 Å²	9	51 Å²	51	5%	0.047	26%	0.259	C	S	.	.			trans	-86.7	120.1	-178.7	-68.9	172.9	0	0	0	109.6	K71 D73 E159 D160 S163	K71-L166 HydrophobicContact CD-CB 3.9Å; K71-L166 HydrophobicContact CD-CD1 4.43Å; K71-L166 WeakPolarHBondContact CE-O 3.35Å; K71-L166 HydrophobicContact CG-CB 3.92Å; D73-L166 HydrophobicContact CB-CD2 4.05Å; E159-L166 HydrophobicContact CB-CD1 4.09Å; E159-L166 HydrophobicContact CB-CD2 4.27Å; E159-L166 HydrophobicContact CB-CG 4.21Å; D160-L166 WeakPolarHBondContact O-CD1 3.41Å; S163-L166 PolarHBondContact O-N 3.02Å
167	H	84.5	Confident	79.3	Confident	50 Å²	50	53.7 Å²	53.7	23%	0.231	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	147.2	177.1	-64.9	-73.5	0	0	0	110.9	K71 T72 N96 D98 K165	K71-H167 CarbonylContact C-O 3.32Å; K71-H167 WeakPolarHBondContact CA-O 3.45Å; T72-H167 PolarHBondContact N-O 3.28Å; T72-H167 PolarHBondContact O-N 2.77Å; T72-H167 VanDerWaalsContact O-N 3.09Å; N96-H167 HydrophobicContact CB-CB 4.26Å; D98-H167 IonicContact OD2-CE1 2.72Å; D98-H167 IonicContact OD2-CG 2.67Å; D98-H167 IonicContact OD2-ND1 2.66Å; D98-H167 PolarHBondContact OD2-ND1 3.27Å; K165-H167 PolarHBondContact O-CD2 2.93Å
168	Y	85.6	Confident	80.3	Confident	14 Å²	14	55 Å²	55	6%	0.055	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	134.7	172.6	-74.6	-77.5	0	0	0	111.1	K71 C97 D98 V101 F105	K71-Y168 HydrophobicContact CB-CD1 3.96Å; K71-Y168 HydrophobicContact CB-CE1 3.79Å; K71-Y168 HydrophobicContact CD-CE1 4.23Å; K71-Y168 HydrophobicContact CD-CE2 4.03Å; K71-Y168 HydrophobicContact CG-CD1 3.96Å; K71-Y168 HydrophobicContact CG-CD2 4.18Å; K71-Y168 HydrophobicContact CG-CE1 3.85Å; K71-Y168 HydrophobicContact CG-CE2 4.08Å; K71-Y168 HydrophobicContact CG-CG 4.13Å; C97-Y168 PolarHBondContact N-O 3.49Å; C97-Y168 PolarHBondContact SG-O 3.1Å; D98-Y168 WeakPolarHBondContact OD1-CB 2.98Å; D98-Y168 WeakPolarHBondContact OD1-CD2 3.47Å; D98-Y168 PolarHBondContact OD1-N 3.01Å; V101-Y168 HydrophobicContact CG1-CD1 4.2Å; V101-Y168 HydrophobicContact CG1-CD2 3.98Å; V101-Y168 HydrophobicContact CG1-CG 3.66Å; V101-Y168 HydrophobicContact CG2-CD2 4.02Å; V101-Y168 HydrophobicContact CG2-CE2 4.33Å; F105-Y168 HydrophobicContact CB-CE2 4.22Å; F105-Y168 HydrophobicContact CD2-CE1 4.21Å
169	V	87.1	Confident	81.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.1	172.9	-179	0	0	0	0	109.3	Y69 Y70 T72 I94 L171 L377	Y69-V169 WeakPolarHBondContact CA-O 3.26Å; Y70-V169 PolarHBondContact N-O 3.4Å; Y70-V169 PolarHBondContact O-N 3.32Å; T72-V169 HydrophobicContact CG2-CG2 4.25Å; I94-V169 HydrophobicContact CG2-CB 4.43Å; I94-V169 HydrophobicContact CG2-CG1 3.5Å; I94-V169 HydrophobicContact CG2-CG2 4.01Å; V169-L171 PolarHBondContact O-N 3.33Å; V169-L377 HydrophobicContact CB-CD1 4.17Å; V169-L377 HydrophobicContact CG1-CD1 4.11Å; V169-L377 HydrophobicContact CG1-CD2 3.7Å; V169-L377 HydrophobicContact CG2-CD1 4.34Å
170	D	89	Confident	82.7	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.011	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	109.8	174	-179.1	7.1	0	0	0	110.4	R68 Y69 C97 V172 R173 N174	R68-D170 IonicContact CZ-OD1 2.65Å; R68-D170 IonicContact CZ-OD2 2.97Å; R68-D170 IonicContact NE-OD1 2.79Å; R68-D170 PolarHBondContact NE-OD1 3.29Å; R68-D170 IonicContact NE-OD2 2.68Å; R68-D170 VanDerWaalsContact NH2-CG 3.33Å; R68-D170 IonicContact NH2-OD1 3.99Å; R68-D170 PolarHBondContact NH2-OD1 3.15Å; R68-D170 IonicContact NH2-OD2 4Å; R68-D170 PolarHBondContact NH2-OD2 3.14Å; Y69-D170 HydrophobicContact CD1-CB 4.1Å; Y69-D170 HydrophobicContact CE1-CB 3.9Å; C97-D170 PolarHBondContact SG-N 2.86Å; D170-V172 VanDerWaalsContact C-N 3.26Å; D170-V172 PolarHBondContact O-N 3.41Å; D170-V172 WeakPolarHBondContact OD1-CB 3.35Å; D170-V172 PolarHBondContact OD1-N 3.11Å; D170-R173 HydrophobicContact CB-CB 4.36Å; D170-R173 PolarHBondContact O-N 3.34Å; D170-R173 WeakPolarHBondContact OD2-CD 3.38Å; D170-R173 VanDerWaalsContact OD2-CG 3.29Å; D170-R173 WeakPolarHBondContact OD2-CG 3.43Å; D170-R173 IonicContact OD2-NE 3.53Å; D170-N174 PolarHBondContact O-N 3.31Å; D170-N174 PolarHBondContact O-ND2 3.13Å
171	L	91	Very high	83.8	Confident	8 Å²	8	50.3 Å²	50.3	4%	0.042	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-25.4	-177.8	-59.6	175.8	0	0	0	112.6	R68 V169 N174 L377 W378 L381 V418 N422	R68-L171 VanDerWaalsContact O-CB 3.27Å; R68-L171 WeakPolarHBondContact O-CB 3.28Å; R68-L171 WeakPolarHBondContact O-CG 3.34Å; R68-L171 PolarHBondContact O-N 3.05Å; V169-L171 PolarHBondContact O-N 3.33Å; L171-N174 CarbonylContact O-C 3.58Å; L171-N174 PolarHBondContact O-N 2.97Å; L171-L377 HydrophobicContact CD2-CD1 4.39Å; L171-L377 HydrophobicContact CD2-CD2 4.13Å; L171-L377 HydrophobicContact CD2-CG 4.38Å; L171-W378 HydrophobicContact CB-CH2 4.35Å; L171-W378 HydrophobicContact CB-CZ2 4.47Å; L171-W378 HydrophobicContact CD2-CH2 4.48Å; L171-L381 HydrophobicContact CD1-CD1 3.43Å; L171-L381 VanDerWaalsContact CD1-CD1 3.43Å; L171-L381 HydrophobicContact CD2-CD1 3.62Å; L171-L381 HydrophobicContact CG-CD1 4.18Å; L171-V418 HydrophobicContact CD1-CG1 4.5Å; L171-N422 HydrophobicContact CD1-CB 4.31Å; L171-N422 VanDerWaalsContact CD1-CG 3.43Å; L171-N422 WeakPolarHBondContact CD1-ND2 3.3Å; L171-N422 WeakPolarHBondContact CD1-OD1 3.33Å
172	V	90.1	Very high	85	Confident	71 Å²	71	56.4 Å²	56.4	43%	0.43	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-38.7	178.7	176.8	0	0	0	0	110.6	K63 R68 D170 N174	K63-V172 HydrophobicContact CG-CG2 4.33Å; R68-V172 HydrophobicContact CB-CG2 3.94Å; D170-V172 VanDerWaalsContact C-N 3.26Å; D170-V172 PolarHBondContact O-N 3.41Å; D170-V172 WeakPolarHBondContact OD1-CB 3.35Å; D170-V172 PolarHBondContact OD1-N 3.11Å; V172-N174 VanDerWaalsContact C-N 3.3Å
173	R	86.7	Confident	86.2	Confident	139 Å²	139	54.7 Å²	54.7	53%	0.525	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-21.4	173.8	-74.2	179.3	-177.6	-178.6	13.7	113	E100 D170 P175	E100-R173 IonicContact OE1-CZ 3.85Å; E100-R173 IonicContact OE1-NH1 2.81Å; E100-R173 PolarHBondContact OE1-NH1 3.49Å; E100-R173 IonicContact OE1-NH2 3.15Å; E100-R173 PolarHBondContact OE1-NH2 2.84Å; E100-R173 IonicContact OE2-CZ 2.77Å; E100-R173 IonicContact OE2-NH1 2.68Å; E100-R173 PolarHBondContact OE2-NH1 3.48Å; E100-R173 VanDerWaalsContact OE2-NH1 3.14Å; E100-R173 IonicContact OE2-NH2 3.33Å; E100-R173 PolarHBondContact OE2-NH2 3.33Å; D170-R173 HydrophobicContact CB-CB 4.36Å; D170-R173 PolarHBondContact O-N 3.34Å; D170-R173 WeakPolarHBondContact OD2-CD 3.38Å; D170-R173 VanDerWaalsContact OD2-CG 3.29Å; D170-R173 WeakPolarHBondContact OD2-CG 3.43Å; D170-R173 IonicContact OD2-NE 3.53Å; R173-P175 WeakPolarHBondContact O-CD 3.08Å
174	N	88.9	Confident	87	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.07	29%	0.291	C	S	.	.	S	Bend	trans	-116.2	59.5	-176.1	-65.9	-75	0	0	0	112.4	D170 L171 V172 L377 W378	D170-N174 PolarHBondContact O-N 3.31Å; D170-N174 PolarHBondContact O-ND2 3.13Å; L171-N174 CarbonylContact O-C 3.58Å; L171-N174 PolarHBondContact O-N 2.97Å; V172-N174 VanDerWaalsContact C-N 3.3Å; N174-L377 HydrophobicContact CB-CD2 3.94Å; N174-W378 VanDerWaalsContact O-CE2 3.31Å; N174-W378 WeakPolarHBondContact O-CZ2 3.38Å; N174-W378 PolarHBondContact O-NE1 3.03Å
175	P	92.6	Very high	87.7	Confident	45 Å²	45	52 Å²	52	29%	0.292	26%	0.26	S	S	.	.			trans	-65.7	146.6	-177.3	29.3	-36.2	0	0	0	112.3	R173 R177	R173-P175 WeakPolarHBondContact O-CD 3.08Å; P175-R177 PolarHBondContact O-N 3.44Å
176	E	94	Very high	88.1	Confident	14 Å²	14	46.6 Å²	46.6	7%	0.065	24%	0.239	C	C	.	.			trans	-70.4	117.3	170.9	-169.6	-169.2	-105.9	0	0	109.4	S239 W378 Q382 R426	E176-S239 PolarHBondContact O-OG 3.31Å; E176-S239 WeakPolarHBondContact OE2-CB 3.15Å; E176-S239 PolarHBondContact OE2-OG 2.81Å; E176-W378 HydrophobicContact CB-CD2 3.73Å; E176-W378 HydrophobicContact CB-CE3 4.42Å; E176-W378 HydrophobicContact CB-CG 3.73Å; E176-W378 HydrophobicContact CB-CZ2 4.37Å; E176-W378 HydrophobicContact CG-CB 4.29Å; E176-W378 HydrophobicContact CG-CD2 4.39Å; E176-W378 HydrophobicContact CG-CG 3.98Å; E176-Q382 PolarHBondContact OE1-OE1 3.4Å; E176-R426 IonicContact OE1-NE 3.5Å; E176-R426 IonicContact OE2-CZ 3.13Å; E176-R426 VanDerWaalsContact OE2-CZ 3.24Å; E176-R426 IonicContact OE2-NE 2.76Å; E176-R426 PolarHBondContact OE2-NE 2.89Å; E176-R426 IonicContact OE2-NH2 3.12Å; E176-R426 PolarHBondContact OE2-NH2 3.27Å
177	R	92.3	Very high	88.6	Confident	60 Å²	60	52.2 Å²	52.2	23%	0.226	27%	0.265	C	S	.	.			trans	-157.5	-177.6	-179.2	62.6	-171.3	-172.8	-175.8	-0.6	111.5	E91 P175 T179 N243 W257	E91-R177 IonicContact OE2-CZ 2.84Å; E91-R177 IonicContact OE2-NE 3.33Å; E91-R177 IonicContact OE2-NH2 2.67Å; E91-R177 PolarHBondContact OE2-NH2 2.91Å; P175-R177 PolarHBondContact O-N 3.44Å; R177-T179 PolarHBondContact O-N 3.19Å; R177-N243 HydrophobicContact CB-CB 3.51Å; R177-W257 HydrophobicContact CB-CE3 4.44Å; R177-W257 HydrophobicContact CB-CH2 4.27Å; R177-W257 HydrophobicContact CB-CZ3 3.8Å; R177-W257 VanDerWaalsContact CD-CZ3 3.48Å; R177-W257 HydrophobicContact CG-CH2 3.59Å; R177-W257 HydrophobicContact CG-CZ2 4.39Å; R177-W257 HydrophobicContact CG-CZ3 3.65Å
178	Y	88.9	Confident	89	Confident	72 Å²	72	55.7 Å²	55.7	28%	0.282	28%	0.276	S	S	.	.			trans	-59.4	122.8	174.7	179.7	-87.9	0	0	0	111.7	I240 N243 W257	Y178-I240 HydrophobicContact CD2-CG2 3.65Å; Y178-I240 HydrophobicContact CG-CG2 4.38Å; Y178-N243 WeakPolarHBondContact CB-O 3.34Å; Y178-N243 PolarHBondContact N-O 2.96Å; Y178-W257 WeakPolarHBondContact O-CH2 3.45Å
179	T	86.9	Confident	89.3	Confident	20 Å²	20	55.3 Å²	55.3	12%	0.123	28%	0.275	C	S	.	.			trans	-113.5	-6.1	177.1	60.8	0	0	0	0	113.4	R177 Y181 C372 K374 C375	R177-T179 PolarHBondContact O-N 3.19Å; T179-Y181 VanDerWaalsContact C-N 3.26Å; T179-Y181 PolarHBondContact O-N 2.99Å; T179-Y181 WeakPolarHBondContact OG1-CB 3.41Å; T179-Y181 PolarHBondContact OG1-N 2.85Å; T179-C372 PolarHBondContact OG1-SG 3.25Å; T179-C372 VanDerWaalsContact OG1-SG 3.4Å; T179-K374 HydrophobicContact CG2-CB 4.21Å; T179-C375 PolarHBondContact OG1-SG 3.15Å
180	G	84.3	Confident	89.6	Confident	27 Å²	27	57.6 Å²	57.6	28%	0.278	28%	0.284	S	S	.	.			trans	79.2	-1.9	-171.5	0	0	0	0	0	115.3	K182	G180-K182 WeakPolarHBondContact O-CG 3.23Å; G180-K182 PolarHBondContact O-N 2.9Å
181	Y	86.1	Confident	89.7	Confident	64 Å²	64	63.5 Å²	63.5	25%	0.251	31%	0.309	S	S	.	.			trans	-62.1	118.1	176.8	-175.7	-124.5	0	0	0	111.5	T179 S185 A186 V370 D371 C372 C375	T179-Y181 VanDerWaalsContact C-N 3.26Å; T179-Y181 PolarHBondContact O-N 2.99Å; T179-Y181 WeakPolarHBondContact OG1-CB 3.41Å; T179-Y181 PolarHBondContact OG1-N 2.85Å; Y181-S185 WeakPolarHBondContact CE2-OG 3.17Å; Y181-S185 VanDerWaalsContact OH-C 3.31Å; Y181-S185 PolarHBondContact OH-OG 3.5Å; Y181-A186 HydrophobicContact CD1-CB 3.88Å; Y181-A186 HydrophobicContact CE1-CB 3.49Å; Y181-A186 VanDerWaalsContact CE1-CB 3.49Å; Y181-A186 HydrophobicContact CE2-CB 4.39Å; Y181-A186 HydrophobicContact CG-CB 4.48Å; Y181-A186 WeakPolarHBondContact OH-CA 3.38Å; Y181-A186 PolarHBondContact OH-N 3.4Å; Y181-V370 HydrophobicContact CE1-CG1 4.09Å; Y181-D371 HydrophobicContact CE2-CB 4.13Å; Y181-C372 HydrophobicContact CD1-CB 4.13Å; Y181-C372 HydrophobicContact CD2-CB 3.9Å; Y181-C372 HydrophobicContact CG-CB 3.7Å; Y181-C375 HydrophobicContact CD1-CB 4.42Å
182	K	86.4	Confident	89.7	Confident	163 Å²	163	64.5 Å²	64.5	71%	0.709	32%	0.317	S	S	*	.			trans	-159.5	175.8	-173.6	68	-171.6	177.1	-179.3	0	112	G180	G180-K182 WeakPolarHBondContact O-CG 3.23Å; G180-K182 PolarHBondContact O-N 2.9Å
183	G	87.1	Confident	89.8	Confident	36 Å²	36	61.2 Å²	61.2	37%	0.371	30%	0.297	S	S	.	.	S	Bend	trans	82.7	-157.7	173.9	0	0	0	0	0	113.6	S185 A186 Q187	G183-S185 VanDerWaalsContact C-N 3.28Å; G183-S185 PolarHBondContact O-N 2.78Å; G183-A186 PolarHBondContact O-N 2.71Å; G183-Q187 WeakPolarHBondContact O-CG 3.22Å; G183-Q187 PolarHBondContact O-N 3.22Å
184	N	88.1	Confident	89.9	Confident	127 Å²	127	57.5 Å²	57.5	68%	0.679	28%	0.283	S	S	*	.	H	α-helix	trans	-60.4	-33.4	-169.4	-68	-13.8	0	0	0	113.8	R188	N184-R188 VanDerWaalsContact O-CB 3.26Å; N184-R188 WeakPolarHBondContact O-CB 3.34Å; N184-R188 PolarHBondContact O-N 3.22Å
185	S	89.3	Confident	89.8	Confident	31 Å²	31	61.9 Å²	61.9	22%	0.217	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-54.8	176.9	173.9	0	0	0	0	110.8	Y181 G183 Q187 R188 V189 D371	Y181-S185 WeakPolarHBondContact CE2-OG 3.17Å; Y181-S185 VanDerWaalsContact OH-C 3.31Å; Y181-S185 PolarHBondContact OH-OG 3.5Å; G183-S185 VanDerWaalsContact C-N 3.28Å; G183-S185 PolarHBondContact O-N 2.78Å; S185-Q187 VanDerWaalsContact C-N 3.33Å; S185-Q187 PolarHBondContact O-N 3.34Å; S185-R188 WeakPolarHBondContact O-CB 3.21Å; S185-R188 PolarHBondContact O-N 2.85Å; S185-V189 PolarHBondContact O-N 3.22Å; S185-V189 VanDerWaalsContact O-N 3.13Å; S185-D371 WeakPolarHBondContact CB-OD2 3.37Å; S185-D371 PolarHBondContact OG-OD2 2.69Å
186	A	90.6	Very high	89.3	Confident	13 Å²	13	61.9 Å²	61.9	11%	0.107	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-41.4	178.4	0	0	0	0	0	112.3	Y181 G183 V189 W190	Y181-A186 HydrophobicContact CD1-CB 3.88Å; Y181-A186 HydrophobicContact CE1-CB 3.49Å; Y181-A186 VanDerWaalsContact CE1-CB 3.49Å; Y181-A186 HydrophobicContact CE2-CB 4.39Å; Y181-A186 HydrophobicContact CG-CB 4.48Å; Y181-A186 WeakPolarHBondContact OH-CA 3.38Å; Y181-A186 PolarHBondContact OH-N 3.4Å; G183-A186 PolarHBondContact O-N 2.71Å; A186-V189 PolarHBondContact O-N 2.81Å; A186-W190 VanDerWaalsContact O-CD1 3.32Å; A186-W190 PolarHBondContact O-N 2.9Å; A186-W190 VanDerWaalsContact O-N 3.13Å
187	Q	91.1	Very high	88.4	Confident	127 Å²	127	61.7 Å²	61.7	59%	0.593	30%	0.298	S	S	*	.	H	α-helix	trans	-64.8	-38.4	177.9	-72.1	177	-5.9	0	0	112.3	G183 S185 K191	G183-Q187 WeakPolarHBondContact O-CG 3.22Å; G183-Q187 PolarHBondContact O-N 3.22Å; S185-Q187 VanDerWaalsContact C-N 3.33Å; S185-Q187 PolarHBondContact O-N 3.34Å; Q187-K191 WeakPolarHBondContact O-CB 3.38Å; Q187-K191 PolarHBondContact O-N 2.94Å
188	R	92.8	Very high	87	Confident	123 Å²	123	62.4 Å²	62.4	46%	0.464	31%	0.312	S	S	.	.	H	α-helix	trans	-62.6	-47.6	176.5	-177.8	-174.5	-60	178.5	0.8	111.2	W81 N184 S185 K191 C192	W81-R188 HydrophobicContact CH2-CG 4.08Å; W81-R188 HydrophobicContact CZ2-CG 4.06Å; W81-R188 HydrophobicContact CZ3-CG 4.44Å; N184-R188 VanDerWaalsContact O-CB 3.26Å; N184-R188 WeakPolarHBondContact O-CB 3.34Å; N184-R188 PolarHBondContact O-N 3.22Å; S185-R188 WeakPolarHBondContact O-CB 3.21Å; S185-R188 PolarHBondContact O-N 2.85Å; R188-K191 PolarHBondContact O-N 3.38Å; R188-C192 PolarHBondContact O-N 3.49Å; R188-C192 PolarHBondContact O-SG 2.97Å; R188-C192 VanDerWaalsContact O-SG 3.37Å
189	V	93.1	Very high	85.6	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-56.8	-53.8	177.7	171.4	0	0	0	0	110.3	W81 S185 A186 K191 C192 I193 I366 V370	W81-V189 HydrophobicContact CZ2-CG2 4.22Å; S185-V189 PolarHBondContact O-N 3.22Å; S185-V189 VanDerWaalsContact O-N 3.13Å; A186-V189 PolarHBondContact O-N 2.81Å; V189-K191 VanDerWaalsContact C-N 3.32Å; V189-K191 PolarHBondContact O-N 2.77Å; V189-C192 PolarHBondContact O-N 3.3Å; V189-I193 HydrophobicContact CG1-CD1 3.8Å; V189-I193 HydrophobicContact CG1-CG1 4.49Å; V189-I193 WeakPolarHBondContact O-CG1 3.16Å; V189-I193 PolarHBondContact O-N 3.17Å; V189-I366 HydrophobicContact CG1-CG2 4.05Å; V189-V370 HydrophobicContact CG1-CG2 3.82Å; V189-V370 HydrophobicContact CG2-CG2 4.14Å
190	W	93.5	Very high	83.7	Confident	47 Å²	47	67 Å²	67	18%	0.178	33%	0.332	C	S	.	.	H	α-helix	trans	-60.7	-41.7	179.4	-79.8	116.4	0	0	0	112.5	A186 C192 I193 Y194 I229 H233 I236	A186-W190 VanDerWaalsContact O-CD1 3.32Å; A186-W190 PolarHBondContact O-N 2.9Å; A186-W190 VanDerWaalsContact O-N 3.13Å; W190-C192 PolarHBondContact O-N 2.95Å; W190-I193 HydrophobicContact CE3-CB 4.49Å; W190-I193 HydrophobicContact CE3-CD1 4.02Å; W190-I193 HydrophobicContact CZ3-CD1 4.16Å; W190-I193 PolarHBondContact O-N 2.82Å; W190-Y194 HydrophobicContact CE3-CD2 4.45Å; W190-Y194 AromaticContact CE3-CE2 3.93Å; W190-Y194 HydrophobicContact CE3-CE2 3.93Å; W190-Y194 WeakPolarHBondContact O-CD2 3.33Å; W190-Y194 PolarHBondContact O-N 2.84Å; W190-I229 HydrophobicContact CZ3-CG2 4.13Å; W190-H233 AromaticContact CD1-NE2 3.98Å; W190-H233 AromaticContact CD2-CE1 3.89Å; W190-H233 AromaticContact CD2-ND1 3.89Å; W190-H233 AromaticContact CE2-CD2 3.51Å; W190-H233 AromaticContact CE2-CE1 3.98Å; W190-H233 AromaticContact CE2-CG 3.83Å; W190-H233 AromaticContact CE2-NE2 3.66Å; W190-H233 HydrophobicContact CE3-CB 4.27Å; W190-H233 AromaticContact CE3-ND1 3.98Å; W190-H233 AromaticContact CG-CE1 4Å; W190-H233 HydrophobicContact CH2-CB 3.55Å; W190-H233 AromaticContact CH2-CG 3.78Å; W190-H233 HydrophobicContact CZ2-CB 3.98Å; W190-H233 AromaticContact CZ2-CD2 3.46Å; W190-H233 VanDerWaalsContact CZ2-CD2 3.46Å; W190-H233 WeakPolarHBondContact CZ2-CD2 3.45Å; W190-H233 AromaticContact CZ2-CG 3.72Å; W190-H233 HydrophobicContact CZ3-CB 3.71Å; W190-H233 AromaticContact CZ3-CG 3.94Å; W190-H233 AromaticContact NE1-CD2 3.86Å; W190-H233 AromaticContact NE1-NE2 3.59Å; W190-I236 HydrophobicContact CH2-CD1 3.93Å; W190-I236 HydrophobicContact CZ2-CD1 3.84Å
191	K	91.1	Very high	81.7	Confident	127 Å²	127	68.5 Å²	68.5	55%	0.552	34%	0.337	S	S	*	.	H	α-helix	trans	-56.3	-49.9	175.9	-179.5	176.7	173.8	-180	0	110.9	Q187 R188 V189 I193 Y194 E195	Q187-K191 WeakPolarHBondContact O-CB 3.38Å; Q187-K191 PolarHBondContact O-N 2.94Å; R188-K191 PolarHBondContact O-N 3.38Å; V189-K191 VanDerWaalsContact C-N 3.32Å; V189-K191 PolarHBondContact O-N 2.77Å; K191-I193 PolarHBondContact O-N 3.41Å; K191-Y194 PolarHBondContact O-N 3.06Å; K191-E195 WeakPolarHBondContact CE-OE1 3.34Å; K191-E195 HydrophobicContact CG-CG 4.35Å; K191-E195 IonicContact NZ-OE1 3.77Å; K191-E195 WeakPolarHBondContact O-CB 3.39Å; K191-E195 VanDerWaalsContact O-CG 3.27Å; K191-E195 WeakPolarHBondContact O-CG 3.49Å; K191-E195 PolarHBondContact O-N 3.37Å
192	C	91	Very high	79.7	Confident	29 Å²	29	69.4 Å²	69.4	20%	0.196	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-42.9	177.1	-67.8	0	0	0	0	112.3	W81 R188 V189 W190 Y194 E195 E196 I366	W81-C192 HydrophobicContact CH2-CB 4.3Å; W81-C192 VanDerWaalsContact CZ3-SG 3.59Å; R188-C192 PolarHBondContact O-N 3.49Å; R188-C192 PolarHBondContact O-SG 2.97Å; R188-C192 VanDerWaalsContact O-SG 3.37Å; V189-C192 PolarHBondContact O-N 3.3Å; W190-C192 PolarHBondContact O-N 2.95Å; C192-Y194 PolarHBondContact O-N 3.41Å; C192-E195 PolarHBondContact O-N 3.03Å; C192-E196 PolarHBondContact O-N 2.9Å; C192-I366 HydrophobicContact CB-CD1 4.04Å; C192-I366 HydrophobicContact CB-CG2 4.39Å
193	I	91.5	Very high	77.7	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-61.9	-43.8	177.9	-64.5	167.9	0	0	0	111.4	V189 W190 K191 E196 I229 I363 I366 M367	V189-I193 HydrophobicContact CG1-CD1 3.8Å; V189-I193 HydrophobicContact CG1-CG1 4.49Å; V189-I193 WeakPolarHBondContact O-CG1 3.16Å; V189-I193 PolarHBondContact O-N 3.17Å; W190-I193 HydrophobicContact CE3-CB 4.49Å; W190-I193 HydrophobicContact CE3-CD1 4.02Å; W190-I193 HydrophobicContact CZ3-CD1 4.16Å; W190-I193 PolarHBondContact O-N 2.82Å; K191-I193 PolarHBondContact O-N 3.41Å; I193-E196 WeakPolarHBondContact O-CB 3.48Å; I193-E196 PolarHBondContact O-N 3.19Å; I193-I229 HydrophobicContact CG2-CD1 4Å; I193-I229 HydrophobicContact CG2-CG1 4.23Å; I193-I229 HydrophobicContact CG2-CG2 3.56Å; I193-I363 HydrophobicContact CG1-CG2 4.47Å; I193-I363 HydrophobicContact CG2-CD1 4.33Å; I193-I363 HydrophobicContact CG2-CG1 4.18Å; I193-I363 HydrophobicContact CG2-CG2 4.36Å; I193-I366 HydrophobicContact CD1-CG2 4.33Å; I193-I366 HydrophobicContact CG1-CB 4.38Å; I193-I366 HydrophobicContact CG1-CD1 4.29Å; I193-I366 HydrophobicContact CG1-CG2 3.78Å; I193-M367 HydrophobicContact CD1-CE 3.51Å
194	Y	89.3	Confident	75.9	Confident	62 Å²	62	73.3 Å²	73.3	24%	0.243	36%	0.363	C	S	.	.	H	α-helix	trans	-71	-32.2	177.7	-79.4	-72.4	0	0	0	112.5	W190 K191 C192 E196 N197 Y226 I229 S230 H233	W190-Y194 HydrophobicContact CE3-CD2 4.45Å; W190-Y194 AromaticContact CE3-CE2 3.93Å; W190-Y194 HydrophobicContact CE3-CE2 3.93Å; W190-Y194 WeakPolarHBondContact O-CD2 3.33Å; W190-Y194 PolarHBondContact O-N 2.84Å; K191-Y194 PolarHBondContact O-N 3.06Å; C192-Y194 PolarHBondContact O-N 3.41Å; Y194-E196 VanDerWaalsContact C-N 3.25Å; Y194-E196 PolarHBondContact O-N 2.91Å; Y194-N197 WeakPolarHBondContact O-CB 3.43Å; Y194-N197 PolarHBondContact O-N 3.37Å; Y194-N197 VanDerWaalsContact O-N 3.12Å; Y194-Y226 HydrophobicContact CD1-CD2 4.24Å; Y194-Y226 HydrophobicContact CD1-CE2 4.32Å; Y194-Y226 HydrophobicContact CE1-CD2 4.16Å; Y194-Y226 HydrophobicContact CE1-CE2 4.03Å; Y194-I229 HydrophobicContact CD1-CB 4.44Å; Y194-I229 HydrophobicContact CD1-CG2 3.88Å; Y194-I229 HydrophobicContact CD2-CG2 4.42Å; Y194-I229 HydrophobicContact CE1-CB 4.03Å; Y194-I229 HydrophobicContact CE1-CG2 3.53Å; Y194-I229 HydrophobicContact CE2-CG2 4.1Å; Y194-I229 HydrophobicContact CG-CG2 4.32Å; Y194-S230 WeakPolarHBondContact OH-CA 3.29Å; Y194-H233 AromaticContact CE2-ND1 3.79Å; Y194-H233 PolarHBondContact OH-ND1 3.29Å
195	E	85.6	Confident	74	Confident	104 Å²	104	75.3 Å²	75.3	49%	0.486	37%	0.366	S	S	.	.	H	α-helix	trans	-69.8	-19.8	175.2	-74.6	175	164.9	0	0	112.8	K191 C192 N197 C198	K191-E195 WeakPolarHBondContact CE-OE1 3.34Å; K191-E195 HydrophobicContact CG-CG 4.35Å; K191-E195 IonicContact NZ-OE1 3.77Å; K191-E195 WeakPolarHBondContact O-CB 3.39Å; K191-E195 VanDerWaalsContact O-CG 3.27Å; K191-E195 WeakPolarHBondContact O-CG 3.49Å; K191-E195 PolarHBondContact O-N 3.37Å; C192-E195 PolarHBondContact O-N 3.03Å; E195-N197 PolarHBondContact O-N 3.38Å; E195-N197 VanDerWaalsContact O-N 3.12Å; E195-C198 PolarHBondContact O-SG 2.63Å
196	E	83.4	Confident	71.9	Confident	45 Å²	45	77.6 Å²	77.6	21%	0.21	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-13.1	167.8	-73.5	-62.2	131.5	0	0	112.9	C192 I193 Y194 C198 F225 H359 N362 I363 I366	C192-E196 PolarHBondContact O-N 2.9Å; I193-E196 WeakPolarHBondContact O-CB 3.48Å; I193-E196 PolarHBondContact O-N 3.19Å; Y194-E196 VanDerWaalsContact C-N 3.25Å; Y194-E196 PolarHBondContact O-N 2.91Å; E196-C198 PolarHBondContact O-N 2.9Å; E196-F225 HydrophobicContact CB-CZ 4.08Å; E196-H359 PolarHBondContact O-CE1 3.36Å; E196-H359 PolarHBondContact O-ND1 2.81Å; E196-H359 IonicContact OE2-ND1 3.66Å; E196-N362 HydrophobicContact CG-CB 4.3Å; E196-N362 VanDerWaalsContact OE2-CB 3.26Å; E196-N362 WeakPolarHBondContact OE2-CB 3.31Å; E196-N362 PolarHBondContact OE2-ND2 3.46Å; E196-I363 HydrophobicContact CG-CG1 4.4Å; E196-I366 HydrophobicContact CG-CD1 3.8Å
197	N	73.2	Confident	69.8	Low	10 Å²	10	86.5 Å²	86.5	5%	0.053	41%	0.412	C	S	.	.			trans	-71.9	48.4	173.1	-162.3	4.4	0	0	0	112.8	Y194 E195 F199 Y209 K222 F225	Y194-N197 WeakPolarHBondContact O-CB 3.43Å; Y194-N197 PolarHBondContact O-N 3.37Å; Y194-N197 VanDerWaalsContact O-N 3.12Å; E195-N197 PolarHBondContact O-N 3.38Å; E195-N197 VanDerWaalsContact O-N 3.12Å; N197-F199 WeakPolarHBondContact OD1-CD2 3.46Å; N197-F199 WeakPolarHBondContact OD1-CE2 3.37Å; N197-Y209 PolarHBondContact O-OH 3.15Å; N197-K222 PolarHBondContact ND2-O 3.03Å; N197-F225 HydrophobicContact CB-CD1 3.55Å; N197-F225 HydrophobicContact CB-CE1 3.67Å
198	C	64.6	Low	67.6	Low	76 Å²	76	87.3 Å²	87.3	51%	0.514	42%	0.416	S	S	.	.			trans	-104.2	48	177.6	-74.3	0	0	0	0	111.2	E195 E196 K200	E195-C198 PolarHBondContact O-SG 2.63Å; E196-C198 PolarHBondContact O-N 2.9Å; C198-K200 PolarHBondContact O-N 3.01Å; C198-K200 VanDerWaalsContact O-N 3.17Å
199	F	58.9	Low	65.2	Low	7 Å²	7	83.6 Å²	83.6	3%	0.031	40%	0.402	C	S	.	.			trans	-54.9	126.5	164.5	-62.6	-98.3	0	0	0	107.3	N197 P201 E221 K222 F225 L352 E355 F356 H359	N197-F199 WeakPolarHBondContact OD1-CD2 3.46Å; N197-F199 WeakPolarHBondContact OD1-CE2 3.37Å; F199-P201 VanDerWaalsContact O-CD 3.25Å; F199-P201 WeakPolarHBondContact O-CD 3.42Å; F199-E221 HydrophobicContact CD1-CB 4.31Å; F199-E221 HydrophobicContact CE1-CB 4.48Å; F199-K222 HydrophobicContact CB-CD 4.44Å; F199-K222 HydrophobicContact CB-CG 3.71Å; F199-K222 HydrophobicContact CD2-CB 4.4Å; F199-K222 HydrophobicContact CD2-CG 3.74Å; F199-K222 HydrophobicContact CG-CG 4Å; F199-K222 WeakPolarHBondContact O-CE 3.47Å; F199-K222 PolarHBondContact O-NZ 3.04Å; F199-K222 VanDerWaalsContact O-NZ 3.14Å; F199-F225 HydrophobicContact CE2-CB 3.4Å; F199-F225 HydrophobicContact CE2-CD1 4.29Å; F199-F225 HydrophobicContact CE2-CD2 4.06Å; F199-F225 AromaticContact CE2-CG 3.67Å; F199-F225 HydrophobicContact CE2-CG 3.67Å; F199-F225 HydrophobicContact CZ-CB 3.74Å; F199-F225 HydrophobicContact CZ-CD2 4.08Å; F199-F225 HydrophobicContact CZ-CG 4.08Å; F199-L352 HydrophobicContact CE1-CD1 4.17Å; F199-E355 HydrophobicContact CD1-CB 3.94Å; F199-E355 WeakPolarHBondContact CD1-OE2 3.5Å; F199-E355 HydrophobicContact CE1-CB 3.82Å; F199-F356 HydrophobicContact CE1-CD2 4.32Å; F199-F356 HydrophobicContact CE1-CE2 4.27Å; F199-F356 HydrophobicContact CZ-CD1 4.44Å; F199-F356 HydrophobicContact CZ-CD2 4.48Å; F199-F356 HydrophobicContact CZ-CE1 4.2Å; F199-F356 HydrophobicContact CZ-CE2 4.26Å; F199-F356 HydrophobicContact CZ-CZ 4.09Å; F199-H359 AromaticContact CD1-NE2 3.91Å; F199-H359 AromaticContact CE1-CD2 3.68Å; F199-H359 AromaticContact CE1-NE2 3.88Å; F199-H359 AromaticContact CE2-CD2 3.87Å; F199-H359 AromaticContact CE2-NE2 3.98Å; F199-H359 AromaticContact CG-NE2 3.98Å; F199-H359 AromaticContact CZ-CD2 3.49Å; F199-H359 VanDerWaalsContact CZ-CD2 3.49Å; F199-H359 WeakPolarHBondContact CZ-CD2 3.18Å; F199-H359 AromaticContact CZ-NE2 3.91Å
200	K	46.5	Very low	62.8	Low	180 Å²	180	91 Å²	91	78%	0.783	44%	0.441	S	S	*	.			trans	-49	112	-171.5	-70.2	176.9	-179.3	174.6	0	109.4	C198 D202	C198-K200 PolarHBondContact O-N 3.01Å; C198-K200 VanDerWaalsContact O-N 3.17Å; K200-D202 PolarHBondContact O-N 2.92Å
201	P	42.9	Very low	60.6	Low	60 Å²	60	94.1 Å²	94.1	39%	0.39	46%	0.46	S	S	.	.			trans	-67.1	132.5	172.3	25.8	-26.3	0	0	0	106.6	F199 P203	F199-P201 VanDerWaalsContact O-CD 3.25Å; F199-P201 WeakPolarHBondContact O-CD 3.42Å; P201-P203 WeakPolarHBondContact O-CD 3.21Å; P201-P203 VanDerWaalsContact O-N 3.09Å
202	D	44.2	Very low	58.4	Low	82 Å²	82	97.4 Å²	97.4	44%	0.439	47%	0.47	S	S	.	.			trans	-60.4	114.5	162.7	-178.3	-15.1	0	0	0	106.1	K200 K204 F205	K200-D202 PolarHBondContact O-N 2.92Å; D202-K204 PolarHBondContact O-N 3.35Å; D202-K204 WeakPolarHBondContact OD1-CB 3.5Å; D202-K204 PolarHBondContact OD1-N 3Å; D202-F205 HydrophobicContact CB-CD2 3.86Å; D202-F205 HydrophobicContact CB-CE2 4.39Å; D202-F205 PolarHBondContact O-N 3.49Å; D202-F205 WeakPolarHBondContact OD2-CE2 3.45Å
203	P	44.4	Very low	56.2	Low	103 Å²	103	100.9 Å²	100.9	67%	0.669	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-11.3	-172.5	-17.3	26.4	0	0	0	113.5	P201	P201-P203 WeakPolarHBondContact O-CD 3.21Å; P201-P203 VanDerWaalsContact O-N 3.09Å
204	K	49.8	Very low	54	Low	178 Å²	178	106 Å²	106	77%	0.774	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.5	175.4	-70.5	179.6	176.3	178.8	0	114.1	D202	D202-K204 PolarHBondContact O-N 3.35Å; D202-K204 WeakPolarHBondContact OD1-CB 3.5Å; D202-K204 PolarHBondContact OD1-N 3Å
205	F	47.1	Very low	52.1	Low	169 Å²	169	106.1 Å²	106.1	74%	0.741	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-19.8	-164.4	-67.1	-77.4	0	0	0	115.9	D202	D202-F205 HydrophobicContact CB-CD2 3.86Å; D202-F205 HydrophobicContact CB-CE2 4.39Å; D202-F205 PolarHBondContact O-N 3.49Å; D202-F205 WeakPolarHBondContact OD2-CE2 3.45Å
206	D	44.9	Very low	50	Low	79 Å²	79	111.8 Å²	111.8	42%	0.422	54%	0.541	S	S	.	.			trans	-157.8	105.9	174.6	-157.2	-16.8	0	0	0	112.9	E208 Y209	D206-E208 PolarHBondContact OD1-N 3.08Å; D206-E208 VanDerWaalsContact OD1-N 3.07Å; D206-Y209 PolarHBondContact OD1-N 3.48Å
207	K	47.4	Very low	47.8	Very low	200 Å²	200	112.8 Å²	112.8	87%	0.87	56%	0.563	S	S	*	*	S	Bend	trans	-85.3	-13.1	176.6	-75.8	-177.6	177.7	178.2	0	113
208	E	45.4	Very low	46.7	Very low	144 Å²	144	113.2 Å²	113.2	67%	0.673	57%	0.565	S	S	*	*			trans	-110.4	5.8	-171.1	-79.2	166.9	163.7	0	0	113.6	D206 L210 I211	D206-E208 PolarHBondContact OD1-N 3.08Å; D206-E208 VanDerWaalsContact OD1-N 3.07Å; E208-L210 PolarHBondContact O-N 2.82Å; E208-I211 PolarHBondContact O-N 3.02Å
209	Y	41.6	Very low	46.5	Very low	46 Å²	46	113.2 Å²	113.2	18%	0.18	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-48.4	-29.5	-177	178	-105.3	0	0	0	116	N197 D206 I211 M218 K222	N197-Y209 PolarHBondContact O-OH 3.15Å; D206-Y209 PolarHBondContact OD1-N 3.48Å; Y209-I211 PolarHBondContact O-N 2.92Å; Y209-M218 HydrophobicContact CE2-CG 4.47Å; Y209-M218 HydrophobicContact CE2-SD 4.28Å; Y209-K222 HydrophobicContact CE2-CD 4.27Å
210	L	42.3	Very low	46.7	Very low	163 Å²	163	116.3 Å²	116.3	85%	0.853	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-9.6	-178.5	-68.4	172	0	0	0	113.9	E208	E208-L210 PolarHBondContact O-N 2.82Å
211	I	48.6	Very low	47.6	Very low	112 Å²	112	110.1 Å²	110.1	57%	0.574	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-39.5	-167.4	-46.2	-179.3	0	0	0	112.4	E208 Y209	E208-I211 PolarHBondContact O-N 3.02Å; Y209-I211 PolarHBondContact O-N 2.92Å
212	Y	44.3	Very low	48.8	Very low	196 Å²	196	107.7 Å²	107.7	77%	0.769	55%	0.545	S	S	*	.			trans	-144.6	102.1	179.2	-65.2	-77.6	0	0	0	112.4	N214	Y212-N214 PolarHBondContact O-N 3.24Å
213	P	44.1	Very low	50.3	Low	102 Å²	102	108 Å²	108	66%	0.662	54%	0.54	S	S	*	.			trans	-75.1	110.5	-178.3	27.4	-31.6	0	0	0	111.8
214	N	45.8	Very low	52.1	Low	109 Å²	109	103.6 Å²	103.6	58%	0.583	51%	0.51	S	S	*	.			trans	-99.7	112.1	171	-170.4	-19.3	0	0	0	110.9	Y212 R216 G217	Y212-N214 PolarHBondContact O-N 3.24Å; N214-R216 PolarHBondContact O-N 2.91Å; N214-R216 VanDerWaalsContact O-N 3.14Å; N214-R216 PolarHBondContact OD1-N 3.23Å; N214-R216 VanDerWaalsContact OD1-N 3.16Å; N214-G217 PolarHBondContact O-N 3.24Å; N214-G217 VanDerWaalsContact O-N 3.12Å
215	I	48.4	Very low	53.8	Low	64 Å²	64	95.1 Å²	95.1	33%	0.328	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-57.8	-30.4	-177.5	-61.6	171.9	0	0	0	112.8	G217 M218 R223 Y226	I215-G217 VanDerWaalsContact C-N 3.34Å; I215-G217 PolarHBondContact O-N 3.04Å; I215-M218 HydrophobicContact CB-CE 4.08Å; I215-M218 HydrophobicContact CG1-CE 3.69Å; I215-R223 HydrophobicContact CG2-CG 3.99Å; I215-R223 PolarHBondContact O-NE 3.1Å; I215-R223 VanDerWaalsContact O-NE 3.12Å; I215-R223 PolarHBondContact O-NH2 3.36Å; I215-Y226 HydrophobicContact CD1-CD1 4.18Å; I215-Y226 HydrophobicContact CD1-CE1 3.66Å; I215-Y226 HydrophobicContact CG1-CE1 4.47Å
216	R	41.4	Very low	55.7	Low	223 Å²	223	89.5 Å²	89.5	84%	0.842	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-70	-29.3	-179	-74.8	-176.3	175.4	176.3	-0.7	113.2	N214 R223	N214-R216 PolarHBondContact O-N 2.91Å; N214-R216 VanDerWaalsContact O-N 3.14Å; N214-R216 PolarHBondContact OD1-N 3.23Å; N214-R216 VanDerWaalsContact OD1-N 3.16Å; R216-R223 PolarHBondContact O-NH2 3.38Å; R216-R223 VanDerWaalsContact O-NH2 3.08Å
217	G	39.1	Very low	57.9	Low	65 Å²	65	87.4 Å²	87.4	67%	0.67	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-90.9	-8.6	-179.4	0	0	0	0	0	115.2	N214 I215	N214-G217 PolarHBondContact O-N 3.24Å; N214-G217 VanDerWaalsContact O-N 3.12Å; I215-G217 VanDerWaalsContact C-N 3.34Å; I215-G217 PolarHBondContact O-N 3.04Å
218	M	49.5	Very low	60	Low	19 Å²	19	77.9 Å²	77.9	9%	0.094	39%	0.392	C	S	.	.	S	Bend	trans	-73.4	142	-179.5	-73.1	-162.7	-94.8	0	0	112.3	Y209 I215 K222	Y209-M218 HydrophobicContact CE2-CG 4.47Å; Y209-M218 HydrophobicContact CE2-SD 4.28Å; I215-M218 HydrophobicContact CB-CE 4.08Å; I215-M218 HydrophobicContact CG1-CE 3.69Å; M218-K222 HydrophobicContact CB-CB 3.97Å; M218-K222 HydrophobicContact CG-CB 4.35Å; M218-K222 HydrophobicContact CG-CD 4.44Å; M218-K222 HydrophobicContact SD-CB 3.92Å; M218-K222 HydrophobicContact SD-CD 4.38Å
219	C	59.2	Low	62.3	Low	76 Å²	76	71 Å²	71	51%	0.514	36%	0.36	S	S	.	.			trans	-50.4	145.8	165.7	-60.2	0	0	0	0	110.1	E221 K222 R223	C219-E221 WeakPolarHBondContact CB-OE2 3.33Å; C219-E221 PolarHBondContact O-N 3.4Å; C219-K222 PolarHBondContact O-N 3.5Å; C219-K222 VanDerWaalsContact O-N 3.08Å; C219-R223 PolarHBondContact O-N 3.35Å; C219-R223 VanDerWaalsContact O-N 3.14Å
220	S	63.2	Low	64.8	Low	72 Å²	72	69 Å²	69	50%	0.503	35%	0.353	S	S	.	.	H	α-helix	trans	-47.8	-36.4	-177.9	25.7	0	0	0	0	113.6	R223 M224	S220-R223 PolarHBondContact O-N 2.88Å; S220-M224 PolarHBondContact O-N 3.03Å
221	E	65.3	Low	67.4	Low	51 Å²	51	61.2 Å²	61.2	24%	0.238	31%	0.312	C	S	.	.	H	α-helix	trans	-65.2	-52	-178.7	-62.2	84.2	169.8	0	0	111.7	F199 C219 R223 M224 F225 L352	F199-E221 HydrophobicContact CD1-CB 4.31Å; F199-E221 HydrophobicContact CE1-CB 4.48Å; C219-E221 WeakPolarHBondContact CB-OE2 3.33Å; C219-E221 PolarHBondContact O-N 3.4Å; E221-R223 VanDerWaalsContact C-N 3.27Å; E221-R223 PolarHBondContact O-N 3.08Å; E221-M224 WeakPolarHBondContact O-CB 3.2Å; E221-M224 PolarHBondContact O-N 2.88Å; E221-M224 VanDerWaalsContact O-N 3.15Å; E221-F225 PolarHBondContact O-N 2.96Å; E221-L352 HydrophobicContact CB-CD1 3.62Å; E221-L352 HydrophobicContact CG-CD1 3.23Å; E221-L352 HydrophobicContact CG-CD2 3.7Å; E221-L352 HydrophobicContact CG-CG 4.03Å
222	K	69.7	Low	69.7	Low	9 Å²	9	55.9 Å²	55.9	4%	0.039	29%	0.285	C	S	.	.	H	α-helix	trans	-60	-39.5	175	-73.2	-171.4	175.6	-167.6	0	112	N197 F199 Y209 M218 C219 Y226	N197-K222 PolarHBondContact ND2-O 3.03Å; F199-K222 HydrophobicContact CB-CD 4.44Å; F199-K222 HydrophobicContact CB-CG 3.71Å; F199-K222 HydrophobicContact CD2-CB 4.4Å; F199-K222 HydrophobicContact CD2-CG 3.74Å; F199-K222 HydrophobicContact CG-CG 4Å; F199-K222 WeakPolarHBondContact O-CE 3.47Å; F199-K222 PolarHBondContact O-NZ 3.04Å; F199-K222 VanDerWaalsContact O-NZ 3.14Å; Y209-K222 HydrophobicContact CE2-CD 4.27Å; M218-K222 HydrophobicContact CB-CB 3.97Å; M218-K222 HydrophobicContact CG-CB 4.35Å; M218-K222 HydrophobicContact CG-CD 4.44Å; M218-K222 HydrophobicContact SD-CB 3.92Å; M218-K222 HydrophobicContact SD-CD 4.38Å; C219-K222 PolarHBondContact O-N 3.5Å; C219-K222 VanDerWaalsContact O-N 3.08Å; K222-Y226 WeakPolarHBondContact O-CB 3.27Å; K222-Y226 PolarHBondContact O-N 2.88Å
223	R	75.5	Confident	72.2	Confident	88 Å²	88	49 Å²	49	33%	0.332	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-44.5	176.9	-174.1	180	-61	160.9	7.2	110.4	I215 R216 C219 S220 E221 Y226 R227	I215-R223 HydrophobicContact CG2-CG 3.99Å; I215-R223 PolarHBondContact O-NE 3.1Å; I215-R223 VanDerWaalsContact O-NE 3.12Å; I215-R223 PolarHBondContact O-NH2 3.36Å; R216-R223 PolarHBondContact O-NH2 3.38Å; R216-R223 VanDerWaalsContact O-NH2 3.08Å; C219-R223 PolarHBondContact O-N 3.35Å; C219-R223 VanDerWaalsContact O-N 3.14Å; S220-R223 PolarHBondContact O-N 2.88Å; E221-R223 VanDerWaalsContact C-N 3.27Å; E221-R223 PolarHBondContact O-N 3.08Å; R223-Y226 PolarHBondContact O-N 2.95Å; R223-R227 HydrophobicContact CG-CG 4.47Å; R223-R227 WeakPolarHBondContact O-CB 3.32Å; R223-R227 WeakPolarHBondContact O-CG 3.33Å; R223-R227 PolarHBondContact O-N 3.2Å
224	M	80.9	Confident	74.7	Confident	11 Å²	11	44.3 Å²	44.3	5%	0.054	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-50.1	177.7	174.5	173.7	172.8	0	0	111.4	S220 E221 Y226 R227 I228 F286 L290 L341 F342 F356 L390	S220-M224 PolarHBondContact O-N 3.03Å; E221-M224 WeakPolarHBondContact O-CB 3.2Å; E221-M224 PolarHBondContact O-N 2.88Å; E221-M224 VanDerWaalsContact O-N 3.15Å; M224-Y226 PolarHBondContact O-N 2.85Å; M224-R227 PolarHBondContact O-N 2.86Å; M224-I228 HydrophobicContact CE-CD1 3.77Å; M224-I228 HydrophobicContact CG-CD1 3.89Å; M224-I228 HydrophobicContact CG-CG1 4.49Å; M224-I228 VanDerWaalsContact O-CG1 3.32Å; M224-I228 WeakPolarHBondContact O-CG1 3.14Å; M224-I228 PolarHBondContact O-N 3.27Å; M224-F286 HydrophobicContact CG-CE1 4.42Å; M224-F286 HydrophobicContact CG-CZ 4.06Å; M224-L290 HydrophobicContact CE-CD1 3.9Å; M224-L290 HydrophobicContact CE-CD2 4.4Å; M224-L341 HydrophobicContact CE-CD2 3.3Å; M224-L341 HydrophobicContact CE-CG 4.12Å; M224-L341 HydrophobicContact SD-CD1 4.24Å; M224-L341 HydrophobicContact SD-CD2 3.49Å; M224-L341 WeakPolarHBondContact SD-CD2 3.24Å; M224-L341 HydrophobicContact SD-CG 3.61Å; M224-F342 HydrophobicContact CE-CE1 4.33Å; M224-F342 HydrophobicContact SD-CE1 4.29Å; M224-F356 HydrophobicContact CB-CZ 4.05Å; M224-F356 HydrophobicContact CE-CZ 4.21Å; M224-F356 HydrophobicContact CG-CE1 4.35Å; M224-F356 HydrophobicContact CG-CZ 3.73Å; M224-F356 HydrophobicContact SD-CE2 4.16Å; M224-F356 HydrophobicContact SD-CZ 3.82Å; M224-L390 HydrophobicContact CE-CD2 3.48Å; M224-L390 VanDerWaalsContact CE-CD2 3.48Å
225	F	85.8	Confident	77.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.8	-47.9	178.1	-178	-90.2	0	0	0	112.3	E196 N197 F199 E221 R227 I228 I229 F356 H359 F360 I363	E196-F225 HydrophobicContact CB-CZ 4.08Å; N197-F225 HydrophobicContact CB-CD1 3.55Å; N197-F225 HydrophobicContact CB-CE1 3.67Å; F199-F225 HydrophobicContact CE2-CB 3.4Å; F199-F225 HydrophobicContact CE2-CD1 4.29Å; F199-F225 HydrophobicContact CE2-CD2 4.06Å; F199-F225 AromaticContact CE2-CG 3.67Å; F199-F225 HydrophobicContact CE2-CG 3.67Å; F199-F225 HydrophobicContact CZ-CB 3.74Å; F199-F225 HydrophobicContact CZ-CD2 4.08Å; F199-F225 HydrophobicContact CZ-CG 4.08Å; E221-F225 PolarHBondContact O-N 2.96Å; F225-R227 VanDerWaalsContact C-N 3.3Å; F225-R227 PolarHBondContact O-N 3.28Å; F225-I228 PolarHBondContact O-N 2.85Å; F225-I228 VanDerWaalsContact O-N 3.09Å; F225-I229 HydrophobicContact CD1-CG1 4.06Å; F225-I229 HydrophobicContact CE1-CD1 4.5Å; F225-I229 HydrophobicContact CE1-CG1 3.69Å; F225-I229 HydrophobicContact CE2-CD1 4.46Å; F225-I229 HydrophobicContact CE2-CG1 4.38Å; F225-I229 HydrophobicContact CZ-CD1 4.22Å; F225-I229 HydrophobicContact CZ-CG1 3.89Å; F225-I229 WeakPolarHBondContact O-CG1 3.38Å; F225-I229 PolarHBondContact O-N 3.14Å; F225-F356 HydrophobicContact CB-CE1 3.93Å; F225-F356 HydrophobicContact CB-CZ 4.24Å; F225-F356 HydrophobicContact CD2-CD1 4.3Å; F225-F356 HydrophobicContact CD2-CE1 4.03Å; F225-H359 HydrophobicContact CD2-CB 4.29Å; F225-H359 HydrophobicContact CE2-CB 3.6Å; F225-H359 HydrophobicContact CZ-CB 4.21Å; F225-F360 HydrophobicContact CD2-CE2 4.14Å; F225-F360 HydrophobicContact CE2-CD2 4.46Å; F225-F360 HydrophobicContact CE2-CE2 4.09Å; F225-I363 HydrophobicContact CE2-CD1 3.63Å; F225-I363 HydrophobicContact CZ-CD1 3.47Å; F225-I363 VanDerWaalsContact CZ-CD1 3.47Å; F225-I363 HydrophobicContact CZ-CG1 4.45Å
226	Y	87.8	Confident	79.6	Confident	50 Å²	50	37.6 Å²	37.6	20%	0.196	19%	0.193	C	C	.	.	H	α-helix	trans	-55.3	-46.6	176.3	174.2	-94.5	0	0	0	112	Y194 I215 K222 R223 M224 I228 I229 S230	Y194-Y226 HydrophobicContact CD1-CD2 4.24Å; Y194-Y226 HydrophobicContact CD1-CE2 4.32Å; Y194-Y226 HydrophobicContact CE1-CD2 4.16Å; Y194-Y226 HydrophobicContact CE1-CE2 4.03Å; I215-Y226 HydrophobicContact CD1-CD1 4.18Å; I215-Y226 HydrophobicContact CD1-CE1 3.66Å; I215-Y226 HydrophobicContact CG1-CE1 4.47Å; K222-Y226 WeakPolarHBondContact O-CB 3.27Å; K222-Y226 PolarHBondContact O-N 2.88Å; R223-Y226 PolarHBondContact O-N 2.95Å; M224-Y226 PolarHBondContact O-N 2.85Å; Y226-I228 VanDerWaalsContact C-N 3.28Å; Y226-I228 PolarHBondContact O-N 2.91Å; Y226-I229 PolarHBondContact O-N 3.18Å; Y226-S230 WeakPolarHBondContact O-CB 3.42Å; Y226-S230 PolarHBondContact O-N 2.76Å
227	R	89.6	Confident	82.2	Confident	35 Å²	35	27.4 Å²	27.4	13%	0.132	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-36	179.4	-68.4	-179.4	73	-173.9	1.5	111.5	R223 M224 F225 G231 N283 F286	R223-R227 HydrophobicContact CG-CG 4.47Å; R223-R227 WeakPolarHBondContact O-CB 3.32Å; R223-R227 WeakPolarHBondContact O-CG 3.33Å; R223-R227 PolarHBondContact O-N 3.2Å; M224-R227 PolarHBondContact O-N 2.86Å; F225-R227 VanDerWaalsContact C-N 3.3Å; F225-R227 PolarHBondContact O-N 3.28Å; R227-G231 PolarHBondContact O-N 3.32Å; R227-N283 VanDerWaalsContact CG-OD1 3.23Å; R227-N283 WeakPolarHBondContact CG-OD1 3.47Å; R227-N283 PolarHBondContact NE-OD1 2.95Å; R227-N283 VanDerWaalsContact NE-OD1 3.16Å; R227-N283 WeakPolarHBondContact O-CB 3.35Å; R227-F286 HydrophobicContact CB-CD1 3.92Å; R227-F286 HydrophobicContact CB-CE1 4.06Å; R227-F286 HydrophobicContact CB-CG 4.36Å; R227-F286 VanDerWaalsContact NH2-CD2 3.32Å
228	I	92.6	Very high	85	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-52.2	176.5	-65	168.2	0	0	0	111.3	M224 F225 Y226 S230 G231 L232 F286 V287 L290 F356 F360 I386 L390	M224-I228 HydrophobicContact CE-CD1 3.77Å; M224-I228 HydrophobicContact CG-CD1 3.89Å; M224-I228 HydrophobicContact CG-CG1 4.49Å; M224-I228 VanDerWaalsContact O-CG1 3.32Å; M224-I228 WeakPolarHBondContact O-CG1 3.14Å; M224-I228 PolarHBondContact O-N 3.27Å; F225-I228 PolarHBondContact O-N 2.85Å; F225-I228 VanDerWaalsContact O-N 3.09Å; Y226-I228 VanDerWaalsContact C-N 3.28Å; Y226-I228 PolarHBondContact O-N 2.91Å; I228-S230 VanDerWaalsContact C-N 3.33Å; I228-S230 PolarHBondContact O-N 3.45Å; I228-G231 PolarHBondContact O-N 3.14Å; I228-L232 PolarHBondContact O-N 2.84Å; I228-F286 HydrophobicContact CG1-CD1 4.4Å; I228-F286 HydrophobicContact CG1-CE1 3.77Å; I228-V287 HydrophobicContact CB-CG2 4.34Å; I228-V287 HydrophobicContact CG1-CG2 4.44Å; I228-V287 HydrophobicContact CG2-CG2 4.31Å; I228-L290 HydrophobicContact CD1-CD2 3.76Å; I228-L290 HydrophobicContact CG1-CD2 3.98Å; I228-F356 HydrophobicContact CD1-CE1 4.13Å; I228-F360 HydrophobicContact CG2-CZ 3.78Å; I228-I386 HydrophobicContact CG2-CD1 4.13Å; I228-I386 HydrophobicContact CG2-CG2 3.51Å; I228-L390 HydrophobicContact CD1-CD1 4.36Å; I228-L390 HydrophobicContact CD1-CD2 4.19Å
229	I	94.4	Very high	87.3	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.4	-40.7	179.6	-58.5	-51.2	0	0	0	111.2	W190 I193 Y194 F225 Y226 G231 L232 H233 F360 I363	W190-I229 HydrophobicContact CZ3-CG2 4.13Å; I193-I229 HydrophobicContact CG2-CD1 4Å; I193-I229 HydrophobicContact CG2-CG1 4.23Å; I193-I229 HydrophobicContact CG2-CG2 3.56Å; Y194-I229 HydrophobicContact CD1-CB 4.44Å; Y194-I229 HydrophobicContact CD1-CG2 3.88Å; Y194-I229 HydrophobicContact CD2-CG2 4.42Å; Y194-I229 HydrophobicContact CE1-CB 4.03Å; Y194-I229 HydrophobicContact CE1-CG2 3.53Å; Y194-I229 HydrophobicContact CE2-CG2 4.1Å; Y194-I229 HydrophobicContact CG-CG2 4.32Å; F225-I229 HydrophobicContact CD1-CG1 4.06Å; F225-I229 HydrophobicContact CE1-CD1 4.5Å; F225-I229 HydrophobicContact CE1-CG1 3.69Å; F225-I229 HydrophobicContact CE2-CD1 4.46Å; F225-I229 HydrophobicContact CE2-CG1 4.38Å; F225-I229 HydrophobicContact CZ-CD1 4.22Å; F225-I229 HydrophobicContact CZ-CG1 3.89Å; F225-I229 WeakPolarHBondContact O-CG1 3.38Å; F225-I229 PolarHBondContact O-N 3.14Å; Y226-I229 PolarHBondContact O-N 3.18Å; I229-G231 PolarHBondContact O-N 2.81Å; I229-L232 PolarHBondContact O-N 2.99Å; I229-H233 WeakPolarHBondContact O-CB 3.48Å; I229-H233 PolarHBondContact O-N 3.3Å; I229-F360 HydrophobicContact CD1-CZ 4.44Å; I229-I363 HydrophobicContact CD1-CD1 3.62Å
230	S	94.4	Very high	88.9	Confident	3 Å²	3	21.5 Å²	21.5	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-61.5	-41.5	174.5	-176.9	0	0	0	0	112.2	Y194 Y226 I228 T234 N283	Y194-S230 WeakPolarHBondContact OH-CA 3.29Å; Y226-S230 WeakPolarHBondContact O-CB 3.42Å; Y226-S230 PolarHBondContact O-N 2.76Å; I228-S230 VanDerWaalsContact C-N 3.33Å; I228-S230 PolarHBondContact O-N 3.45Å; S230-T234 VanDerWaalsContact O-CB 3.28Å; S230-T234 WeakPolarHBondContact O-CB 3.18Å; S230-T234 PolarHBondContact O-N 3.33Å; S230-T234 PolarHBondContact O-OG1 3.04Å; S230-N283 VanDerWaalsContact CB-ND2 3.32Å; S230-N283 WeakPolarHBondContact CB-ND2 3.48Å; S230-N283 PolarHBondContact OG-ND2 2.9Å
231	G	95.8	Very high	90.5	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64.5	-44.8	175.7	0	0	0	0	0	112.4	R227 I228 I229 T234 S235 N283	R227-G231 PolarHBondContact O-N 3.32Å; I228-G231 PolarHBondContact O-N 3.14Å; I229-G231 PolarHBondContact O-N 2.81Å; G231-T234 WeakPolarHBondContact O-CB 3.29Å; G231-T234 PolarHBondContact O-N 3.28Å; G231-S235 PolarHBondContact O-N 3.42Å; G231-N283 VanDerWaalsContact CA-C 3.46Å; G231-N283 WeakPolarHBondContact CA-O 3.34Å
232	L	97.4	Very high	92.1	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-59.1	-50.6	174.5	175.4	60.1	0	0	0	111.7	I228 I229 T234 S235 I236 Q382 T383 I386 F427	I228-L232 PolarHBondContact O-N 2.84Å; I229-L232 PolarHBondContact O-N 2.99Å; L232-T234 PolarHBondContact O-N 2.7Å; L232-S235 WeakPolarHBondContact O-CB 3.2Å; L232-S235 PolarHBondContact O-N 2.94Å; L232-S235 VanDerWaalsContact O-N 3.15Å; L232-I236 HydrophobicContact CD1-CD1 4.08Å; L232-I236 HydrophobicContact CD1-CG1 4.48Å; L232-I236 HydrophobicContact CG-CD1 4.15Å; L232-I236 WeakPolarHBondContact O-CG1 3.49Å; L232-I236 PolarHBondContact O-N 2.73Å; L232-I236 VanDerWaalsContact O-N 3.07Å; L232-Q382 HydrophobicContact CD1-CB 3.56Å; L232-Q382 HydrophobicContact CD1-CG 4.15Å; L232-T383 HydrophobicContact CD2-CG2 3.83Å; L232-I386 HydrophobicContact CB-CD1 4.18Å; L232-I386 HydrophobicContact CD1-CD1 4.28Å; L232-I386 HydrophobicContact CD2-CD1 4.14Å; L232-I386 HydrophobicContact CG-CD1 4.43Å; L232-F427 HydrophobicContact CB-CZ 4.41Å; L232-F427 HydrophobicContact CD1-CZ 4.27Å
233	H	96.9	Very high	93.3	Very high	51 Å²	51	18.2 Å²	18.2	24%	0.236	8%	0.084	C	C	.	.	H	α-helix	trans	-60.8	-34.9	177.9	-169.4	-178.8	0	0	0	112	W190 Y194 I229 S237	W190-H233 AromaticContact CD1-NE2 3.98Å; W190-H233 AromaticContact CD2-CE1 3.89Å; W190-H233 AromaticContact CD2-ND1 3.89Å; W190-H233 AromaticContact CE2-CD2 3.51Å; W190-H233 AromaticContact CE2-CE1 3.98Å; W190-H233 AromaticContact CE2-CG 3.83Å; W190-H233 AromaticContact CE2-NE2 3.66Å; W190-H233 HydrophobicContact CE3-CB 4.27Å; W190-H233 AromaticContact CE3-ND1 3.98Å; W190-H233 AromaticContact CG-CE1 4Å; W190-H233 HydrophobicContact CH2-CB 3.55Å; W190-H233 AromaticContact CH2-CG 3.78Å; W190-H233 HydrophobicContact CZ2-CB 3.98Å; W190-H233 AromaticContact CZ2-CD2 3.46Å; W190-H233 VanDerWaalsContact CZ2-CD2 3.46Å; W190-H233 WeakPolarHBondContact CZ2-CD2 3.45Å; W190-H233 AromaticContact CZ2-CG 3.72Å; W190-H233 HydrophobicContact CZ3-CB 3.71Å; W190-H233 AromaticContact CZ3-CG 3.94Å; W190-H233 AromaticContact NE1-CD2 3.86Å; W190-H233 AromaticContact NE1-NE2 3.59Å; Y194-H233 AromaticContact CE2-ND1 3.79Å; Y194-H233 PolarHBondContact OH-ND1 3.29Å; I229-H233 WeakPolarHBondContact O-CB 3.48Å; I229-H233 PolarHBondContact O-N 3.3Å; H233-S237 WeakPolarHBondContact O-CB 3.45Å; H233-S237 PolarHBondContact O-N 3.23Å; H233-S237 PolarHBondContact O-OG 2.95Å
234	T	97	Very high	94.1	Very high	4 Å²	4	14.1 Å²	14.1	3%	0.025	7%	0.069	C	C	.	.	H	α-helix	trans	-66.6	-46	174.8	-61.4	0	0	0	0	111.4	S230 G231 L232 I236 S237 I238 F268 R280 L281 L284	S230-T234 VanDerWaalsContact O-CB 3.28Å; S230-T234 WeakPolarHBondContact O-CB 3.18Å; S230-T234 PolarHBondContact O-N 3.33Å; S230-T234 PolarHBondContact O-OG1 3.04Å; G231-T234 WeakPolarHBondContact O-CB 3.29Å; G231-T234 PolarHBondContact O-N 3.28Å; L232-T234 PolarHBondContact O-N 2.7Å; T234-I236 PolarHBondContact O-N 3.16Å; T234-S237 WeakPolarHBondContact O-CB 3.41Å; T234-S237 PolarHBondContact O-N 3.29Å; T234-I238 HydrophobicContact CG2-CD1 3.67Å; T234-I238 HydrophobicContact CG2-CG1 4.39Å; T234-I238 WeakPolarHBondContact O-CG1 3.27Å; T234-I238 PolarHBondContact O-N 2.86Å; T234-F268 HydrophobicContact CG2-CE1 3.64Å; T234-F268 HydrophobicContact CG2-CZ 4.01Å; T234-R280 HydrophobicContact CG2-CB 4.47Å; T234-R280 WeakPolarHBondContact OG1-CB 3.45Å; T234-R280 PolarHBondContact OG1-O 2.86Å; T234-L281 HydrophobicContact CG2-CD2 4.21Å; T234-L284 HydrophobicContact CG2-CB 3.93Å; T234-L284 HydrophobicContact CG2-CD1 4.39Å
235	S	98.3	Very high	94.6	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-56.4	-49.3	176.9	179.7	0	0	0	0	111.7	G231 L232 S237 I238 S239 S430	G231-S235 PolarHBondContact O-N 3.42Å; L232-S235 WeakPolarHBondContact O-CB 3.2Å; L232-S235 PolarHBondContact O-N 2.94Å; L232-S235 VanDerWaalsContact O-N 3.15Å; S235-S237 VanDerWaalsContact C-N 3.35Å; S235-S237 PolarHBondContact O-N 2.88Å; S235-I238 PolarHBondContact O-N 2.78Å; S235-S239 WeakPolarHBondContact O-CB 3.09Å; S235-S239 PolarHBondContact O-N 3.18Å; S235-S430 VanDerWaalsContact CA-OG 3.31Å; S235-S430 WeakPolarHBondContact CA-OG 3.42Å; S235-S430 WeakPolarHBondContact CB-OG 3.39Å; S235-S430 PolarHBondContact O-OG 3.15Å; S235-S430 PolarHBondContact OG-OG 3.33Å
236	I	97.3	Very high	94.6	Very high	31 Å²	31	22 Å²	22	16%	0.159	10%	0.101	C	C	.	.	H	α-helix	trans	-60.5	-45.1	177.1	-65.9	165.4	0	0	0	110.7	W190 L232 T234 I238 S239 I240	W190-I236 HydrophobicContact CH2-CD1 3.93Å; W190-I236 HydrophobicContact CZ2-CD1 3.84Å; L232-I236 HydrophobicContact CD1-CD1 4.08Å; L232-I236 HydrophobicContact CD1-CG1 4.48Å; L232-I236 HydrophobicContact CG-CD1 4.15Å; L232-I236 WeakPolarHBondContact O-CG1 3.49Å; L232-I236 PolarHBondContact O-N 2.73Å; L232-I236 VanDerWaalsContact O-N 3.07Å; T234-I236 PolarHBondContact O-N 3.16Å; I236-I238 VanDerWaalsContact C-N 3.34Å; I236-I238 PolarHBondContact O-N 2.69Å; I236-S239 WeakPolarHBondContact O-CB 3.26Å; I236-S239 PolarHBondContact O-N 2.73Å; I236-I240 HydrophobicContact CG2-CD1 3.78Å; I236-I240 HydrophobicContact CG2-CG1 4.43Å; I236-I240 VanDerWaalsContact O-CG1 3.26Å; I236-I240 WeakPolarHBondContact O-CG1 3.42Å; I236-I240 PolarHBondContact O-N 3.44Å
237	S	96.7	Very high	94.4	Very high	9 Å²	9	24.1 Å²	24.1	6%	0.063	12%	0.121	C	C	.	.	H	α-helix	trans	-62	-40.5	179.4	-69.4	0	0	0	0	112.8	H233 T234 S235 A241 R267	H233-S237 WeakPolarHBondContact O-CB 3.45Å; H233-S237 PolarHBondContact O-N 3.23Å; H233-S237 PolarHBondContact O-OG 2.95Å; T234-S237 WeakPolarHBondContact O-CB 3.41Å; T234-S237 PolarHBondContact O-N 3.29Å; S235-S237 VanDerWaalsContact C-N 3.35Å; S235-S237 PolarHBondContact O-N 2.88Å; S237-A241 PolarHBondContact O-N 3.43Å; S237-A241 VanDerWaalsContact O-N 3.09Å; S237-R267 PolarHBondContact OG-NH1 3.44Å
238	I	97.8	Very high	94.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.1	-44.2	175.9	-69	161.3	0	0	0	110.1	T234 S235 I236 I240 A241 A242 F264 F268 L281 L284 E433 V434	T234-I238 HydrophobicContact CG2-CD1 3.67Å; T234-I238 HydrophobicContact CG2-CG1 4.39Å; T234-I238 WeakPolarHBondContact O-CG1 3.27Å; T234-I238 PolarHBondContact O-N 2.86Å; S235-I238 PolarHBondContact O-N 2.78Å; I236-I238 VanDerWaalsContact C-N 3.34Å; I236-I238 PolarHBondContact O-N 2.69Å; I238-I240 VanDerWaalsContact C-N 3.34Å; I238-I240 PolarHBondContact O-N 3.42Å; I238-A241 PolarHBondContact O-N 2.81Å; I238-A242 VanDerWaalsContact O-CB 3.32Å; I238-A242 WeakPolarHBondContact O-CB 3.47Å; I238-A242 PolarHBondContact O-N 3.45Å; I238-F264 HydrophobicContact CG1-CE2 4.23Å; I238-F268 HydrophobicContact CD1-CZ 4.35Å; I238-F268 HydrophobicContact CG1-CE2 3.65Å; I238-F268 HydrophobicContact CG1-CZ 3.67Å; I238-L281 HydrophobicContact CD1-CD2 4.04Å; I238-L284 HydrophobicContact CD1-CD1 4.42Å; I238-L284 HydrophobicContact CD1-CD2 3.62Å; I238-E433 HydrophobicContact CG2-CB 3.66Å; I238-V434 HydrophobicContact CD1-CG2 3.6Å; I238-V434 HydrophobicContact CG1-CG2 4.38Å
239	S	97.1	Very high	93.7	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.014	16%	0.16	C	C	.	.	H	α-helix	trans	-58.4	-44.7	177.7	-179.4	0	0	0	0	112.9	E176 S235 I236 A241 A242 N243 R426	E176-S239 PolarHBondContact O-OG 3.31Å; E176-S239 WeakPolarHBondContact OE2-CB 3.15Å; E176-S239 PolarHBondContact OE2-OG 2.81Å; S235-S239 WeakPolarHBondContact O-CB 3.09Å; S235-S239 PolarHBondContact O-N 3.18Å; I236-S239 WeakPolarHBondContact O-CB 3.26Å; I236-S239 PolarHBondContact O-N 2.73Å; S239-A241 VanDerWaalsContact C-N 3.34Å; S239-A242 PolarHBondContact O-N 3.24Å; S239-N243 WeakPolarHBondContact O-CB 3.43Å; S239-N243 PolarHBondContact O-N 2.73Å; S239-N243 PolarHBondContact O-ND2 3.43Å; S239-R426 PolarHBondContact OG-NH2 3.37Å
240	I	94.4	Very high	93	Very high	34 Å²	34	33.3 Å²	33.3	17%	0.174	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-41.6	176.5	-68.3	169.7	0	0	0	110.9	Y178 I236 I238 N243 S244 M263	Y178-I240 HydrophobicContact CD2-CG2 3.65Å; Y178-I240 HydrophobicContact CG-CG2 4.38Å; I236-I240 HydrophobicContact CG2-CD1 3.78Å; I236-I240 HydrophobicContact CG2-CG1 4.43Å; I236-I240 VanDerWaalsContact O-CG1 3.26Å; I236-I240 WeakPolarHBondContact O-CG1 3.42Å; I236-I240 PolarHBondContact O-N 3.44Å; I238-I240 VanDerWaalsContact C-N 3.34Å; I238-I240 PolarHBondContact O-N 3.42Å; I240-N243 CarbonylContact O-C 3.59Å; I240-S244 PolarHBondContact O-N 2.84Å; I240-S244 PolarHBondContact O-OG 3.27Å; I240-M263 HydrophobicContact CG2-SD 3.97Å
241	A	96.6	Very high	92	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.2	-42.5	176.8	0	0	0	0	0	111.6	S237 I238 S239 N260 M263 F264 F437	S237-A241 PolarHBondContact O-N 3.43Å; S237-A241 VanDerWaalsContact O-N 3.09Å; I238-A241 PolarHBondContact O-N 2.81Å; S239-A241 VanDerWaalsContact C-N 3.34Å; A241-N260 PolarHBondContact O-N 3.47Å; A241-M263 HydrophobicContact CB-CB 4.48Å; A241-M263 HydrophobicContact CB-CG 4.36Å; A241-M263 HydrophobicContact CB-SD 4.31Å; A241-F264 HydrophobicContact CB-CB 4.29Å; A241-F437 HydrophobicContact CB-CE2 4.14Å; A241-F437 HydrophobicContact CB-CZ 3.8Å
242	A	97.4	Very high	90.9	Very high	4 Å²	4	44.7 Å²	44.7	3%	0.033	28%	0.275	C	S	.	.	H	α-helix	trans	-67.7	-37.6	-178.5	0	0	0	0	0	112.3	I238 S239 F258 R259 E433 F437	I238-A242 VanDerWaalsContact O-CB 3.32Å; I238-A242 WeakPolarHBondContact O-CB 3.47Å; I238-A242 PolarHBondContact O-N 3.45Å; S239-A242 PolarHBondContact O-N 3.24Å; A242-F258 CarbonylContact O-C 3.45Å; A242-R259 WeakPolarHBondContact O-CG 3.27Å; A242-E433 HydrophobicContact CB-CB 4.12Å; A242-E433 HydrophobicContact CB-CG 3.65Å; A242-E433 WeakPolarHBondContact CB-OE2 3.41Å; A242-F437 HydrophobicContact CB-CE2 3.99Å; A242-F437 HydrophobicContact CB-CZ 4.22Å
243	N	95.2	Very high	89.9	Confident	59 Å²	59	47.7 Å²	47.7	32%	0.316	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	60.9	-179.1	-54.1	-74	0	0	0	109.3	R177 Y178 S239 I240 W257	R177-N243 HydrophobicContact CB-CB 3.51Å; Y178-N243 WeakPolarHBondContact CB-O 3.34Å; Y178-N243 PolarHBondContact N-O 2.96Å; S239-N243 WeakPolarHBondContact O-CB 3.43Å; S239-N243 PolarHBondContact O-N 2.73Å; S239-N243 PolarHBondContact O-ND2 3.43Å; I240-N243 CarbonylContact O-C 3.59Å; N243-W257 HydrophobicContact CB-CE3 4.27Å; N243-W257 VanDerWaalsContact O-CE3 3.3Å; N243-W257 WeakPolarHBondContact O-CZ3 2.92Å
244	S	93.7	Very high	89.2	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.021	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	154.7	173.2	-81.9	0	0	0	0	111	I240 W257 F258 N260	I240-S244 PolarHBondContact O-N 2.84Å; I240-S244 PolarHBondContact O-OG 3.27Å; S244-W257 CarbonylContact O-C 3.37Å; S244-W257 VanDerWaalsContact O-CA 3.28Å; S244-W257 WeakPolarHBondContact O-CA 2.94Å; S244-F258 WeakPolarHBondContact CB-O 3.22Å; S244-F258 PolarHBondContact N-O 3.21Å; S244-F258 WeakPolarHBondContact O-CD1 3.49Å; S244-F258 PolarHBondContact O-N 3.11Å; S244-N260 WeakPolarHBondContact OG-CB 3.5Å
245	Y	90	Very high	88.6	Confident	71 Å²	71	55 Å²	55	28%	0.278	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134	-176.4	-175	-110.5	0	0	0	112	P247 G255 W257	Y245-P247 HydrophobicContact CE1-CB 4.11Å; Y245-G255 VanDerWaalsContact OH-CA 3.3Å; Y245-G255 WeakPolarHBondContact OH-CA 2.99Å; Y245-G255 PolarHBondContact OH-N 3Å; Y245-W257 AromaticContact CD2-CD2 3.98Å; Y245-W257 HydrophobicContact CD2-CD2 3.98Å; Y245-W257 AromaticContact CD2-CE2 3.64Å; Y245-W257 HydrophobicContact CD2-CE3 4.43Å; Y245-W257 HydrophobicContact CD2-CG 4.38Å; Y245-W257 HydrophobicContact CD2-CH2 4.28Å; Y245-W257 AromaticContact CD2-CZ2 3.8Å; Y245-W257 HydrophobicContact CD2-CZ2 3.8Å; Y245-W257 AromaticContact CD2-NE1 3.89Å; Y245-W257 HydrophobicContact CE2-CZ2 4.46Å; Y245-W257 HydrophobicContact CG-CH2 4.35Å; Y245-W257 HydrophobicContact CG-CZ2 4.28Å
246	K	86.9	Confident	88.2	Confident	105 Å²	105	61 Å²	61	46%	0.457	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	115.7	168.2	-87.7	163.5	-177	173.7	0	108.7	G255 E256 F258	K246-G255 CarbonylContact O-C 3.54Å; K246-G255 WeakPolarHBondContact O-CA 3.29Å; K246-E256 PolarHBondContact N-O 3.12Å; K246-E256 PolarHBondContact O-N 2.67Å; K246-F258 HydrophobicContact CB-CD1 4.25Å; K246-F258 HydrophobicContact CB-CE1 4.17Å; K246-F258 HydrophobicContact CD-CD1 3.67Å; K246-F258 HydrophobicContact CD-CD2 4.41Å; K246-F258 HydrophobicContact CD-CE1 3.57Å; K246-F258 HydrophobicContact CD-CE2 4.29Å; K246-F258 HydrophobicContact CD-CG 4.14Å; K246-F258 HydrophobicContact CD-CZ 3.9Å; K246-F258 HydrophobicContact CG-CD1 3.83Å; K246-F258 HydrophobicContact CG-CE1 3.41Å; K246-F258 VanDerWaalsContact CG-CE1 3.41Å; K246-F258 HydrophobicContact CG-CZ 3.98Å
247	P	84.2	Confident	87.9	Confident	95 Å²	95	63.4 Å²	63.4	62%	0.617	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-64.7	151	175.1	27.1	-32.9	0	0	0	110.9	Y245	Y245-P247 HydrophobicContact CE1-CB 4.11Å
248	A	85.3	Confident	87.9	Confident	14 Å²	14	64.8 Å²	64.8	12%	0.116	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-57.8	141.6	178	0	0	0	0	0	111.5	G250 G251 M252 G253	A248-G250 PolarHBondContact O-N 3.33Å; A248-G251 PolarHBondContact O-N 2.01Å; A248-M252 WeakPolarHBondContact CB-O 3.32Å; A248-G253 WeakPolarHBondContact CB-O 2.95Å
249	P	80.6	Confident	87.8	Confident	128 Å²	128	70 Å²	70	83%	0.831	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-54.1	126.3	175.5	-22.8	32.2	0	0	0	111.1	G251	P249-G251 PolarHBondContact O-N 2.01Å
250	G	79.2	Confident	87.8	Confident	86 Å²	86	71.4 Å²	71.4	89%	0.887	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	73.7	6.8	-179.1	0	0	0	0	0	115.5	A248 M252	A248-G250 PolarHBondContact O-N 3.33Å; G250-M252 PolarHBondContact O-N 3.16Å
251	G	73.6	Confident	87.8	Confident	68 Å²	68	71.3 Å²	71.3	70%	0.701	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	72.7	6.1	177	0	0	0	0	0	115	A248 P249	A248-G251 PolarHBondContact O-N 2.01Å; P249-G251 PolarHBondContact O-N 2.01Å
252	M	73.1	Confident	87.7	Confident	173 Å²	173	77.1 Å²	77.1	85%	0.852	45%	0.445	S	S	*	.			trans	-105.9	117.5	172.6	-79.2	-175.2	176.1	0	0	109.8	A248 G250	A248-M252 WeakPolarHBondContact CB-O 3.32Å; G250-M252 PolarHBondContact O-N 3.16Å
253	G	76.8	Confident	87.6	Confident	65 Å²	65	78.9 Å²	78.9	67%	0.67	45%	0.453	S	S	*	.	S	Bend	trans	116.1	174.3	179.3	0	0	0	0	0	113.4	A248	A248-G253 WeakPolarHBondContact CB-O 2.95Å
254	E	81.1	Confident	87.6	Confident	189 Å²	189	76.5 Å²	76.5	88%	0.883	44%	0.44	S	S	*	.			trans	-76.9	134	174.4	-66.1	-173.9	166.2	0	0	109.9
255	G	84.3	Confident	87.6	Confident	19 Å²	19	78.6 Å²	78.6	20%	0.196	45%	0.449	C	S	.	.			trans	-75.5	169.6	171.4	0	0	0	0	0	112	Y245 K246	Y245-G255 VanDerWaalsContact OH-CA 3.3Å; Y245-G255 WeakPolarHBondContact OH-CA 2.99Å; Y245-G255 PolarHBondContact OH-N 3Å; K246-G255 CarbonylContact O-C 3.54Å; K246-G255 WeakPolarHBondContact O-CA 3.29Å
256	E	91	Very high	87.8	Confident	127 Å²	127	83 Å²	83	59%	0.593	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.2	-175.3	-171.6	-174.8	178.8	0	0	111	K246	K246-E256 PolarHBondContact N-O 3.12Å; K246-E256 PolarHBondContact O-N 2.67Å
257	W	91.9	Very high	88	Confident	80 Å²	80	81.9 Å²	81.9	30%	0.303	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128	166.9	-66.8	91.7	0	0	0	109.7	E91 R177 Y178 N243 S244 Y245	E91-W257 HydrophobicContact CG-CZ2 4.43Å; E91-W257 WeakPolarHBondContact OE2-CZ2 3.48Å; R177-W257 HydrophobicContact CB-CE3 4.44Å; R177-W257 HydrophobicContact CB-CH2 4.27Å; R177-W257 HydrophobicContact CB-CZ3 3.8Å; R177-W257 VanDerWaalsContact CD-CZ3 3.48Å; R177-W257 HydrophobicContact CG-CH2 3.59Å; R177-W257 HydrophobicContact CG-CZ2 4.39Å; R177-W257 HydrophobicContact CG-CZ3 3.65Å; Y178-W257 WeakPolarHBondContact O-CH2 3.45Å; N243-W257 HydrophobicContact CB-CE3 4.27Å; N243-W257 VanDerWaalsContact O-CE3 3.3Å; N243-W257 WeakPolarHBondContact O-CZ3 2.92Å; S244-W257 CarbonylContact O-C 3.37Å; S244-W257 VanDerWaalsContact O-CA 3.28Å; S244-W257 WeakPolarHBondContact O-CA 2.94Å; Y245-W257 AromaticContact CD2-CD2 3.98Å; Y245-W257 HydrophobicContact CD2-CD2 3.98Å; Y245-W257 AromaticContact CD2-CE2 3.64Å; Y245-W257 HydrophobicContact CD2-CE3 4.43Å; Y245-W257 HydrophobicContact CD2-CG 4.38Å; Y245-W257 HydrophobicContact CD2-CH2 4.28Å; Y245-W257 AromaticContact CD2-CZ2 3.8Å; Y245-W257 HydrophobicContact CD2-CZ2 3.8Å; Y245-W257 AromaticContact CD2-NE1 3.89Å; Y245-W257 HydrophobicContact CE2-CZ2 4.46Å; Y245-W257 HydrophobicContact CG-CH2 4.35Å; Y245-W257 HydrophobicContact CG-CZ2 4.28Å
258	F	94.9	Very high	88.4	Confident	39 Å²	39	77.8 Å²	77.8	17%	0.171	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	158.6	-175	76.7	-71	0	0	0	111.8	A242 S244 K246 N260	A242-F258 CarbonylContact O-C 3.45Å; S244-F258 WeakPolarHBondContact CB-O 3.22Å; S244-F258 PolarHBondContact N-O 3.21Å; S244-F258 WeakPolarHBondContact O-CD1 3.49Å; S244-F258 PolarHBondContact O-N 3.11Å; K246-F258 HydrophobicContact CB-CD1 4.25Å; K246-F258 HydrophobicContact CB-CE1 4.17Å; K246-F258 HydrophobicContact CD-CD1 3.67Å; K246-F258 HydrophobicContact CD-CD2 4.41Å; K246-F258 HydrophobicContact CD-CE1 3.57Å; K246-F258 HydrophobicContact CD-CE2 4.29Å; K246-F258 HydrophobicContact CD-CG 4.14Å; K246-F258 HydrophobicContact CD-CZ 3.9Å; K246-F258 HydrophobicContact CG-CD1 3.83Å; K246-F258 HydrophobicContact CG-CE1 3.41Å; K246-F258 VanDerWaalsContact CG-CE1 3.41Å; K246-F258 HydrophobicContact CG-CZ 3.98Å; F258-N260 HydrophobicContact CD2-CB 4.48Å; F258-N260 HydrophobicContact CE2-CB 3.68Å; F258-N260 HydrophobicContact CZ-CB 3.88Å; F258-N260 PolarHBondContact O-N 2.6Å
259	R	96.6	Very high	88.6	Confident	109 Å²	109	77.8 Å²	77.8	41%	0.411	43%	0.43	S	S	.	.			trans	-79	113	171	-71	-175.1	175.1	84.2	5.6	110.1	A242 V261 E433 F437 L440	A242-R259 WeakPolarHBondContact O-CG 3.27Å; R259-V261 PolarHBondContact O-N 3.47Å; R259-E433 IonicContact CZ-OE1 3.75Å; R259-E433 IonicContact CZ-OE2 3.52Å; R259-E433 IonicContact NE-OE1 3.56Å; R259-E433 IonicContact NE-OE2 3.71Å; R259-E433 PolarHBondContact NE-OE2 3.32Å; R259-E433 IonicContact NH2-OE1 2.73Å; R259-E433 PolarHBondContact NH2-OE1 3.33Å; R259-E433 IonicContact NH2-OE2 3.29Å; R259-E433 PolarHBondContact NH2-OE2 3.47Å; R259-F437 HydrophobicContact CB-CE1 3.92Å; R259-F437 HydrophobicContact CB-CZ 4.21Å; R259-F437 HydrophobicContact CG-CZ 4.49Å; R259-L440 HydrophobicContact CB-CD1 4.14Å
260	N	95.9	Very high	88.9	Confident	31 Å²	31	73.2 Å²	73.2	17%	0.166	40%	0.4	C	S	.	.			trans	-86.5	87.6	178.8	-169.7	-21.4	0	0	0	111.1	A241 S244 F258 D262 M263 F264	A241-N260 PolarHBondContact O-N 3.47Å; S244-N260 WeakPolarHBondContact OG-CB 3.5Å; F258-N260 HydrophobicContact CD2-CB 4.48Å; F258-N260 HydrophobicContact CE2-CB 3.68Å; F258-N260 HydrophobicContact CZ-CB 3.88Å; F258-N260 PolarHBondContact O-N 2.6Å; N260-D262 VanDerWaalsContact C-N 3.3Å; N260-D262 PolarHBondContact O-N 3.23Å; N260-D262 PolarHBondContact OD1-N 3.49Å; N260-M263 HydrophobicContact CB-CB 3.97Å; N260-M263 VanDerWaalsContact CG-CB 3.45Å; N260-M263 PolarHBondContact O-N 3.47Å; N260-M263 WeakPolarHBondContact OD1-CB 3.25Å; N260-M263 PolarHBondContact OD1-N 2.94Å; N260-F264 PolarHBondContact O-N 2.94Å; N260-F264 VanDerWaalsContact O-N 3.09Å
261	V	95.7	Very high	89.4	Confident	32 Å²	32	76.7 Å²	76.7	19%	0.194	39%	0.391	C	S	.	.	H	α-helix	trans	-61.7	-36.8	-178.8	-176.5	0	0	0	0	111.9	R259 F264 K265 F437 L440 L441	R259-V261 PolarHBondContact O-N 3.47Å; V261-F264 PolarHBondContact O-N 2.89Å; V261-K265 HydrophobicContact CG1-CD 4.35Å; V261-K265 PolarHBondContact O-N 2.96Å; V261-F437 HydrophobicContact CG2-CD1 4.29Å; V261-F437 HydrophobicContact CG2-CE1 4.35Å; V261-L440 HydrophobicContact CG2-CB 4.06Å; V261-L440 HydrophobicContact CG2-CD1 3.88Å; V261-L441 HydrophobicContact CG1-CD2 3.36Å; V261-L441 HydrophobicContact CG1-CG 4.03Å
262	D	94.6	Very high	90.1	Very high	122 Å²	122	79.3 Å²	79.3	65%	0.652	38%	0.38	S	S	*	.	H	α-helix	trans	-66.6	-41.3	178.7	-62.3	-42.1	0	0	0	111.7	N260 F264 K265 Y266	N260-D262 VanDerWaalsContact C-N 3.3Å; N260-D262 PolarHBondContact O-N 3.23Å; N260-D262 PolarHBondContact OD1-N 3.49Å; D262-F264 VanDerWaalsContact C-N 3.33Å; D262-K265 PolarHBondContact O-N 3.47Å; D262-Y266 WeakPolarHBondContact O-CB 3.38Å; D262-Y266 PolarHBondContact O-N 2.74Å
263	M	94.8	Very high	90.9	Very high	42 Å²	42	71.7 Å²	71.7	21%	0.207	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-42.4	174.3	-176.1	179.9	-62.3	0	0	111.2	I240 A241 N260 Y266 R267	I240-M263 HydrophobicContact CG2-SD 3.97Å; A241-M263 HydrophobicContact CB-CB 4.48Å; A241-M263 HydrophobicContact CB-CG 4.36Å; A241-M263 HydrophobicContact CB-SD 4.31Å; N260-M263 HydrophobicContact CB-CB 3.97Å; N260-M263 VanDerWaalsContact CG-CB 3.45Å; N260-M263 PolarHBondContact O-N 3.47Å; N260-M263 WeakPolarHBondContact OD1-CB 3.25Å; N260-M263 PolarHBondContact OD1-N 2.94Å; M263-Y266 PolarHBondContact O-N 3.06Å; M263-R267 WeakPolarHBondContact O-CB 3.03Å; M263-R267 WeakPolarHBondContact O-CG 3.49Å; M263-R267 PolarHBondContact O-N 3.47Å; M263-R267 VanDerWaalsContact O-N 3.14Å
264	F	95	Very high	91.4	Very high	8 Å²	8	75.5 Å²	75.5	4%	0.035	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-49.5	176.4	-176.7	-89.7	0	0	0	111.2	I238 A241 N260 V261 D262 Y266 R267 F268 V434 F437 L441	I238-F264 HydrophobicContact CG1-CE2 4.23Å; A241-F264 HydrophobicContact CB-CB 4.29Å; N260-F264 PolarHBondContact O-N 2.94Å; N260-F264 VanDerWaalsContact O-N 3.09Å; V261-F264 PolarHBondContact O-N 2.89Å; D262-F264 VanDerWaalsContact C-N 3.33Å; F264-Y266 PolarHBondContact O-N 3.42Å; F264-R267 PolarHBondContact O-N 3.23Å; F264-F268 HydrophobicContact CD1-CD2 4.45Å; F264-F268 AromaticContact CD2-CD2 3.52Å; F264-F268 HydrophobicContact CD2-CD2 3.52Å; F264-F268 AromaticContact CD2-CE2 3.87Å; F264-F268 HydrophobicContact CD2-CE2 3.87Å; F264-F268 HydrophobicContact CE1-CB 4.44Å; F264-F268 HydrophobicContact CE1-CD2 4.47Å; F264-F268 AromaticContact CE2-CD2 3.56Å; F264-F268 HydrophobicContact CE2-CD2 3.56Å; F264-F268 AromaticContact CE2-CE2 3.99Å; F264-F268 HydrophobicContact CE2-CE2 3.99Å; F264-F268 HydrophobicContact CE2-CG 4.37Å; F264-F268 AromaticContact CG-CD2 4Å; F264-F268 HydrophobicContact CG-CD2 4Å; F264-F268 HydrophobicContact CZ-CB 4.42Å; F264-F268 HydrophobicContact CZ-CD2 4.06Å; F264-F268 WeakPolarHBondContact O-CD2 3.32Å; F264-F268 PolarHBondContact O-N 3.25Å; F264-V434 HydrophobicContact CE2-CG2 4.37Å; F264-F437 HydrophobicContact CB-CD1 3.82Å; F264-F437 HydrophobicContact CB-CD2 4.32Å; F264-F437 HydrophobicContact CB-CE1 3.86Å; F264-F437 HydrophobicContact CB-CE2 4.35Å; F264-F437 HydrophobicContact CB-CG 4.07Å; F264-F437 HydrophobicContact CB-CZ 4.12Å; F264-F437 HydrophobicContact CD1-CB 3.82Å; F264-F437 HydrophobicContact CD1-CD1 4.31Å; F264-F437 HydrophobicContact CD1-CD2 4.47Å; F264-F437 AromaticContact CD1-CG 3.97Å; F264-F437 HydrophobicContact CD1-CG 3.97Å; F264-F437 HydrophobicContact CD2-CB 4.07Å; F264-F437 HydrophobicContact CD2-CD1 4.22Å; F264-F437 AromaticContact CD2-CD2 3.25Å; F264-F437 HydrophobicContact CD2-CD2 3.25Å; F264-F437 AromaticContact CD2-CE2 3.64Å; F264-F437 HydrophobicContact CD2-CE2 3.64Å; F264-F437 AromaticContact CD2-CG 3.59Å; F264-F437 HydrophobicContact CD2-CG 3.59Å; F264-F437 HydrophobicContact CD2-CZ 4.27Å; F264-F437 HydrophobicContact CE1-CB 3.78Å; F264-F437 HydrophobicContact CE1-CG 4.31Å; F264-F437 HydrophobicContact CE2-CB 4.03Å; F264-F437 AromaticContact CE2-CD2 3.56Å; F264-F437 HydrophobicContact CE2-CD2 3.56Å; F264-F437 HydrophobicContact CE2-CE2 4.29Å; F264-F437 AromaticContact CE2-CG 3.96Å; F264-F437 HydrophobicContact CE2-CG 3.96Å; F264-F437 HydrophobicContact CG-CB 3.97Å; F264-F437 AromaticContact CG-CD1 3.86Å; F264-F437 HydrophobicContact CG-CD1 3.86Å; F264-F437 AromaticContact CG-CD2 3.77Å; F264-F437 HydrophobicContact CG-CD2 3.77Å; F264-F437 HydrophobicContact CG-CE1 4.29Å; F264-F437 HydrophobicContact CG-CE2 4.2Å; F264-F437 AromaticContact CG-CG 3.59Å; F264-F437 HydrophobicContact CG-CG 3.59Å; F264-F437 HydrophobicContact CG-CZ 4.44Å; F264-F437 HydrophobicContact CZ-CB 3.88Å; F264-F437 HydrophobicContact CZ-CD2 4.29Å; F264-F437 HydrophobicContact CZ-CG 4.31Å; F264-L441 HydrophobicContact CD1-CD1 4.15Å; F264-L441 HydrophobicContact CE1-CD1 4.16Å
265	K	93.1	Very high	91.5	Very high	47 Å²	47	72 Å²	72	20%	0.204	34%	0.336	C	S	.	.	H	α-helix	trans	-53.3	-54	174.6	-84.3	168.9	146.1	141.3	0	111.5	V261 D262 R267 F268 D269 L441	V261-K265 HydrophobicContact CG1-CD 4.35Å; V261-K265 PolarHBondContact O-N 2.96Å; D262-K265 PolarHBondContact O-N 3.47Å; K265-R267 PolarHBondContact O-N 3.02Å; K265-R267 VanDerWaalsContact O-N 3.15Å; K265-F268 PolarHBondContact O-N 3.43Å; K265-D269 WeakPolarHBondContact O-CB 3.44Å; K265-D269 PolarHBondContact O-N 2.9Å; K265-L441 HydrophobicContact CD-CD2 3.56Å; K265-L441 HydrophobicContact CG-CD1 4.49Å; K265-L441 HydrophobicContact CG-CD2 3.63Å
266	Y	94.1	Very high	91.6	Very high	164 Å²	164	74.9 Å²	74.9	64%	0.643	34%	0.344	S	S	*	.	H	α-helix	trans	-59.9	-31	-177.5	-174.9	-98.4	0	0	0	113.2	D262 M263 F264 Y272	D262-Y266 WeakPolarHBondContact O-CB 3.38Å; D262-Y266 PolarHBondContact O-N 2.74Å; M263-Y266 PolarHBondContact O-N 3.06Å; F264-Y266 PolarHBondContact O-N 3.42Å; Y266-Y272 HydrophobicContact CD2-CD1 4.45Å; Y266-Y272 HydrophobicContact CD2-CG 4.41Å
267	R	92.4	Very high	91.5	Very high	81 Å²	81	68.9 Å²	68.9	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-88.4	-25.6	-177.6	-71.8	-171.2	-177.9	-141.6	3.4	115	S237 M263 F264 K265 T273 R280	S237-R267 PolarHBondContact OG-NH1 3.44Å; M263-R267 WeakPolarHBondContact O-CB 3.03Å; M263-R267 WeakPolarHBondContact O-CG 3.49Å; M263-R267 PolarHBondContact O-N 3.47Å; M263-R267 VanDerWaalsContact O-N 3.14Å; F264-R267 PolarHBondContact O-N 3.23Å; K265-R267 PolarHBondContact O-N 3.02Å; K265-R267 VanDerWaalsContact O-N 3.15Å; R267-T273 VanDerWaalsContact O-CG2 3.29Å; R267-T273 WeakPolarHBondContact O-CG2 3.44Å; R267-R280 PolarHBondContact O-NH1 2.88Å
268	F	92.7	Very high	91.3	Very high	9 Å²	9	66.9 Å²	66.9	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-130.2	-12.2	-168.9	-58.9	-64.1	0	0	0	115.4	T234 I238 F264 K265 G277 R280 L281	T234-F268 HydrophobicContact CG2-CE1 3.64Å; T234-F268 HydrophobicContact CG2-CZ 4.01Å; I238-F268 HydrophobicContact CD1-CZ 4.35Å; I238-F268 HydrophobicContact CG1-CE2 3.65Å; I238-F268 HydrophobicContact CG1-CZ 3.67Å; F264-F268 HydrophobicContact CD1-CD2 4.45Å; F264-F268 AromaticContact CD2-CD2 3.52Å; F264-F268 HydrophobicContact CD2-CD2 3.52Å; F264-F268 AromaticContact CD2-CE2 3.87Å; F264-F268 HydrophobicContact CD2-CE2 3.87Å; F264-F268 HydrophobicContact CE1-CB 4.44Å; F264-F268 HydrophobicContact CE1-CD2 4.47Å; F264-F268 AromaticContact CE2-CD2 3.56Å; F264-F268 HydrophobicContact CE2-CD2 3.56Å; F264-F268 AromaticContact CE2-CE2 3.99Å; F264-F268 HydrophobicContact CE2-CE2 3.99Å; F264-F268 HydrophobicContact CE2-CG 4.37Å; F264-F268 AromaticContact CG-CD2 4Å; F264-F268 HydrophobicContact CG-CD2 4Å; F264-F268 HydrophobicContact CZ-CB 4.42Å; F264-F268 HydrophobicContact CZ-CD2 4.06Å; F264-F268 WeakPolarHBondContact O-CD2 3.32Å; F264-F268 PolarHBondContact O-N 3.25Å; K265-F268 PolarHBondContact O-N 3.43Å; F268-G277 CarbonylContact O-C 3.53Å; F268-G277 VanDerWaalsContact O-CA 3.27Å; F268-G277 WeakPolarHBondContact O-CA 2.98Å; F268-R280 HydrophobicContact CD1-CB 4.38Å; F268-R280 HydrophobicContact CE1-CB 4.31Å; F268-L281 HydrophobicContact CB-CD1 4.44Å; F268-L281 HydrophobicContact CD1-CD2 4.01Å; F268-L281 HydrophobicContact CD1-CG 4.17Å; F268-L281 HydrophobicContact CE1-CD2 4.35Å; F268-L281 HydrophobicContact CG-CD2 4.27Å
269	D	87.9	Confident	90.8	Very high	14 Å²	14	69 Å²	69	8%	0.075	32%	0.324	C	S	.	.			trans	-72.9	131	177.5	-168.7	-56.8	0	0	0	110.3	L21 K265 K271 Y272 T273	L21-D269 WeakPolarHBondContact CD1-OD2 3.35Å; K265-D269 WeakPolarHBondContact O-CB 3.44Å; K265-D269 PolarHBondContact O-N 2.9Å; D269-K271 PolarHBondContact O-N 3.1Å; D269-K271 VanDerWaalsContact O-N 3.14Å; D269-K271 WeakPolarHBondContact OD1-CB 3.41Å; D269-K271 PolarHBondContact OD1-N 3.49Å; D269-Y272 HydrophobicContact CB-CD2 3.8Å; D269-Y272 PolarHBondContact O-N 3.18Å; D269-Y272 VanDerWaalsContact O-N 3.15Å; D269-T273 WeakPolarHBondContact O-CB 3.29Å; D269-T273 VanDerWaalsContact O-CG2 3.31Å; D269-T273 WeakPolarHBondContact O-CG2 3.44Å; D269-T273 PolarHBondContact O-N 3Å; D269-T273 VanDerWaalsContact O-N 3.08Å; D269-T273 PolarHBondContact O-OG1 3.45Å
270	P	87.7	Confident	90.5	Very high	33 Å²	33	68 Å²	68	21%	0.214	32%	0.32	C	S	.	.	H	α-helix	trans	-52.1	-35.7	177.9	-19.8	25.3	0	0	0	113.6	T273 N274 N275 P278	P270-T273 PolarHBondContact O-N 3.3Å; P270-N274 PolarHBondContact O-N 3.06Å; P270-N274 VanDerWaalsContact O-N 3.09Å; P270-N275 VanDerWaalsContact CB-OD1 3.31Å; P270-N275 WeakPolarHBondContact CB-OD1 3.36Å; P270-N275 PolarHBondContact O-N 3.06Å; P270-P278 HydrophobicContact CB-CG 4.42Å; P270-P278 HydrophobicContact CG-CG 3.7Å
271	K	89.2	Confident	90.3	Very high	159 Å²	159	67 Å²	67	69%	0.691	32%	0.315	S	S	*	.	H	α-helix	trans	-65.5	-39	-178.5	-175.1	-179.1	178	178.5	0	112.9	D269	D269-K271 PolarHBondContact O-N 3.1Å; D269-K271 VanDerWaalsContact O-N 3.14Å; D269-K271 WeakPolarHBondContact OD1-CB 3.41Å; D269-K271 PolarHBondContact OD1-N 3.49Å
272	Y	90.1	Very high	90	Very high	123 Å²	123	67.7 Å²	67.7	48%	0.482	32%	0.315	S	S	.	.	H	α-helix	trans	-89.9	-15.1	-179.2	-63.6	-65.3	0	0	0	112.9	Y266 D269	Y266-Y272 HydrophobicContact CD2-CD1 4.45Å; Y266-Y272 HydrophobicContact CD2-CG 4.41Å; D269-Y272 HydrophobicContact CB-CD2 3.8Å; D269-Y272 PolarHBondContact O-N 3.18Å; D269-Y272 VanDerWaalsContact O-N 3.15Å
273	T	88.2	Confident	89.7	Confident	13 Å²	13	62.2 Å²	62.2	8%	0.08	29%	0.286	C	S	.	.	H	α-helix	trans	-115.1	5.8	-170.9	62.1	0	0	0	0	114.1	R267 D269 P270 N275 E276 G277	R267-T273 VanDerWaalsContact O-CG2 3.29Å; R267-T273 WeakPolarHBondContact O-CG2 3.44Å; D269-T273 WeakPolarHBondContact O-CB 3.29Å; D269-T273 VanDerWaalsContact O-CG2 3.31Å; D269-T273 WeakPolarHBondContact O-CG2 3.44Å; D269-T273 PolarHBondContact O-N 3Å; D269-T273 VanDerWaalsContact O-N 3.08Å; D269-T273 PolarHBondContact O-OG1 3.45Å; P270-T273 PolarHBondContact O-N 3.3Å; T273-N275 VanDerWaalsContact C-N 3.31Å; T273-N275 PolarHBondContact O-N 2.94Å; T273-E276 VanDerWaalsContact O-CB 3.3Å; T273-E276 WeakPolarHBondContact O-CB 3.49Å; T273-E276 WeakPolarHBondContact O-CG 3.14Å; T273-E276 PolarHBondContact O-N 2.98Å; T273-G277 WeakPolarHBondContact OG1-CA 3.45Å; T273-G277 PolarHBondContact OG1-N 3.06Å
274	N	88.9	Confident	89.7	Confident	144 Å²	144	60.2 Å²	60.2	77%	0.77	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	46.6	-172.6	-59.1	-32.4	0	0	0	112.1	P270 E276	P270-N274 PolarHBondContact O-N 3.06Å; P270-N274 VanDerWaalsContact O-N 3.09Å; N274-E276 PolarHBondContact O-N 3.27Å
275	N	83	Confident	89.5	Confident	116 Å²	116	59.9 Å²	59.9	62%	0.62	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	5.5	-176.2	-59.8	-43	0	0	0	116.8	P270 T273	P270-N275 VanDerWaalsContact CB-OD1 3.31Å; P270-N275 WeakPolarHBondContact CB-OD1 3.36Å; P270-N275 PolarHBondContact O-N 3.06Å; T273-N275 VanDerWaalsContact C-N 3.31Å; T273-N275 PolarHBondContact O-N 2.94Å
276	E	86.9	Confident	89.3	Confident	80 Å²	80	57.8 Å²	57.8	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-75.6	-26.6	178.3	-68.2	-66.2	142.7	0	0	113.4	T273 N274 E279 R280	T273-E276 VanDerWaalsContact O-CB 3.3Å; T273-E276 WeakPolarHBondContact O-CB 3.49Å; T273-E276 WeakPolarHBondContact O-CG 3.14Å; T273-E276 PolarHBondContact O-N 2.98Å; N274-E276 PolarHBondContact O-N 3.27Å; E276-E279 PolarHBondContact O-N 2.75Å; E276-R280 WeakPolarHBondContact O-CG 3.27Å; E276-R280 PolarHBondContact O-N 3.38Å
277	G	87.8	Confident	89.3	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-55.9	-51.4	-178	0	0	0	0	0	114.1	F268 T273 E279 R280 L281	F268-G277 CarbonylContact O-C 3.53Å; F268-G277 VanDerWaalsContact O-CA 3.27Å; F268-G277 WeakPolarHBondContact O-CA 2.98Å; T273-G277 WeakPolarHBondContact OG1-CA 3.45Å; T273-G277 PolarHBondContact OG1-N 3.06Å; G277-E279 VanDerWaalsContact C-N 3.31Å; G277-E279 PolarHBondContact O-N 3.31Å; G277-R280 WeakPolarHBondContact O-CB 3.46Å; G277-R280 PolarHBondContact O-N 3.34Å; G277-L281 PolarHBondContact O-N 2.95Å
278	P	87.9	Confident	89.4	Confident	38 Å²	38	46.1 Å²	46.1	25%	0.247	22%	0.221	C	C	.	.	H	α-helix	trans	-58.1	-37.8	173.2	-27.7	35	0	0	0	114.3	P270 L281 K282	P270-P278 HydrophobicContact CB-CG 4.42Å; P270-P278 HydrophobicContact CG-CG 3.7Å; P278-L281 PolarHBondContact O-N 2.59Å; P278-K282 WeakPolarHBondContact O-CG 3.17Å; P278-K282 PolarHBondContact O-N 2.9Å
279	E	84.6	Confident	89.2	Confident	84 Å²	84	46 Å²	46	39%	0.393	22%	0.22	S	C	.	.	H	α-helix	trans	-67.9	-36.1	177.7	-67.6	-57.3	128.7	0	0	112	E276 G277 K282 N283	E276-E279 PolarHBondContact O-N 2.75Å; G277-E279 VanDerWaalsContact C-N 3.31Å; G277-E279 PolarHBondContact O-N 3.31Å; E279-K282 WeakPolarHBondContact O-CB 3.21Å; E279-K282 PolarHBondContact O-N 3.38Å; E279-K282 WeakPolarHBondContact OE1-CD 3.22Å; E279-K282 WeakPolarHBondContact OE1-CE 3.16Å; E279-K282 IonicContact OE1-NZ 3.99Å; E279-K282 PolarHBondContact OE1-NZ 2.8Å; E279-N283 VanDerWaalsContact O-CG 3.25Å; E279-N283 PolarHBondContact O-N 3.07Å; E279-N283 PolarHBondContact O-ND2 3.23Å
280	R	90.8	Very high	89.3	Confident	87 Å²	87	45.3 Å²	45.3	33%	0.328	22%	0.216	S	C	.	.	H	α-helix	trans	-61.8	-45	171.4	-69	168.3	-167.9	172.2	1.3	111.5	T234 R267 F268 E276 G277 N283 L284	T234-R280 HydrophobicContact CG2-CB 4.47Å; T234-R280 WeakPolarHBondContact OG1-CB 3.45Å; T234-R280 PolarHBondContact OG1-O 2.86Å; R267-R280 PolarHBondContact O-NH1 2.88Å; F268-R280 HydrophobicContact CD1-CB 4.38Å; F268-R280 HydrophobicContact CE1-CB 4.31Å; E276-R280 WeakPolarHBondContact O-CG 3.27Å; E276-R280 PolarHBondContact O-N 3.38Å; G277-R280 WeakPolarHBondContact O-CB 3.46Å; G277-R280 PolarHBondContact O-N 3.34Å; R280-N283 WeakPolarHBondContact O-CB 3.18Å; R280-N283 PolarHBondContact O-N 3.49Å; R280-N283 VanDerWaalsContact O-N 3.1Å; R280-L284 PolarHBondContact O-N 2.9Å; R280-L284 VanDerWaalsContact O-N 3.08Å
281	L	91.6	Very high	89.6	Confident	11 Å²	11	43.7 Å²	43.7	6%	0.058	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-45.4	174.8	-66.7	177.1	0	0	0	110.9	T234 I238 F268 G277 P278 N283 L284 Y285 V434	T234-L281 HydrophobicContact CG2-CD2 4.21Å; I238-L281 HydrophobicContact CD1-CD2 4.04Å; F268-L281 HydrophobicContact CB-CD1 4.44Å; F268-L281 HydrophobicContact CD1-CD2 4.01Å; F268-L281 HydrophobicContact CD1-CG 4.17Å; F268-L281 HydrophobicContact CE1-CD2 4.35Å; F268-L281 HydrophobicContact CG-CD2 4.27Å; G277-L281 PolarHBondContact O-N 2.95Å; P278-L281 PolarHBondContact O-N 2.59Å; L281-N283 PolarHBondContact O-N 2.84Å; L281-L284 WeakPolarHBondContact O-CA 3.39Å; L281-L284 WeakPolarHBondContact O-CB 3.39Å; L281-L284 PolarHBondContact O-N 3.4Å; L281-Y285 WeakPolarHBondContact O-CD2 3.32Å; L281-Y285 PolarHBondContact O-N 3.47Å; L281-V434 HydrophobicContact CD2-CG2 3.86Å
282	K	87.9	Confident	89.7	Confident	46 Å²	46	36.4 Å²	36.4	20%	0.2	18%	0.175	C	C	.	.	H	α-helix	trans	-54.5	-38.9	172.9	-74.1	174.9	-172.7	173.4	0	112.3	F29 L36 P278 E279 L284 Y285 F286	F29-K282 HydrophobicContact CD1-CG 3.99Å; F29-K282 HydrophobicContact CE1-CD 4.13Å; F29-K282 HydrophobicContact CE1-CG 3.39Å; F29-K282 HydrophobicContact CZ-CG 3.83Å; L36-K282 HydrophobicContact CB-CB 4.38Å; L36-K282 HydrophobicContact CB-CD 4.21Å; L36-K282 HydrophobicContact CB-CG 4.1Å; L36-K282 HydrophobicContact CD1-CB 3.69Å; L36-K282 HydrophobicContact CD1-CG 4.25Å; L36-K282 WeakPolarHBondContact CD1-O 3.3Å; P278-K282 WeakPolarHBondContact O-CG 3.17Å; P278-K282 PolarHBondContact O-N 2.9Å; E279-K282 WeakPolarHBondContact O-CB 3.21Å; E279-K282 PolarHBondContact O-N 3.38Å; E279-K282 WeakPolarHBondContact OE1-CD 3.22Å; E279-K282 WeakPolarHBondContact OE1-CE 3.16Å; E279-K282 IonicContact OE1-NZ 3.99Å; E279-K282 PolarHBondContact OE1-NZ 2.8Å; K282-L284 VanDerWaalsContact C-N 3.33Å; K282-L284 PolarHBondContact O-N 3.35Å; K282-Y285 PolarHBondContact O-N 3.03Å; K282-F286 PolarHBondContact O-N 3.48Å
283	N	90	Very high	89.5	Confident	8 Å²	8	32.7 Å²	32.7	4%	0.043	16%	0.16	C	C	.	.	H	α-helix	trans	-68.2	-30.6	177.1	-67.5	-24.6	0	0	0	113.1	R227 S230 G231 E279 R280 L281 F286 V287	R227-N283 VanDerWaalsContact CG-OD1 3.23Å; R227-N283 WeakPolarHBondContact CG-OD1 3.47Å; R227-N283 PolarHBondContact NE-OD1 2.95Å; R227-N283 VanDerWaalsContact NE-OD1 3.16Å; R227-N283 WeakPolarHBondContact O-CB 3.35Å; S230-N283 VanDerWaalsContact CB-ND2 3.32Å; S230-N283 WeakPolarHBondContact CB-ND2 3.48Å; S230-N283 PolarHBondContact OG-ND2 2.9Å; G231-N283 VanDerWaalsContact CA-C 3.46Å; G231-N283 WeakPolarHBondContact CA-O 3.34Å; E279-N283 VanDerWaalsContact O-CG 3.25Å; E279-N283 PolarHBondContact O-N 3.07Å; E279-N283 PolarHBondContact O-ND2 3.23Å; R280-N283 WeakPolarHBondContact O-CB 3.18Å; R280-N283 PolarHBondContact O-N 3.49Å; R280-N283 VanDerWaalsContact O-N 3.1Å; L281-N283 PolarHBondContact O-N 2.84Å; N283-F286 WeakPolarHBondContact O-CB 3.43Å; N283-F286 PolarHBondContact O-N 3.41Å; N283-V287 WeakPolarHBondContact O-CG2 3.07Å; N283-V287 PolarHBondContact O-N 3.29Å
284	L	94.4	Very high	89.6	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.2	-53.5	169.9	-178.8	77.5	0	0	0	111.4	T234 I238 R280 L281 K282 F286 V287 F288 F427 I431 V434	T234-L284 HydrophobicContact CG2-CB 3.93Å; T234-L284 HydrophobicContact CG2-CD1 4.39Å; I238-L284 HydrophobicContact CD1-CD1 4.42Å; I238-L284 HydrophobicContact CD1-CD2 3.62Å; R280-L284 PolarHBondContact O-N 2.9Å; R280-L284 VanDerWaalsContact O-N 3.08Å; L281-L284 WeakPolarHBondContact O-CA 3.39Å; L281-L284 WeakPolarHBondContact O-CB 3.39Å; L281-L284 PolarHBondContact O-N 3.4Å; K282-L284 VanDerWaalsContact C-N 3.33Å; K282-L284 PolarHBondContact O-N 3.35Å; L284-F286 VanDerWaalsContact C-N 3.27Å; L284-F286 PolarHBondContact O-N 3.27Å; L284-V287 PolarHBondContact O-N 3.28Å; L284-F288 PolarHBondContact O-N 2.92Å; L284-F427 HydrophobicContact CD1-CD1 3.7Å; L284-F427 HydrophobicContact CD1-CE1 4.19Å; L284-I431 HydrophobicContact CD2-CG1 3.9Å; L284-I431 HydrophobicContact CG-CG1 4.3Å; L284-V434 HydrophobicContact CD2-CG2 4.2Å
285	Y	91.1	Very high	89.7	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.8	-37	179.5	-70.5	-88.6	0	0	0	112	F29 V46 D47 L281 K282 V287 F288 L289 I431	F29-Y285 HydrophobicContact CD2-CD1 4.44Å; F29-Y285 AromaticContact CD2-CD2 3.56Å; F29-Y285 HydrophobicContact CD2-CD2 3.56Å; F29-Y285 HydrophobicContact CD2-CE1 4.29Å; F29-Y285 AromaticContact CD2-CE2 3.44Å; F29-Y285 HydrophobicContact CD2-CE2 3.44Å; F29-Y285 VanDerWaalsContact CD2-CE2 3.44Å; F29-Y285 HydrophobicContact CD2-CG 4.1Å; F29-Y285 AromaticContact CD2-CZ 3.82Å; F29-Y285 AromaticContact CE2-CD2 3.83Å; F29-Y285 HydrophobicContact CE2-CD2 3.83Å; F29-Y285 AromaticContact CE2-CE2 3.52Å; F29-Y285 HydrophobicContact CE2-CE2 3.52Å; F29-Y285 HydrophobicContact CG-CD2 4.39Å; V46-Y285 HydrophobicContact CB-CD1 4.01Å; V46-Y285 HydrophobicContact CB-CE1 4.32Å; V46-Y285 HydrophobicContact CG1-CD1 3.76Å; V46-Y285 HydrophobicContact CG1-CE1 4.25Å; D47-Y285 VanDerWaalsContact OD1-CE1 3.27Å; D47-Y285 WeakPolarHBondContact OD1-CE1 3.36Å; D47-Y285 PolarHBondContact OD1-OH 3.47Å; L281-Y285 WeakPolarHBondContact O-CD2 3.32Å; L281-Y285 PolarHBondContact O-N 3.47Å; K282-Y285 PolarHBondContact O-N 3.03Å; Y285-V287 PolarHBondContact O-N 3.31Å; Y285-F288 PolarHBondContact O-N 2.89Å; Y285-L289 WeakPolarHBondContact O-CG 3.31Å; Y285-L289 PolarHBondContact O-N 3.43Å; Y285-I431 HydrophobicContact CD1-CD1 3.9Å; Y285-I431 HydrophobicContact CD1-CG1 4.17Å; Y285-I431 HydrophobicContact CE1-CB 4.5Å; Y285-I431 HydrophobicContact CE1-CD1 4.04Å; Y285-I431 HydrophobicContact CE1-CG1 3.94Å; Y285-I431 HydrophobicContact CE1-CG2 3.81Å
286	F	89	Confident	90	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.018	10%	0.096	C	C	.	.	H	α-helix	trans	-57.2	-47.9	175.4	175.4	-90.6	0	0	0	112.2	L33 L36 M224 R227 I228 K282 N283 L284 L289 L290 L341	L33-F286 HydrophobicContact CD2-CD2 3.78Å; L33-F286 HydrophobicContact CD2-CE2 3.22Å; L33-F286 HydrophobicContact CD2-CZ 3.92Å; L33-F286 HydrophobicContact CG-CD2 4.23Å; L33-F286 HydrophobicContact CG-CE2 4.06Å; L36-F286 HydrophobicContact CD1-CB 4.37Å; M224-F286 HydrophobicContact CG-CE1 4.42Å; M224-F286 HydrophobicContact CG-CZ 4.06Å; R227-F286 HydrophobicContact CB-CD1 3.92Å; R227-F286 HydrophobicContact CB-CE1 4.06Å; R227-F286 HydrophobicContact CB-CG 4.36Å; R227-F286 VanDerWaalsContact NH2-CD2 3.32Å; I228-F286 HydrophobicContact CG1-CD1 4.4Å; I228-F286 HydrophobicContact CG1-CE1 3.77Å; K282-F286 PolarHBondContact O-N 3.48Å; N283-F286 WeakPolarHBondContact O-CB 3.43Å; N283-F286 PolarHBondContact O-N 3.41Å; L284-F286 VanDerWaalsContact C-N 3.27Å; L284-F286 PolarHBondContact O-N 3.27Å; F286-L289 PolarHBondContact O-N 3.04Å; F286-L290 WeakPolarHBondContact O-CB 3.13Å; F286-L290 PolarHBondContact O-N 2.84Å; F286-L341 HydrophobicContact CZ-CD1 4.49Å
287	V	92.9	Very high	89.9	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-70.4	-41.4	-178.9	-175.5	0	0	0	0	111.2	I228 N283 L284 Y285 L289 L290 E291 I386 F427	I228-V287 HydrophobicContact CB-CG2 4.34Å; I228-V287 HydrophobicContact CG1-CG2 4.44Å; I228-V287 HydrophobicContact CG2-CG2 4.31Å; N283-V287 WeakPolarHBondContact O-CG2 3.07Å; N283-V287 PolarHBondContact O-N 3.29Å; L284-V287 PolarHBondContact O-N 3.28Å; Y285-V287 PolarHBondContact O-N 3.31Å; V287-L289 VanDerWaalsContact C-N 3.27Å; V287-L289 PolarHBondContact O-N 2.87Å; V287-L290 WeakPolarHBondContact O-CB 3.43Å; V287-L290 PolarHBondContact O-N 2.88Å; V287-E291 HydrophobicContact CG1-CG 4.41Å; V287-E291 PolarHBondContact O-N 2.92Å; V287-I386 HydrophobicContact CG1-CD1 4.28Å; V287-I386 HydrophobicContact CG1-CG1 4.24Å; V287-F427 HydrophobicContact CB-CD1 4.23Å; V287-F427 HydrophobicContact CB-CE1 3.79Å; V287-F427 HydrophobicContact CB-CE2 4.39Å; V287-F427 HydrophobicContact CB-CZ 3.9Å; V287-F427 HydrophobicContact CG1-CD1 4.3Å; V287-F427 HydrophobicContact CG1-CD2 4.1Å; V287-F427 HydrophobicContact CG1-CE1 3.71Å; V287-F427 HydrophobicContact CG1-CE2 3.47Å; V287-F427 VanDerWaalsContact CG1-CE2 3.47Å; V287-F427 HydrophobicContact CG1-CZ 3.26Å
288	F	94	Very high	89.9	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-52.3	-49	174	177.7	-114	0	0	0	111.3	V46 N50 L284 Y285 L290 E291 M292 I424 F427 I431	V46-F288 HydrophobicContact CG1-CD1 3.77Å; V46-F288 HydrophobicContact CG1-CE1 3.83Å; N50-F288 HydrophobicContact CB-CE1 4.21Å; N50-F288 HydrophobicContact CB-CZ 4.1Å; N50-F288 WeakPolarHBondContact OD1-CZ 3.33Å; L284-F288 PolarHBondContact O-N 2.92Å; Y285-F288 PolarHBondContact O-N 2.89Å; F288-L290 PolarHBondContact O-N 2.84Å; F288-E291 PolarHBondContact O-N 3.23Å; F288-M292 HydrophobicContact CD1-CG 4.36Å; F288-M292 HydrophobicContact CD2-CG 4.12Å; F288-M292 HydrophobicContact CE1-CG 4.05Å; F288-M292 HydrophobicContact CE2-CG 3.79Å; F288-M292 HydrophobicContact CE2-SD 4Å; F288-M292 HydrophobicContact CG-CG 4.4Å; F288-M292 HydrophobicContact CZ-CE 4.17Å; F288-M292 HydrophobicContact CZ-CG 3.76Å; F288-M292 HydrophobicContact CZ-SD 4.09Å; F288-M292 WeakPolarHBondContact O-CB 3.3Å; F288-M292 WeakPolarHBondContact O-CG 3.27Å; F288-M292 PolarHBondContact O-N 3.15Å; F288-I424 HydrophobicContact CE2-CG2 4.28Å; F288-F427 HydrophobicContact CB-CB 4.04Å; F288-F427 HydrophobicContact CD2-CB 3.89Å; F288-F427 HydrophobicContact CG-CB 4.44Å; F288-I431 HydrophobicContact CB-CD1 3.7Å; F288-I431 HydrophobicContact CD1-CD1 3.45Å; F288-I431 VanDerWaalsContact CD1-CD1 3.45Å; F288-I431 HydrophobicContact CD2-CD1 4.05Å; F288-I431 HydrophobicContact CE1-CD1 4.06Å; F288-I431 HydrophobicContact CG-CD1 3.44Å; F288-I431 VanDerWaalsContact CG-CD1 3.44Å
289	L	89.7	Confident	89.9	Confident	5 Å²	5	19.3 Å²	19.3	3%	0.026	9%	0.088	C	C	.	.	H	α-helix	trans	-74.4	-28.3	-177.4	-69.5	163.7	0	0	0	113.5	H31 V46 Y285 F286 V287 R293 F332	H31-L289 WeakPolarHBondContact CD2-CD1 3.41Å; H31-L289 WeakPolarHBondContact CE1-CD1 3.49Å; H31-L289 VanDerWaalsContact CG-CD1 3.49Å; H31-L289 WeakPolarHBondContact NE2-CD1 3.14Å; V46-L289 HydrophobicContact CG1-CD1 4.25Å; V46-L289 HydrophobicContact CG1-CD2 4.29Å; V46-L289 HydrophobicContact CG1-CG 4.39Å; V46-L289 HydrophobicContact CG2-CD1 3.75Å; V46-L289 HydrophobicContact CG2-CD2 4.42Å; Y285-L289 WeakPolarHBondContact O-CG 3.31Å; Y285-L289 PolarHBondContact O-N 3.43Å; F286-L289 PolarHBondContact O-N 3.04Å; V287-L289 VanDerWaalsContact C-N 3.27Å; V287-L289 PolarHBondContact O-N 2.87Å; L289-R293 WeakPolarHBondContact O-CB 3.48Å; L289-R293 PolarHBondContact O-N 2.86Å; L289-F332 HydrophobicContact CD2-CE1 4.3Å
290	L	89.3	Confident	89.9	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.8	-50.3	169.7	-177.3	77.8	0	0	0	110.8	M224 I228 F286 V287 F288 R293 A294 F336 L341 L390 L393	M224-L290 HydrophobicContact CE-CD1 3.9Å; M224-L290 HydrophobicContact CE-CD2 4.4Å; I228-L290 HydrophobicContact CD1-CD2 3.76Å; I228-L290 HydrophobicContact CG1-CD2 3.98Å; F286-L290 WeakPolarHBondContact O-CB 3.13Å; F286-L290 PolarHBondContact O-N 2.84Å; V287-L290 WeakPolarHBondContact O-CB 3.43Å; V287-L290 PolarHBondContact O-N 2.88Å; F288-L290 PolarHBondContact O-N 2.84Å; L290-R293 PolarHBondContact O-N 3.09Å; L290-A294 PolarHBondContact O-N 2.92Å; L290-A294 VanDerWaalsContact O-N 3.08Å; L290-F336 HydrophobicContact CB-CE2 4.14Å; L290-F336 HydrophobicContact CD1-CE2 3.89Å; L290-F336 HydrophobicContact CD1-CZ 3.5Å; L290-F336 VanDerWaalsContact CD1-CZ 3.5Å; L290-L341 HydrophobicContact CD1-CD2 3.86Å; L290-L390 HydrophobicContact CD2-CD2 4.1Å; L290-L393 HydrophobicContact CD1-CD1 3.31Å; L290-L393 HydrophobicContact CG-CD1 3.77Å
291	E	93.8	Very high	89.5	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-71	-38.2	-179.3	-64	-170.1	155.4	0	0	112.4	V287 F288 R293 A294 L295 I386 A389 S423 I424 F427	V287-E291 HydrophobicContact CG1-CG 4.41Å; V287-E291 PolarHBondContact O-N 2.92Å; F288-E291 PolarHBondContact O-N 3.23Å; E291-R293 VanDerWaalsContact C-N 3.27Å; E291-R293 PolarHBondContact O-N 2.79Å; E291-A294 WeakPolarHBondContact O-CA 2.89Å; E291-A294 WeakPolarHBondContact O-CB 3.43Å; E291-A294 PolarHBondContact O-N 2.92Å; E291-A294 VanDerWaalsContact O-N 3.08Å; E291-L295 PolarHBondContact O-N 2.7Å; E291-I386 WeakPolarHBondContact OE1-CG1 3.39Å; E291-A389 HydrophobicContact CB-CB 4.42Å; E291-A389 HydrophobicContact CG-CB 3.94Å; E291-S423 VanDerWaalsContact CD-OG 3.31Å; E291-S423 VanDerWaalsContact OE1-CB 3.3Å; E291-S423 WeakPolarHBondContact OE1-CB 3.08Å; E291-S423 PolarHBondContact OE1-OG 3.47Å; E291-S423 VanDerWaalsContact OE2-C 3.28Å; E291-S423 PolarHBondContact OE2-OG 3.38Å; E291-I424 HydrophobicContact CB-CD1 4.13Å; E291-I424 HydrophobicContact CB-CG1 3.52Å; E291-I424 HydrophobicContact CG-CG1 4.46Å; E291-I424 VanDerWaalsContact OE2-CA 3.31Å; E291-I424 WeakPolarHBondContact OE2-CA 3.46Å; E291-I424 WeakPolarHBondContact OE2-CG1 3.4Å; E291-I424 PolarHBondContact OE2-N 3.23Å; E291-F427 VanDerWaalsContact OE2-CD2 3.27Å; E291-F427 WeakPolarHBondContact OE2-CD2 3.14Å
292	M	91.1	Very high	89.1	Confident	6 Å²	6	18.9 Å²	18.9	3%	0.03	10%	0.095	C	C	.	.	H	α-helix	trans	-60.8	-38.3	173.9	-69.1	-62.9	-81.3	0	0	111.7	F49 I54 F288 L295 Q296 I329 I424	F49-M292 HydrophobicContact CE1-CE 3.72Å; F49-M292 HydrophobicContact CZ-CE 3.86Å; I54-M292 HydrophobicContact CD1-CE 4.38Å; I54-M292 HydrophobicContact CG1-CE 4.35Å; I54-M292 HydrophobicContact CG2-CE 4.07Å; F288-M292 HydrophobicContact CD1-CG 4.36Å; F288-M292 HydrophobicContact CD2-CG 4.12Å; F288-M292 HydrophobicContact CE1-CG 4.05Å; F288-M292 HydrophobicContact CE2-CG 3.79Å; F288-M292 HydrophobicContact CE2-SD 4Å; F288-M292 HydrophobicContact CG-CG 4.4Å; F288-M292 HydrophobicContact CZ-CE 4.17Å; F288-M292 HydrophobicContact CZ-CG 3.76Å; F288-M292 HydrophobicContact CZ-SD 4.09Å; F288-M292 WeakPolarHBondContact O-CB 3.3Å; F288-M292 WeakPolarHBondContact O-CG 3.27Å; F288-M292 PolarHBondContact O-N 3.15Å; M292-L295 PolarHBondContact O-N 3.13Å; M292-Q296 WeakPolarHBondContact O-CB 3.4Å; M292-Q296 PolarHBondContact O-N 3.43Å; M292-I329 HydrophobicContact CE-CD1 3.46Å; M292-I329 VanDerWaalsContact CE-CD1 3.46Å; M292-I329 HydrophobicContact CE-CG1 3.41Å; M292-I329 VanDerWaalsContact CE-CG1 3.41Å; M292-I329 HydrophobicContact CE-CG2 4.5Å; M292-I329 HydrophobicContact SD-CD1 4.08Å; M292-I424 HydrophobicContact SD-CG2 3.52Å; M292-I424 VanDerWaalsContact SD-CG2 3.52Å
293	R	87	Confident	88.5	Confident	44 Å²	44	21.9 Å²	21.9	17%	0.166	11%	0.109	C	C	.	.	H	α-helix	trans	-65.9	-39.6	173.2	-180	56.7	179.2	177.2	-1.7	112	L289 L290 E291 Q296 K297 F336 E338 L393	L289-R293 WeakPolarHBondContact O-CB 3.48Å; L289-R293 PolarHBondContact O-N 2.86Å; L290-R293 PolarHBondContact O-N 3.09Å; E291-R293 VanDerWaalsContact C-N 3.27Å; E291-R293 PolarHBondContact O-N 2.79Å; R293-Q296 WeakPolarHBondContact O-CB 3.45Å; R293-Q296 PolarHBondContact O-N 3.28Å; R293-K297 WeakPolarHBondContact O-CB 3.32Å; R293-K297 PolarHBondContact O-N 2.77Å; R293-F336 HydrophobicContact CB-CB 3.99Å; R293-F336 HydrophobicContact CB-CD2 3.99Å; R293-F336 HydrophobicContact CB-CG 3.94Å; R293-F336 HydrophobicContact CG-CB 3.83Å; R293-F336 HydrophobicContact CG-CD1 4.09Å; R293-F336 HydrophobicContact CG-CD2 4.42Å; R293-F336 HydrophobicContact CG-CG 3.87Å; R293-E338 IonicContact CZ-OE1 2.83Å; R293-E338 IonicContact NE-OE1 3.77Å; R293-E338 PolarHBondContact NE-OE1 3.35Å; R293-E338 IonicContact NH2-OE1 2.76Å; R293-E338 PolarHBondContact NH2-OE1 2.94Å; R293-E338 IonicContact NH2-OE2 3.34Å; R293-E338 PolarHBondContact NH2-OE2 2.69Å; R293-L393 HydrophobicContact CB-CD2 4.25Å; R293-L393 HydrophobicContact CG-CD2 3.71Å
294	A	90.1	Very high	87.5	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.1	-47.2	174.8	0	0	0	0	0	110.9	L290 E291 Q296 K297 I298 A389 I392 L393	L290-A294 PolarHBondContact O-N 2.92Å; L290-A294 VanDerWaalsContact O-N 3.08Å; E291-A294 WeakPolarHBondContact O-CA 2.89Å; E291-A294 WeakPolarHBondContact O-CB 3.43Å; E291-A294 PolarHBondContact O-N 2.92Å; E291-A294 VanDerWaalsContact O-N 3.08Å; A294-Q296 VanDerWaalsContact C-N 3.33Å; A294-Q296 PolarHBondContact O-N 3.34Å; A294-K297 WeakPolarHBondContact O-CB 3.35Å; A294-K297 PolarHBondContact O-N 3Å; A294-K297 VanDerWaalsContact O-N 3.07Å; A294-I298 PolarHBondContact O-N 3.46Å; A294-I298 VanDerWaalsContact O-N 3.08Å; A294-A389 HydrophobicContact CB-CB 3.66Å; A294-I392 HydrophobicContact CB-CB 4.1Å; A294-I392 HydrophobicContact CB-CD1 4.18Å; A294-I392 HydrophobicContact CB-CG2 3.89Å; A294-I392 WeakPolarHBondContact O-CG2 3.43Å; A294-L393 HydrophobicContact CB-CD1 4.47Å; A294-L393 HydrophobicContact CB-CD2 4.34Å; A294-L393 HydrophobicContact CB-CG 4.06Å
295	L	91.8	Very high	86.4	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.5	-43.6	176.9	-176.1	58	0	0	0	112	E291 M292 K297 I298 S299 L302 L325 I329 F421 I424	E291-L295 PolarHBondContact O-N 2.7Å; M292-L295 PolarHBondContact O-N 3.13Å; L295-K297 VanDerWaalsContact C-N 3.29Å; L295-K297 PolarHBondContact O-N 3Å; L295-I298 HydrophobicContact CD1-CD1 4.2Å; L295-I298 HydrophobicContact CD1-CG1 4.27Å; L295-I298 WeakPolarHBondContact O-CG1 3.18Å; L295-I298 PolarHBondContact O-N 3.23Å; L295-S299 PolarHBondContact O-N 2.78Å; L295-S299 VanDerWaalsContact O-N 3.1Å; L295-L302 HydrophobicContact CD1-CD1 3.96Å; L295-L325 HydrophobicContact CD2-CD2 4.05Å; L295-I329 HydrophobicContact CD2-CD1 3.57Å; L295-I329 HydrophobicContact CG-CD1 4.06Å; L295-F421 HydrophobicContact CD1-CE1 4.31Å; L295-F421 HydrophobicContact CD1-CE2 3.7Å; L295-F421 HydrophobicContact CD1-CZ 3.59Å; L295-F421 HydrophobicContact CD2-CE1 4.36Å; L295-F421 HydrophobicContact CD2-CZ 4.43Å; L295-I424 HydrophobicContact CB-CD1 3.88Å; L295-I424 HydrophobicContact CD2-CD1 3.77Å; L295-I424 HydrophobicContact CG-CD1 4.36Å
296	Q	88.1	Confident	85.7	Confident	30 Å²	30	31.7 Å²	31.7	14%	0.14	16%	0.163	C	C	.	.	H	α-helix	trans	-57.6	-42.2	173.9	-164.6	-179.4	24.1	0	0	112.1	M292 R293 A294 I298 S299 I329 D330	M292-Q296 WeakPolarHBondContact O-CB 3.4Å; M292-Q296 PolarHBondContact O-N 3.43Å; R293-Q296 WeakPolarHBondContact O-CB 3.45Å; R293-Q296 PolarHBondContact O-N 3.28Å; A294-Q296 VanDerWaalsContact C-N 3.33Å; A294-Q296 PolarHBondContact O-N 3.34Å; Q296-I298 PolarHBondContact O-N 2.62Å; Q296-S299 WeakPolarHBondContact O-CB 3.13Å; Q296-S299 PolarHBondContact O-N 2.71Å; Q296-I329 HydrophobicContact CB-CG2 3.83Å; Q296-I329 HydrophobicContact CG-CG2 4.03Å; Q296-D330 WeakPolarHBondContact CG-OD1 3.43Å; Q296-D330 PolarHBondContact NE2-OD1 3.01Å
297	K	85.5	Confident	85.3	Confident	48 Å²	48	31.5 Å²	31.5	21%	0.209	16%	0.162	C	C	.	.	H	α-helix	trans	-69.9	-31.3	-177.4	-176	174.9	-179.9	-166.3	0	113	R293 A294 L295 I392 L393 A395 L397	R293-K297 WeakPolarHBondContact O-CB 3.32Å; R293-K297 PolarHBondContact O-N 2.77Å; A294-K297 WeakPolarHBondContact O-CB 3.35Å; A294-K297 PolarHBondContact O-N 3Å; A294-K297 VanDerWaalsContact O-N 3.07Å; L295-K297 VanDerWaalsContact C-N 3.29Å; L295-K297 PolarHBondContact O-N 3Å; K297-I392 HydrophobicContact CB-CG2 4.02Å; K297-I392 HydrophobicContact CD-CG2 4.08Å; K297-I392 WeakPolarHBondContact CE-O 3.39Å; K297-I392 HydrophobicContact CG-CG2 4.17Å; K297-I392 PolarHBondContact NZ-O 3.18Å; K297-L393 PolarHBondContact NZ-O 3.41Å; K297-A395 WeakPolarHBondContact CE-O 3.39Å; K297-A395 PolarHBondContact NZ-O 3.28Å; K297-L397 HydrophobicContact CD-CD1 4.24Å; K297-L397 HydrophobicContact CG-CD1 3.68Å
298	I	88.2	Confident	84.7	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-90.7	-5.5	176.6	61.6	168.2	0	0	0	114.6	A294 L295 Q296 P300 Y301 L302 I392 F410 L412 L420	A294-I298 PolarHBondContact O-N 3.46Å; A294-I298 VanDerWaalsContact O-N 3.08Å; L295-I298 HydrophobicContact CD1-CD1 4.2Å; L295-I298 HydrophobicContact CD1-CG1 4.27Å; L295-I298 WeakPolarHBondContact O-CG1 3.18Å; L295-I298 PolarHBondContact O-N 3.23Å; Q296-I298 PolarHBondContact O-N 2.62Å; I298-P300 VanDerWaalsContact C-CD 3.41Å; I298-P300 VanDerWaalsContact C-N 3.27Å; I298-P300 VanDerWaalsContact O-N 3.11Å; I298-Y301 WeakPolarHBondContact O-CA 3.32Å; I298-Y301 WeakPolarHBondContact O-CB 3.35Å; I298-Y301 PolarHBondContact O-N 2.84Å; I298-L302 HydrophobicContact CD1-CD2 3.74Å; I298-L302 HydrophobicContact CD1-CG 4.42Å; I298-L302 HydrophobicContact CG1-CD2 4.22Å; I298-L302 HydrophobicContact CG1-CG 4.38Å; I298-L302 PolarHBondContact O-N 3.46Å; I298-I392 HydrophobicContact CD1-CD1 3.82Å; I298-I392 HydrophobicContact CG1-CD1 4.28Å; I298-I392 HydrophobicContact CG2-CB 4.08Å; I298-I392 HydrophobicContact CG2-CD1 3.57Å; I298-I392 HydrophobicContact CG2-CG1 3.48Å; I298-I392 VanDerWaalsContact CG2-CG1 3.48Å; I298-I392 HydrophobicContact CG2-CG2 3.47Å; I298-I392 VanDerWaalsContact CG2-CG2 3.47Å; I298-F410 HydrophobicContact CG2-CE1 4Å; I298-F410 HydrophobicContact CG2-CZ 4.42Å; I298-L412 HydrophobicContact CD1-CD1 3.8Å; I298-L412 HydrophobicContact CG2-CD1 4.23Å; I298-L420 HydrophobicContact CD1-CD2 3.65Å
299	S	87.4	Confident	84	Confident	32 Å²	32	36.6 Å²	36.6	22%	0.224	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-41.9	-48.1	180	152.7	0	0	0	0	113.6	L295 Q296 Y301 L302 V326	L295-S299 PolarHBondContact O-N 2.78Å; L295-S299 VanDerWaalsContact O-N 3.1Å; Q296-S299 WeakPolarHBondContact O-CB 3.13Å; Q296-S299 PolarHBondContact O-N 2.71Å; S299-Y301 PolarHBondContact O-N 3.45Å; S299-Y301 VanDerWaalsContact O-N 3.09Å; S299-L302 PolarHBondContact O-N 2.96Å; S299-V326 WeakPolarHBondContact OG-CG1 3.39Å
300	P	83.8	Confident	83.3	Confident	90 Å²	90	38.4 Å²	38.4	58%	0.584	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-64.4	-17	179.3	-23.4	35.2	0	0	0	115.4	I298 H303	I298-P300 VanDerWaalsContact C-CD 3.41Å; I298-P300 VanDerWaalsContact C-N 3.27Å; I298-P300 VanDerWaalsContact O-N 3.11Å; P300-H303 PolarHBondContact O-CE1 3.43Å; P300-H303 VanDerWaalsContact O-CE1 3.28Å
301	Y	82.7	Confident	82.9	Confident	70 Å²	70	42 Å²	42	28%	0.275	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-104.6	-2.4	-176.8	-55.9	-85.1	0	0	0	112.9	I298 S299 H303 L397 P398	I298-Y301 WeakPolarHBondContact O-CA 3.32Å; I298-Y301 WeakPolarHBondContact O-CB 3.35Å; I298-Y301 PolarHBondContact O-N 2.84Å; S299-Y301 PolarHBondContact O-N 3.45Å; S299-Y301 VanDerWaalsContact O-N 3.09Å; Y301-H303 VanDerWaalsContact C-N 3.29Å; Y301-H303 PolarHBondContact O-CD2 3.47Å; Y301-H303 VanDerWaalsContact O-CD2 3.28Å; Y301-H303 PolarHBondContact O-N 2.84Å; Y301-L397 HydrophobicContact CD2-CD1 4.24Å; Y301-L397 HydrophobicContact CE2-CB 4.18Å; Y301-L397 HydrophobicContact CE2-CD1 3.74Å; Y301-L397 HydrophobicContact CE2-CD2 4.1Å; Y301-L397 HydrophobicContact CE2-CG 4.23Å; Y301-P398 PolarHBondContact OH-O 2.69Å; Y301-P398 VanDerWaalsContact OH-O 3.04Å
302	L	83.2	Confident	82.4	Confident	13 Å²	13	46.9 Å²	46.9	7%	0.068	25%	0.248	C	C	.	.			trans	-74.6	83.7	174	-65.7	-179.5	0	0	0	109.2	L295 I298 S299 L306 F307 M319 I322 V326 F421	L295-L302 HydrophobicContact CD1-CD1 3.96Å; I298-L302 HydrophobicContact CD1-CD2 3.74Å; I298-L302 HydrophobicContact CD1-CG 4.42Å; I298-L302 HydrophobicContact CG1-CD2 4.22Å; I298-L302 HydrophobicContact CG1-CG 4.38Å; I298-L302 PolarHBondContact O-N 3.46Å; S299-L302 PolarHBondContact O-N 2.96Å; L302-L306 HydrophobicContact CD2-CD1 4.49Å; L302-F307 HydrophobicContact CB-CE2 4.29Å; L302-F307 HydrophobicContact CD2-CE2 4.32Å; L302-F307 HydrophobicContact CD2-CZ 4.14Å; L302-M319 WeakPolarHBondContact O-CE 3.48Å; L302-I322 HydrophobicContact CD1-CG2 3.78Å; L302-V326 HydrophobicContact CD1-CG2 4.2Å; L302-F421 HydrophobicContact CD1-CZ 4.22Å; L302-F421 HydrophobicContact CD2-CE2 4.44Å
303	H	75.2	Confident	82.3	Confident	108 Å²	108	53.9 Å²	53.9	50%	0.5	28%	0.28	S	S	.	.			trans	-94	155.3	178.6	-56	-55.8	0	0	0	111.9	P300 Y301 T305 L306	P300-H303 PolarHBondContact O-CE1 3.43Å; P300-H303 VanDerWaalsContact O-CE1 3.28Å; Y301-H303 VanDerWaalsContact C-N 3.29Å; Y301-H303 PolarHBondContact O-CD2 3.47Å; Y301-H303 VanDerWaalsContact O-CD2 3.28Å; Y301-H303 PolarHBondContact O-N 2.84Å; H303-T305 PolarHBondContact O-N 3.37Å; H303-L306 PolarHBondContact O-N 3.21Å
304	H	68.9	Low	82.2	Confident	73 Å²	73	54.1 Å²	54.1	34%	0.338	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-47.5	-36.9	-179.9	177.7	-87.6	0	0	0	114	L306 F307 Y308 D315 M319	H304-L306 PolarHBondContact O-N 3.34Å; H304-L306 VanDerWaalsContact O-N 3.14Å; H304-F307 PolarHBondContact O-N 2.83Å; H304-Y308 PolarHBondContact O-N 2.76Å; H304-Y308 VanDerWaalsContact O-N 3.15Å; H304-D315 WeakPolarHBondContact NE2-CB 3.42Å; H304-M319 HydrophobicContact CB-CG 4.41Å
305	T	71.3	Confident	82	Confident	111 Å²	111	54.1 Å²	54.1	68%	0.681	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-60.2	-26.2	-178.6	53.4	0	0	0	0	114.1	H303 F307	H303-T305 PolarHBondContact O-N 3.37Å; T305-F307 VanDerWaalsContact C-N 3.3Å
306	L	76.2	Confident	81.9	Confident	30 Å²	30	59.8 Å²	59.8	16%	0.157	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-74.7	-22.9	178.2	-68.4	170.4	0	0	0	112.7	L302 H303 H304 V417	L302-L306 HydrophobicContact CD2-CD1 4.49Å; H303-L306 PolarHBondContact O-N 3.21Å; H304-L306 PolarHBondContact O-N 3.34Å; H304-L306 VanDerWaalsContact O-N 3.14Å; L306-V417 HydrophobicContact CB-CG2 4.44Å; L306-V417 HydrophobicContact CD1-CG2 4.13Å; L306-V417 HydrophobicContact CD2-CG2 4.18Å; L306-V417 HydrophobicContact CG-CG2 4.49Å
307	F	81.8	Confident	82.1	Confident	1 Å²	1	61.7 Å²	61.7	0%	0.004	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-6.2	-175.4	-59.4	-76.6	0	0	0	113	C66 L67 L302 H304 T305 T309 T318 M319 I322 V417 F421	C66-F307 HydrophobicContact CB-CB 4.31Å; C66-F307 HydrophobicContact CB-CD1 4.47Å; C66-F307 WeakPolarHBondContact CB-O 3.14Å; L67-F307 HydrophobicContact CD2-CE1 4.29Å; L302-F307 HydrophobicContact CB-CE2 4.29Å; L302-F307 HydrophobicContact CD2-CE2 4.32Å; L302-F307 HydrophobicContact CD2-CZ 4.14Å; H304-F307 PolarHBondContact O-N 2.83Å; T305-F307 VanDerWaalsContact C-N 3.3Å; F307-T309 WeakPolarHBondContact O-CG2 3.45Å; F307-T309 PolarHBondContact O-N 3.26Å; F307-T318 HydrophobicContact CB-CG2 4.08Å; F307-T318 HydrophobicContact CD1-CG2 4.15Å; F307-T318 HydrophobicContact CG-CG2 4.24Å; F307-M319 HydrophobicContact CB-SD 4.46Å; F307-M319 HydrophobicContact CD2-SD 3.49Å; F307-M319 WeakPolarHBondContact CD2-SD 3.36Å; F307-M319 HydrophobicContact CE2-SD 4.13Å; F307-M319 HydrophobicContact CG-SD 4.25Å; F307-I322 HydrophobicContact CD1-CD1 3.52Å; F307-I322 HydrophobicContact CD2-CD1 3.64Å; F307-I322 HydrophobicContact CE1-CD1 3.33Å; F307-I322 HydrophobicContact CE1-CG1 4.42Å; F307-I322 HydrophobicContact CE2-CD1 3.47Å; F307-I322 VanDerWaalsContact CE2-CD1 3.47Å; F307-I322 HydrophobicContact CG-CD1 3.66Å; F307-I322 HydrophobicContact CZ-CD1 3.31Å; F307-I322 HydrophobicContact CZ-CG1 4.37Å; F307-V417 HydrophobicContact CE1-CG1 3.58Å; F307-V417 HydrophobicContact CZ-CG1 3.67Å; F307-F421 HydrophobicContact CE1-CE2 4.4Å; F307-F421 HydrophobicContact CZ-CE2 4.19Å; F307-F421 HydrophobicContact CZ-CZ 4.27Å
308	Y	79.6	Confident	82.3	Confident	101 Å²	101	59.4 Å²	59.4	40%	0.396	31%	0.313	S	S	.	.			trans	-50.4	125.5	-177.8	179.6	-112.4	0	0	0	113	A104 F105 H304 D315 R414	A104-Y308 HydrophobicContact CB-CD1 4.09Å; A104-Y308 HydrophobicContact CB-CE1 3.59Å; F105-Y308 WeakPolarHBondContact CE1-O 3.16Å; H304-Y308 PolarHBondContact O-N 2.76Å; H304-Y308 VanDerWaalsContact O-N 3.15Å; Y308-D315 VanDerWaalsContact CA-OD2 3.31Å; Y308-D315 WeakPolarHBondContact CA-OD2 3.47Å; Y308-D315 VanDerWaalsContact CD2-OD2 3.26Å; Y308-D315 WeakPolarHBondContact CD2-OD2 3.41Å; Y308-R414 PolarHBondContact O-NH1 3Å; Y308-R414 PolarHBondContact O-NH2 3.45Å
309	T	79.7	Confident	82.4	Confident	6 Å²	6	61.5 Å²	61.5	4%	0.037	32%	0.323	C	S	.	.			trans	-115.4	-11.3	175.3	65.5	0	0	0	0	113.4	D65 C66 P102 A104 F105 F307 N311 D315	D65-T309 HydrophobicContact CB-CG2 4.17Å; C66-T309 HydrophobicContact CB-CG2 3.72Å; P102-T309 VanDerWaalsContact CB-O 3.26Å; P102-T309 WeakPolarHBondContact CB-O 3.48Å; A104-T309 WeakPolarHBondContact CB-O 2.99Å; F105-T309 HydrophobicContact CE1-CG2 4.1Å; F105-T309 HydrophobicContact CZ-CG2 3.93Å; F307-T309 WeakPolarHBondContact O-CG2 3.45Å; F307-T309 PolarHBondContact O-N 3.26Å; T309-N311 VanDerWaalsContact C-N 3.29Å; T309-N311 PolarHBondContact OG1-N 2.94Å; T309-D315 WeakPolarHBondContact CB-OD1 3.45Å; T309-D315 WeakPolarHBondContact CG2-OD1 3.31Å; T309-D315 VanDerWaalsContact N-CG 3.32Å; T309-D315 PolarHBondContact N-OD1 3.48Å; T309-D315 PolarHBondContact N-OD2 3.16Å; T309-D315 PolarHBondContact OG1-OD1 3.08Å
310	G	75	Confident	82.7	Confident	43 Å²	43	63 Å²	63	44%	0.443	33%	0.328	S	S	.	.	S	Bend	trans	87.9	-0.8	-169.8	0	0	0	0	0	113.3	D315	G310-D315 PolarHBondContact N-OD2 3.21Å
311	N	81.4	Confident	83.2	Confident	74 Å²	74	59 Å²	59	40%	0.396	30%	0.302	S	S	.	.			trans	-108.6	95	168.8	-177.9	-2.3	0	0	0	109.4	T309 E313 E314 D315	T309-N311 VanDerWaalsContact C-N 3.29Å; T309-N311 PolarHBondContact OG1-N 2.94Å; N311-E313 PolarHBondContact O-N 3.2Å; N311-E313 PolarHBondContact OD1-N 3.29Å; N311-E314 HydrophobicContact CB-CB 4.14Å; N311-E314 PolarHBondContact ND2-OE2 3.42Å; N311-E314 PolarHBondContact O-N 2.96Å; N311-D315 WeakPolarHBondContact O-CB 3.48Å; N311-D315 PolarHBondContact O-N 3.37Å
312	D	81.9	Confident	83.7	Confident	103 Å²	103	55.9 Å²	55.9	55%	0.551	29%	0.29	S	S	*	.	H	α-helix	trans	-57.1	-34.3	-174.7	-68.1	-17.8	0	0	0	113.2	M316	D312-M316 WeakPolarHBondContact O-CB 3.44Å; D312-M316 WeakPolarHBondContact O-CE 3.37Å; D312-M316 VanDerWaalsContact O-CG 3.27Å; D312-M316 WeakPolarHBondContact O-CG 3.47Å; D312-M316 PolarHBondContact O-N 2.75Å
313	E	88.6	Confident	84.1	Confident	153 Å²	153	61.4 Å²	61.4	72%	0.715	31%	0.314	S	S	*	.	H	α-helix	trans	-68.2	-46.3	179.5	-173.1	177.1	179.8	0	0	111.4	N311 M316 D317	N311-E313 PolarHBondContact O-N 3.2Å; N311-E313 PolarHBondContact OD1-N 3.29Å; E313-M316 PolarHBondContact O-N 3.25Å; E313-D317 PolarHBondContact O-N 2.89Å
314	E	86.6	Confident	85	Confident	49 Å²	49	62.1 Å²	62.1	23%	0.229	31%	0.312	C	S	.	.	H	α-helix	trans	-69.6	-36.6	177.5	-173.6	175.9	174.4	0	0	111.8	D65 N311 D317 T318	D65-E314 PolarHBondContact N-OE1 3.36Å; N311-E314 HydrophobicContact CB-CB 4.14Å; N311-E314 PolarHBondContact ND2-OE2 3.42Å; N311-E314 PolarHBondContact O-N 2.96Å; E314-D317 PolarHBondContact O-N 3.23Å; E314-T318 VanDerWaalsContact O-CB 3.28Å; E314-T318 WeakPolarHBondContact O-CB 2.9Å; E314-T318 PolarHBondContact O-N 2.66Å; E314-T318 PolarHBondContact O-OG1 3.02Å
315	D	85	Confident	86.2	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-40.9	177.1	-67.9	-15	0	0	0	110.8	H304 Y308 T309 G310 N311 T318 M319	H304-D315 WeakPolarHBondContact NE2-CB 3.42Å; Y308-D315 VanDerWaalsContact CA-OD2 3.31Å; Y308-D315 WeakPolarHBondContact CA-OD2 3.47Å; Y308-D315 VanDerWaalsContact CD2-OD2 3.26Å; Y308-D315 WeakPolarHBondContact CD2-OD2 3.41Å; T309-D315 WeakPolarHBondContact CB-OD1 3.45Å; T309-D315 WeakPolarHBondContact CG2-OD1 3.31Å; T309-D315 VanDerWaalsContact N-CG 3.32Å; T309-D315 PolarHBondContact N-OD1 3.48Å; T309-D315 PolarHBondContact N-OD2 3.16Å; T309-D315 PolarHBondContact OG1-OD1 3.08Å; G310-D315 PolarHBondContact N-OD2 3.21Å; N311-D315 WeakPolarHBondContact O-CB 3.48Å; N311-D315 PolarHBondContact O-N 3.37Å; D315-T318 WeakPolarHBondContact O-CB 3.32Å; D315-T318 PolarHBondContact O-N 2.87Å; D315-M319 WeakPolarHBondContact O-CG 3.22Å; D315-M319 PolarHBondContact O-N 3.31Å
316	M	89	Confident	87.2	Confident	119 Å²	119	53.9 Å²	53.9	59%	0.586	27%	0.266	S	S	*	.	H	α-helix	trans	-65.1	-46.1	173.2	-76	-171.7	-62.4	0	0	112.6	D312 E313 T318 M319 D320	D312-M316 WeakPolarHBondContact O-CB 3.44Å; D312-M316 WeakPolarHBondContact O-CE 3.37Å; D312-M316 VanDerWaalsContact O-CG 3.27Å; D312-M316 WeakPolarHBondContact O-CG 3.47Å; D312-M316 PolarHBondContact O-N 2.75Å; E313-M316 PolarHBondContact O-N 3.25Å; M316-T318 PolarHBondContact O-N 3.28Å; M316-M319 PolarHBondContact O-N 3.43Å; M316-D320 PolarHBondContact O-N 2.94Å
317	D	92.9	Very high	88	Confident	71 Å²	71	56.4 Å²	56.4	38%	0.38	28%	0.28	S	S	.	.	H	α-helix	trans	-62.6	-35	176.5	-177.2	56.4	0	0	0	111.4	K60 K64 E313 E314 D320 D321	K60-D317 IonicContact NZ-OD2 2.86Å; K64-D317 PolarHBondContact NZ-O 3.22Å; K64-D317 IonicContact NZ-OD2 3.79Å; K64-D317 PolarHBondContact NZ-OD2 2.77Å; E313-D317 PolarHBondContact O-N 2.89Å; E314-D317 PolarHBondContact O-N 3.23Å; D317-D320 PolarHBondContact O-N 3.18Å; D317-D321 PolarHBondContact O-N 3.42Å
318	T	90.7	Very high	88.5	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-46.2	172.9	-62.1	0	0	0	0	111.7	L61 K64 C66 F307 E314 D315 M316 D320 D321 I322	L61-T318 HydrophobicContact CD1-CG2 4.08Å; K64-T318 HydrophobicContact CD-CG2 4.4Å; K64-T318 WeakPolarHBondContact CD-OG1 3.08Å; C66-T318 WeakPolarHBondContact SG-CG2 3Å; F307-T318 HydrophobicContact CB-CG2 4.08Å; F307-T318 HydrophobicContact CD1-CG2 4.15Å; F307-T318 HydrophobicContact CG-CG2 4.24Å; E314-T318 VanDerWaalsContact O-CB 3.28Å; E314-T318 WeakPolarHBondContact O-CB 2.9Å; E314-T318 PolarHBondContact O-N 2.66Å; E314-T318 PolarHBondContact O-OG1 3.02Å; D315-T318 WeakPolarHBondContact O-CB 3.32Å; D315-T318 PolarHBondContact O-N 2.87Å; M316-T318 PolarHBondContact O-N 3.28Å; T318-D320 VanDerWaalsContact C-N 3.32Å; T318-D320 PolarHBondContact O-N 3.39Å; T318-D321 PolarHBondContact O-N 2.66Å; T318-I322 HydrophobicContact CG2-CD1 3.76Å; T318-I322 HydrophobicContact CG2-CG1 4.49Å; T318-I322 WeakPolarHBondContact O-CD1 3.21Å; T318-I322 VanDerWaalsContact O-CG1 3.28Å; T318-I322 WeakPolarHBondContact O-CG1 3.5Å; T318-I322 PolarHBondContact O-N 2.97Å
319	M	90	Very high	88.9	Confident	44 Å²	44	56.6 Å²	56.6	22%	0.217	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-37.6	177.6	-74.3	-57.1	-57.4	0	0	112.5	L302 H304 F307 D315 M316 I322 K323	L302-M319 WeakPolarHBondContact O-CE 3.48Å; H304-M319 HydrophobicContact CB-CG 4.41Å; F307-M319 HydrophobicContact CB-SD 4.46Å; F307-M319 HydrophobicContact CD2-SD 3.49Å; F307-M319 WeakPolarHBondContact CD2-SD 3.36Å; F307-M319 HydrophobicContact CE2-SD 4.13Å; F307-M319 HydrophobicContact CG-SD 4.25Å; D315-M319 WeakPolarHBondContact O-CG 3.22Å; D315-M319 PolarHBondContact O-N 3.31Å; M316-M319 PolarHBondContact O-N 3.43Å; M319-I322 PolarHBondContact O-N 3.15Å; M319-I322 HydrophobicContact SD-CD1 4.26Å; M319-K323 WeakPolarHBondContact O-CB 3.41Å; M319-K323 PolarHBondContact O-N 2.85Å
320	D	93.6	Very high	89.2	Confident	63 Å²	63	59.7 Å²	59.7	34%	0.337	30%	0.3	S	S	.	.	H	α-helix	trans	-67.1	-43.9	174.8	-168.5	53.5	0	0	0	111.8	M316 D317 T318 I322 K323 R324	M316-D320 PolarHBondContact O-N 2.94Å; D317-D320 PolarHBondContact O-N 3.18Å; T318-D320 VanDerWaalsContact C-N 3.32Å; T318-D320 PolarHBondContact O-N 3.39Å; D320-I322 VanDerWaalsContact C-N 3.35Å; D320-I322 PolarHBondContact O-N 2.95Å; D320-K323 PolarHBondContact O-N 3.44Å; D320-R324 VanDerWaalsContact O-CG 3.28Å; D320-R324 WeakPolarHBondContact O-CG 3.2Å; D320-R324 PolarHBondContact O-N 2.96Å; D320-R324 IonicContact OD1-NE 2.78Å; D320-R324 IonicContact OD2-CZ 2.7Å; D320-R324 IonicContact OD2-NE 3.91Å; D320-R324 PolarHBondContact OD2-NE 3.4Å; D320-R324 IonicContact OD2-NH1 3.23Å; D320-R324 IonicContact OD2-NH2 3Å; D320-R324 PolarHBondContact OD2-NH2 3.09Å
321	D	93.9	Very high	89.8	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.037	31%	0.312	C	S	.	.	H	α-helix	trans	-62.4	-39.2	175.4	-79.6	-28.9	0	0	0	112.2	K60 L61 K64 D317 T318 R324 L325	K60-D321 IonicContact NZ-OD1 3.62Å; K60-D321 PolarHBondContact NZ-OD1 3.43Å; K60-D321 IonicContact NZ-OD2 3.49Å; K60-D321 PolarHBondContact NZ-OD2 3.39Å; L61-D321 HydrophobicContact CD1-CB 3.79Å; K64-D321 WeakPolarHBondContact CE-OD2 3.26Å; K64-D321 IonicContact NZ-OD2 3.73Å; K64-D321 PolarHBondContact NZ-OD2 3.05Å; D317-D321 PolarHBondContact O-N 3.42Å; T318-D321 PolarHBondContact O-N 2.66Å; D321-R324 PolarHBondContact O-N 3.05Å; D321-L325 WeakPolarHBondContact O-CB 3.39Å; D321-L325 PolarHBondContact O-N 2.89Å
322	I	92.9	Very high	89.8	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-64.1	-45.4	174.6	-71.2	160.2	0	0	0	110.7	L61 L302 F307 T318 M319 D320 R324 L325 V326 F421	L61-I322 HydrophobicContact CD1-CG1 4.04Å; L61-I322 HydrophobicContact CD2-CG1 3.82Å; L302-I322 HydrophobicContact CD1-CG2 3.78Å; F307-I322 HydrophobicContact CD1-CD1 3.52Å; F307-I322 HydrophobicContact CD2-CD1 3.64Å; F307-I322 HydrophobicContact CE1-CD1 3.33Å; F307-I322 HydrophobicContact CE1-CG1 4.42Å; F307-I322 HydrophobicContact CE2-CD1 3.47Å; F307-I322 VanDerWaalsContact CE2-CD1 3.47Å; F307-I322 HydrophobicContact CG-CD1 3.66Å; F307-I322 HydrophobicContact CZ-CD1 3.31Å; F307-I322 HydrophobicContact CZ-CG1 4.37Å; T318-I322 HydrophobicContact CG2-CD1 3.76Å; T318-I322 HydrophobicContact CG2-CG1 4.49Å; T318-I322 WeakPolarHBondContact O-CD1 3.21Å; T318-I322 VanDerWaalsContact O-CG1 3.28Å; T318-I322 WeakPolarHBondContact O-CG1 3.5Å; T318-I322 PolarHBondContact O-N 2.97Å; M319-I322 PolarHBondContact O-N 3.15Å; M319-I322 HydrophobicContact SD-CD1 4.26Å; D320-I322 VanDerWaalsContact C-N 3.35Å; D320-I322 PolarHBondContact O-N 2.95Å; I322-R324 VanDerWaalsContact C-N 3.34Å; I322-R324 PolarHBondContact O-N 2.67Å; I322-L325 WeakPolarHBondContact O-CB 3.37Å; I322-L325 PolarHBondContact O-N 2.94Å; I322-V326 HydrophobicContact CG2-CG2 4.36Å; I322-V326 WeakPolarHBondContact O-CB 3.35Å; I322-V326 WeakPolarHBondContact O-CG2 3.39Å; I322-V326 PolarHBondContact O-N 3.49Å; I322-F421 HydrophobicContact CG1-CE1 4.41Å; I322-F421 HydrophobicContact CG1-CZ 4.47Å; I322-F421 HydrophobicContact CG2-CZ 4.49Å
323	K	92.7	Very high	89.3	Confident	129 Å²	129	56.7 Å²	56.7	56%	0.561	29%	0.29	S	S	*	.	H	α-helix	trans	-59.9	-46.3	178.1	-175.8	178.4	178.1	-178.3	0	110.9	M319 D320 L325 V326 D327	M319-K323 WeakPolarHBondContact O-CB 3.41Å; M319-K323 PolarHBondContact O-N 2.85Å; D320-K323 PolarHBondContact O-N 3.44Å; K323-L325 VanDerWaalsContact C-N 3.32Å; K323-L325 PolarHBondContact O-N 3.49Å; K323-V326 PolarHBondContact O-N 3.34Å; K323-D327 WeakPolarHBondContact O-CB 3.45Å; K323-D327 PolarHBondContact O-N 3.31Å
324	R	94.4	Very high	87.9	Confident	123 Å²	123	53.2 Å²	53.2	46%	0.464	28%	0.283	S	S	.	.	H	α-helix	trans	-59.1	-42.5	175	-70.5	171	-172.7	-171.6	1.5	112.2	D320 D321 I322 K328	D320-R324 VanDerWaalsContact O-CG 3.28Å; D320-R324 WeakPolarHBondContact O-CG 3.2Å; D320-R324 PolarHBondContact O-N 2.96Å; D320-R324 IonicContact OD1-NE 2.78Å; D320-R324 IonicContact OD2-CZ 2.7Å; D320-R324 IonicContact OD2-NE 3.91Å; D320-R324 PolarHBondContact OD2-NE 3.4Å; D320-R324 IonicContact OD2-NH1 3.23Å; D320-R324 IonicContact OD2-NH2 3Å; D320-R324 PolarHBondContact OD2-NH2 3.09Å; D321-R324 PolarHBondContact O-N 3.05Å; I322-R324 VanDerWaalsContact C-N 3.34Å; I322-R324 PolarHBondContact O-N 2.67Å; R324-K328 WeakPolarHBondContact O-CG 3.24Å; R324-K328 PolarHBondContact O-N 3.4Å
325	L	94.2	Very high	86.4	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-51.6	176.2	176.1	68.5	0	0	0	110.4	I54 L57 L58 L61 L295 D321 I322 K323 D327 K328 I329 F421	I54-L325 HydrophobicContact CD1-CD1 3.77Å; I54-L325 HydrophobicContact CG2-CD1 3.92Å; L57-L325 HydrophobicContact CB-CD1 4.47Å; L58-L325 HydrophobicContact CD2-CD1 4.11Å; L58-L325 HydrophobicContact CD2-CD2 3.66Å; L58-L325 HydrophobicContact CG-CD1 4.11Å; L61-L325 HydrophobicContact CD2-CD2 4.26Å; L295-L325 HydrophobicContact CD2-CD2 4.05Å; D321-L325 WeakPolarHBondContact O-CB 3.39Å; D321-L325 PolarHBondContact O-N 2.89Å; I322-L325 WeakPolarHBondContact O-CB 3.37Å; I322-L325 PolarHBondContact O-N 2.94Å; K323-L325 VanDerWaalsContact C-N 3.32Å; K323-L325 PolarHBondContact O-N 3.49Å; L325-D327 PolarHBondContact O-N 3.31Å; L325-K328 WeakPolarHBondContact O-CB 3.36Å; L325-K328 PolarHBondContact O-N 3.37Å; L325-I329 HydrophobicContact CD1-CD1 4.48Å; L325-I329 HydrophobicContact CG-CD1 4.16Å; L325-I329 WeakPolarHBondContact O-CG1 3.39Å; L325-I329 PolarHBondContact O-N 2.83Å; L325-I329 VanDerWaalsContact O-N 3.09Å; L325-F421 HydrophobicContact CD2-CD1 4.42Å; L325-F421 HydrophobicContact CD2-CE1 3.86Å
326	V	91.5	Very high	85.1	Confident	9 Å²	9	53.5 Å²	53.5	6%	0.055	29%	0.288	C	S	.	.	H	α-helix	trans	-58.1	-46	178.3	164.6	0	0	0	0	111.7	S299 L302 I322 K323 K328 I329 D330	S299-V326 WeakPolarHBondContact OG-CG1 3.39Å; L302-V326 HydrophobicContact CD1-CG2 4.2Å; I322-V326 HydrophobicContact CG2-CG2 4.36Å; I322-V326 WeakPolarHBondContact O-CB 3.35Å; I322-V326 WeakPolarHBondContact O-CG2 3.39Å; I322-V326 PolarHBondContact O-N 3.49Å; K323-V326 PolarHBondContact O-N 3.34Å; V326-K328 PolarHBondContact O-N 3.15Å; V326-I329 CarbonylContact O-C 3.38Å; V326-I329 WeakPolarHBondContact O-CA 3.45Å; V326-I329 WeakPolarHBondContact O-CB 3.36Å; V326-I329 PolarHBondContact O-N 3.33Å; V326-D330 PolarHBondContact O-N 2.82Å
327	D	92.7	Very high	83.4	Confident	84 Å²	84	50.2 Å²	50.2	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-57.7	-37.8	178.8	-70.9	-21.2	0	0	0	111.4	K323 L325 A331	K323-D327 WeakPolarHBondContact O-CB 3.45Å; K323-D327 PolarHBondContact O-N 3.31Å; L325-D327 PolarHBondContact O-N 3.31Å; D327-A331 VanDerWaalsContact O-CB 3.28Å; D327-A331 WeakPolarHBondContact O-CB 3.3Å; D327-A331 PolarHBondContact O-N 2.89Å
328	K	92	Very high	82	Confident	98 Å²	98	49.2 Å²	49.2	43%	0.426	27%	0.269	S	S	.	.	H	α-helix	trans	-68.6	-38.4	174.6	-66.8	-65.1	-179.1	-173.9	0	112.3	F49 I54 L57 R324 L325 V326 A331 F332	F49-K328 WeakPolarHBondContact CE2-O 3.46Å; I54-K328 HydrophobicContact CD1-CB 3.6Å; L57-K328 HydrophobicContact CD1-CG 4.44Å; R324-K328 WeakPolarHBondContact O-CG 3.24Å; R324-K328 PolarHBondContact O-N 3.4Å; L325-K328 WeakPolarHBondContact O-CB 3.36Å; L325-K328 PolarHBondContact O-N 3.37Å; V326-K328 PolarHBondContact O-N 3.15Å; K328-A331 PolarHBondContact O-N 3.37Å; K328-F332 PolarHBondContact O-N 3.42Å; K328-F332 VanDerWaalsContact O-N 3.1Å
329	I	88.9	Confident	80.5	Confident	7 Å²	7	52.9 Å²	52.9	4%	0.036	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-43.9	175.8	-61.3	175.9	0	0	0	110.4	F49 I54 M292 L295 Q296 L325 V326 F332 G333	F49-I329 HydrophobicContact CZ-CG1 4.34Å; I54-I329 HydrophobicContact CD1-CG1 4.16Å; M292-I329 HydrophobicContact CE-CD1 3.46Å; M292-I329 VanDerWaalsContact CE-CD1 3.46Å; M292-I329 HydrophobicContact CE-CG1 3.41Å; M292-I329 VanDerWaalsContact CE-CG1 3.41Å; M292-I329 HydrophobicContact CE-CG2 4.5Å; M292-I329 HydrophobicContact SD-CD1 4.08Å; L295-I329 HydrophobicContact CD2-CD1 3.57Å; L295-I329 HydrophobicContact CG-CD1 4.06Å; Q296-I329 HydrophobicContact CB-CG2 3.83Å; Q296-I329 HydrophobicContact CG-CG2 4.03Å; L325-I329 HydrophobicContact CD1-CD1 4.48Å; L325-I329 HydrophobicContact CG-CD1 4.16Å; L325-I329 WeakPolarHBondContact O-CG1 3.39Å; L325-I329 PolarHBondContact O-N 2.83Å; L325-I329 VanDerWaalsContact O-N 3.09Å; V326-I329 CarbonylContact O-C 3.38Å; V326-I329 WeakPolarHBondContact O-CA 3.45Å; V326-I329 WeakPolarHBondContact O-CB 3.36Å; V326-I329 PolarHBondContact O-N 3.33Å; I329-F332 PolarHBondContact O-N 3.32Å; I329-G333 PolarHBondContact O-N 2.93Å
330	D	86.3	Confident	78.9	Confident	71 Å²	71	55.7 Å²	55.7	38%	0.38	31%	0.306	S	S	.	.	H	α-helix	trans	-64.7	-41	177.4	-76.5	-28.3	0	0	0	111.9	Q296 V326 F332 G333	Q296-D330 WeakPolarHBondContact CG-OD1 3.43Å; Q296-D330 PolarHBondContact NE2-OD1 3.01Å; V326-D330 PolarHBondContact O-N 2.82Å; D330-F332 VanDerWaalsContact C-N 3.3Å; D330-F332 PolarHBondContact O-N 3.01Å; D330-G333 WeakPolarHBondContact O-CA 2.91Å; D330-G333 PolarHBondContact O-N 3.46Å
331	A	86.9	Confident	77.4	Confident	85 Å²	85	53.8 Å²	53.8	70%	0.702	30%	0.296	S	S	*	.	H	α-helix	trans	-64.5	-31.5	176.3	0	0	0	0	0	113.5	D327 K328 G333	D327-A331 VanDerWaalsContact O-CB 3.28Å; D327-A331 WeakPolarHBondContact O-CB 3.3Å; D327-A331 PolarHBondContact O-N 2.89Å; K328-A331 PolarHBondContact O-N 3.37Å; A331-G333 PolarHBondContact O-N 3.41Å
332	F	82.3	Confident	76	Confident	44 Å²	44	54.4 Å²	54.4	19%	0.193	30%	0.298	C	S	.	.	H	α-helix	trans	-66.6	-22.7	173.9	-172.3	-112.4	0	0	0	112.2	F49 L289 K328 I329 D330 T335	F49-F332 HydrophobicContact CB-CD2 3.74Å; F49-F332 HydrophobicContact CB-CE2 3.55Å; F49-F332 HydrophobicContact CB-CZ 4.19Å; F49-F332 HydrophobicContact CD1-CD1 4.07Å; F49-F332 HydrophobicContact CD1-CD2 4.07Å; F49-F332 HydrophobicContact CD1-CE1 4.17Å; F49-F332 HydrophobicContact CD1-CE2 4.19Å; F49-F332 HydrophobicContact CD1-CG 4.01Å; F49-F332 HydrophobicContact CD1-CZ 4.23Å; F49-F332 HydrophobicContact CD2-CB 3.83Å; F49-F332 AromaticContact CD2-CD2 3.55Å; F49-F332 HydrophobicContact CD2-CD2 3.55Å; F49-F332 HydrophobicContact CD2-CE2 4.26Å; F49-F332 AromaticContact CD2-CG 3.75Å; F49-F332 HydrophobicContact CD2-CG 3.75Å; F49-F332 HydrophobicContact CE1-CB 4.39Å; F49-F332 HydrophobicContact CE1-CD1 4.04Å; F49-F332 HydrophobicContact CE1-CE1 4.48Å; F49-F332 HydrophobicContact CE1-CG 4.09Å; F49-F332 HydrophobicContact CE2-CB 3.51Å; F49-F332 HydrophobicContact CE2-CD2 4.14Å; F49-F332 AromaticContact CE2-CG 3.85Å; F49-F332 HydrophobicContact CE2-CG 3.85Å; F49-F332 HydrophobicContact CG-CB 4.4Å; F49-F332 HydrophobicContact CG-CD1 4.32Å; F49-F332 AromaticContact CG-CD2 3.5Å; F49-F332 HydrophobicContact CG-CD2 3.5Å; F49-F332 AromaticContact CG-CE2 3.75Å; F49-F332 HydrophobicContact CG-CE2 3.75Å; F49-F332 AromaticContact CG-CG 3.82Å; F49-F332 HydrophobicContact CG-CG 3.82Å; F49-F332 HydrophobicContact CG-CZ 4.25Å; F49-F332 HydrophobicContact CZ-CB 3.8Å; F49-F332 HydrophobicContact CZ-CD1 4.29Å; F49-F332 AromaticContact CZ-CG 4Å; F49-F332 HydrophobicContact CZ-CG 4Å; L289-F332 HydrophobicContact CD2-CE1 4.3Å; K328-F332 PolarHBondContact O-N 3.42Å; K328-F332 VanDerWaalsContact O-N 3.1Å; I329-F332 PolarHBondContact O-N 3.32Å; D330-F332 VanDerWaalsContact C-N 3.3Å; D330-F332 PolarHBondContact O-N 3.01Å; F332-T335 HydrophobicContact CD1-CG2 4.35Å; F332-T335 HydrophobicContact CE1-CG2 3.88Å; F332-T335 HydrophobicContact CZ-CG2 4.43Å
333	G	71.3	Confident	74	Confident	29 Å²	29	63.4 Å²	63.4	30%	0.299	33%	0.332	S	S	.	.			trans	82.5	157	176	0	0	0	0	0	113.3	I329 D330 A331 T335	I329-G333 PolarHBondContact O-N 2.93Å; D330-G333 WeakPolarHBondContact O-CA 2.91Å; D330-G333 PolarHBondContact O-N 3.46Å; A331-G333 PolarHBondContact O-N 3.41Å; G333-T335 VanDerWaalsContact C-N 3.32Å; G333-T335 PolarHBondContact O-N 2.97Å
334	S	58.6	Low	72.1	Confident	79 Å²	79	59.1 Å²	59.1	55%	0.552	32%	0.324	S	S	*	.			trans	-71	86.8	178.4	66.7	0	0	0	0	110.5	F336	S334-F336 PolarHBondContact O-N 3.37Å
335	T	55.1	Low	70.1	Confident	52 Å²	52	58 Å²	58	32%	0.319	33%	0.331	S	S	.	.			trans	-74.1	-0.8	170.2	51.4	0	0	0	0	112.6	F332 G333	F332-T335 HydrophobicContact CD1-CG2 4.35Å; F332-T335 HydrophobicContact CE1-CG2 3.88Å; F332-T335 HydrophobicContact CZ-CG2 4.43Å; G333-T335 VanDerWaalsContact C-N 3.32Å; G333-T335 PolarHBondContact O-N 2.97Å
336	F	58.5	Low	68.8	Low	4 Å²	4	60.5 Å²	60.5	2%	0.018	36%	0.358	C	S	.	.			trans	-120.1	113.7	-172.9	-154.2	-63.3	0	0	0	109.5	L33 L290 R293 S334 L341	L33-F336 HydrophobicContact CD1-CB 4.18Å; L33-F336 HydrophobicContact CD1-CD1 4.09Å; L33-F336 HydrophobicContact CD1-CD2 2.98Å; L33-F336 HydrophobicContact CD1-CE1 4.22Å; L33-F336 HydrophobicContact CD1-CE2 3.13Å; L33-F336 HydrophobicContact CD1-CG 3.49Å; L33-F336 VanDerWaalsContact CD1-CG 3.49Å; L33-F336 HydrophobicContact CD1-CZ 3.8Å; L33-F336 HydrophobicContact CD2-CD2 3.99Å; L33-F336 HydrophobicContact CD2-CE1 3.91Å; L33-F336 HydrophobicContact CD2-CE2 3.17Å; L33-F336 HydrophobicContact CD2-CZ 3.15Å; L33-F336 HydrophobicContact CG-CD2 4.08Å; L33-F336 HydrophobicContact CG-CE2 3.75Å; L33-F336 HydrophobicContact CG-CZ 4.06Å; L290-F336 HydrophobicContact CB-CE2 4.14Å; L290-F336 HydrophobicContact CD1-CE2 3.89Å; L290-F336 HydrophobicContact CD1-CZ 3.5Å; L290-F336 VanDerWaalsContact CD1-CZ 3.5Å; R293-F336 HydrophobicContact CB-CB 3.99Å; R293-F336 HydrophobicContact CB-CD2 3.99Å; R293-F336 HydrophobicContact CB-CG 3.94Å; R293-F336 HydrophobicContact CG-CB 3.83Å; R293-F336 HydrophobicContact CG-CD1 4.09Å; R293-F336 HydrophobicContact CG-CD2 4.42Å; R293-F336 HydrophobicContact CG-CG 3.87Å; S334-F336 PolarHBondContact O-N 3.37Å; F336-L341 HydrophobicContact CE1-CB 4.06Å; F336-L341 HydrophobicContact CE1-CD1 3.69Å; F336-L341 HydrophobicContact CE1-CD2 3.7Å; F336-L341 HydrophobicContact CE1-CG 4.04Å; F336-L341 HydrophobicContact CZ-CD1 3.5Å; F336-L341 VanDerWaalsContact CZ-CD1 3.5Å; F336-L341 HydrophobicContact CZ-CD2 3.61Å; F336-L341 HydrophobicContact CZ-CG 4.1Å
337	S	53.2	Low	67.6	Low	50 Å²	50	66 Å²	66	35%	0.35	39%	0.386	S	S	.	.			trans	-100.9	110.5	173.1	-168.2	0	0	0	0	108.8	S339 K340 L341	S337-S339 PolarHBondContact O-N 2.94Å; S337-S339 VanDerWaalsContact O-N 3.15Å; S337-S339 PolarHBondContact OG-OG 2.67Å; S337-K340 WeakPolarHBondContact O-CB 3.4Å; S337-K340 PolarHBondContact O-N 3.01Å; S337-L341 PolarHBondContact O-N 3.47Å
338	E	62.6	Low	66.4	Low	49 Å²	49	68.3 Å²	68.3	23%	0.229	39%	0.392	C	S	.	.	H	α-helix	trans	-56.6	-31.9	-179.8	-65	89.1	164.2	0	0	111.7	R293 K340 L341 F342	R293-E338 IonicContact CZ-OE1 2.83Å; R293-E338 IonicContact NE-OE1 3.77Å; R293-E338 PolarHBondContact NE-OE1 3.35Å; R293-E338 IonicContact NH2-OE1 2.76Å; R293-E338 PolarHBondContact NH2-OE1 2.94Å; R293-E338 IonicContact NH2-OE2 3.34Å; R293-E338 PolarHBondContact NH2-OE2 2.69Å; E338-K340 PolarHBondContact O-N 3.24Å; E338-L341 WeakPolarHBondContact O-CB 3.39Å; E338-L341 PolarHBondContact O-N 2.95Å; E338-F342 HydrophobicContact CB-CD2 4.2Å; E338-F342 PolarHBondContact O-N 3.37Å
339	S	58.5	Low	65.3	Low	78 Å²	78	65.5 Å²	65.5	55%	0.545	38%	0.383	S	S	.	.	H	α-helix	trans	-62.8	-24.7	176.9	66.5	0	0	0	0	113.1	S337 R343	S337-S339 PolarHBondContact O-N 2.94Å; S337-S339 VanDerWaalsContact O-N 3.15Å; S337-S339 PolarHBondContact OG-OG 2.67Å; S339-R343 WeakPolarHBondContact O-CG 3.34Å
340	K	57.2	Low	64.5	Low	103 Å²	103	74.2 Å²	74.2	45%	0.448	42%	0.416	S	S	.	.	H	α-helix	trans	-82.2	-29	172.8	-67.7	-174.1	178.1	-178.1	0	112.4	S337 E338	S337-K340 WeakPolarHBondContact O-CB 3.4Å; S337-K340 PolarHBondContact O-N 3.01Å; E338-K340 PolarHBondContact O-N 3.24Å
341	L	61.6	Low	63.9	Low	23 Å²	23	75.2 Å²	75.2	12%	0.12	42%	0.42	C	S	.	.	H	α-helix	trans	-77.3	-43.4	176.8	-141.8	77.6	0	0	0	112	L33 M224 F286 L290 F336 S337 E338	L33-L341 HydrophobicContact CB-CD1 4.43Å; L33-L341 HydrophobicContact CD2-CD1 3.15Å; L33-L341 HydrophobicContact CG-CD1 4.4Å; M224-L341 HydrophobicContact CE-CD2 3.3Å; M224-L341 HydrophobicContact CE-CG 4.12Å; M224-L341 HydrophobicContact SD-CD1 4.24Å; M224-L341 HydrophobicContact SD-CD2 3.49Å; M224-L341 WeakPolarHBondContact SD-CD2 3.24Å; M224-L341 HydrophobicContact SD-CG 3.61Å; F286-L341 HydrophobicContact CZ-CD1 4.49Å; L290-L341 HydrophobicContact CD1-CD2 3.86Å; F336-L341 HydrophobicContact CE1-CB 4.06Å; F336-L341 HydrophobicContact CE1-CD1 3.69Å; F336-L341 HydrophobicContact CE1-CD2 3.7Å; F336-L341 HydrophobicContact CE1-CG 4.04Å; F336-L341 HydrophobicContact CZ-CD1 3.5Å; F336-L341 VanDerWaalsContact CZ-CD1 3.5Å; F336-L341 HydrophobicContact CZ-CD2 3.61Å; F336-L341 HydrophobicContact CZ-CG 4.1Å; S337-L341 PolarHBondContact O-N 3.47Å; E338-L341 WeakPolarHBondContact O-CB 3.39Å; E338-L341 PolarHBondContact O-N 2.95Å
342	F	64.7	Low	63.3	Low	20 Å²	20	71.7 Å²	71.7	9%	0.088	39%	0.389	C	S	.	.	S	Bend	trans	-117.5	64.8	-173.7	-47.6	-54.5	0	0	0	108.8	M224 E338 G344 T349 L352 L393 F394	M224-F342 HydrophobicContact CE-CE1 4.33Å; M224-F342 HydrophobicContact SD-CE1 4.29Å; E338-F342 HydrophobicContact CB-CD2 4.2Å; E338-F342 PolarHBondContact O-N 3.37Å; F342-G344 VanDerWaalsContact C-N 3.32Å; F342-G344 PolarHBondContact O-N 3.01Å; F342-T349 HydrophobicContact CB-CG2 4.22Å; F342-L352 HydrophobicContact CD1-CD2 3.93Å; F342-L393 HydrophobicContact CE2-CB 4.22Å; F342-L393 HydrophobicContact CZ-CB 4.24Å; F342-F394 HydrophobicContact CD1-CD1 4.29Å; F342-F394 AromaticContact CD1-CE1 3.4Å; F342-F394 HydrophobicContact CD1-CE1 3.4Å; F342-F394 VanDerWaalsContact CD1-CE1 3.4Å; F342-F394 AromaticContact CD1-CZ 3.84Å; F342-F394 HydrophobicContact CD1-CZ 3.84Å; F342-F394 HydrophobicContact CD2-CE1 4.43Å; F342-F394 AromaticContact CE1-CD1 3.96Å; F342-F394 HydrophobicContact CE1-CD1 3.96Å; F342-F394 AromaticContact CE1-CE1 3.1Å; F342-F394 HydrophobicContact CE1-CE1 3.1Å; F342-F394 HydrophobicContact CE1-CE2 4.05Å; F342-F394 AromaticContact CE1-CZ 3.15Å; F342-F394 HydrophobicContact CE1-CZ 3.15Å; F342-F394 HydrophobicContact CE2-CD1 4.28Å; F342-F394 HydrophobicContact CE2-CE1 4.2Å; F342-F394 HydrophobicContact CG-CE1 4.05Å; F342-F394 AromaticContact CZ-CD1 3.92Å; F342-F394 HydrophobicContact CZ-CD1 3.92Å; F342-F394 AromaticContact CZ-CE1 3.52Å; F342-F394 HydrophobicContact CZ-CE1 3.52Å; F342-F394 HydrophobicContact CZ-CE2 4.19Å; F342-F394 HydrophobicContact CZ-CG 4.42Å; F342-F394 AromaticContact CZ-CZ 3.67Å; F342-F394 HydrophobicContact CZ-CZ 3.67Å
343	R	51.7	Low	63	Low	193 Å²	193	71.9 Å²	71.9	73%	0.728	39%	0.39	S	S	*	.			trans	-69.2	90.8	173.2	-74.1	-174.7	-175.6	-173.8	3	109	S339	S339-R343 WeakPolarHBondContact O-CG 3.34Å
344	G	52.2	Low	63.4	Low	38 Å²	38	74.1 Å²	74.1	39%	0.392	39%	0.393	S	S	.	.	S	Bend	trans	-165.1	147.5	-177.8	0	0	0	0	0	114.5	F342	F342-G344 VanDerWaalsContact C-N 3.32Å; F342-G344 PolarHBondContact O-N 3.01Å
345	T	52.9	Low	64.4	Low	99 Å²	99	72.5 Å²	72.5	61%	0.607	38%	0.376	S	S	*	.			trans	-58.1	152.7	158.1	46.9	0	0	0	0	109.1	L347 K348 T349	T345-L347 PolarHBondContact O-N 2.77Å; T345-K348 PolarHBondContact O-N 2.88Å; T345-T349 PolarHBondContact O-N 3.24Å
346	G	67	Low	65.8	Low	56 Å²	56	70 Å²	70	58%	0.577	36%	0.361	S	S	*	.	H	α-helix	trans	-50.7	-27.2	-173.8	0	0	0	0	0	115.2	R350	G346-R350 VanDerWaalsContact O-CG 3.29Å; G346-R350 WeakPolarHBondContact O-CG 3.43Å; G346-R350 PolarHBondContact O-N 3.21Å
347	L	66	Low	66.9	Low	125 Å²	125	71 Å²	71	65%	0.654	37%	0.365	S	S	*	.	H	α-helix	trans	-68.7	-45.1	173.4	-168.8	71.9	0	0	0	113.3	T345 T349 R350 I351	T345-L347 PolarHBondContact O-N 2.77Å; L347-T349 VanDerWaalsContact C-N 3.35Å; L347-R350 PolarHBondContact O-N 3.32Å; L347-I351 HydrophobicContact CG-CD1 4.36Å; L347-I351 WeakPolarHBondContact O-CG1 3.19Å; L347-I351 PolarHBondContact O-N 3.15Å
348	K	66	Low	68.3	Low	132 Å²	132	72.2 Å²	72.2	57%	0.574	37%	0.367	S	S	*	.	H	α-helix	trans	-63.6	-42.5	178.4	-74.1	-171.6	176.5	-172.7	0	111.2	T345 R350 I351 L352	T345-K348 PolarHBondContact O-N 2.88Å; K348-R350 VanDerWaalsContact C-N 3.3Å; K348-R350 PolarHBondContact O-N 3.1Å; K348-I351 PolarHBondContact O-N 2.72Å; K348-L352 WeakPolarHBondContact O-CB 3.41Å; K348-L352 PolarHBondContact O-N 3.2Å
349	T	68.9	Low	69.5	Low	38 Å²	38	70.9 Å²	70.9	23%	0.233	36%	0.361	C	S	.	.	H	α-helix	trans	-62.3	-38.1	176.9	-51.2	0	0	0	0	111.6	F342 T345 L347 L352 K353 F394	F342-T349 HydrophobicContact CB-CG2 4.22Å; T345-T349 PolarHBondContact O-N 3.24Å; L347-T349 VanDerWaalsContact C-N 3.35Å; T349-L352 PolarHBondContact O-N 3.2Å; T349-K353 VanDerWaalsContact O-CB 3.32Å; T349-K353 WeakPolarHBondContact O-CB 3.5Å; T349-K353 PolarHBondContact O-N 3.44Å; T349-F394 HydrophobicContact CG2-CD1 4.23Å; T349-F394 HydrophobicContact CG2-CE1 4.43Å
350	R	72.1	Confident	70.9	Confident	191 Å²	191	67.1 Å²	67.1	72%	0.721	34%	0.335	S	S	*	.	H	α-helix	trans	-67.4	-41	175.4	-76.5	179.5	69.5	170.2	3.2	113.3	G346 L347 K348 L352 E354	G346-R350 VanDerWaalsContact O-CG 3.29Å; G346-R350 WeakPolarHBondContact O-CG 3.43Å; G346-R350 PolarHBondContact O-N 3.21Å; L347-R350 PolarHBondContact O-N 3.32Å; K348-R350 VanDerWaalsContact C-N 3.3Å; K348-R350 PolarHBondContact O-N 3.1Å; R350-L352 VanDerWaalsContact C-N 3.34Å; R350-E354 PolarHBondContact O-N 3.21Å; R350-E354 VanDerWaalsContact O-N 3.15Å
351	I	73.6	Confident	72.4	Confident	92 Å²	92	63.2 Å²	63.2	47%	0.472	32%	0.318	S	S	.	.	H	α-helix	trans	-62.8	-46.9	175.1	-67.1	167	0	0	0	109.5	L347 K348 K353 E354 E355	L347-I351 HydrophobicContact CG-CD1 4.36Å; L347-I351 WeakPolarHBondContact O-CG1 3.19Å; L347-I351 PolarHBondContact O-N 3.15Å; K348-I351 PolarHBondContact O-N 2.72Å; I351-K353 PolarHBondContact O-N 3.37Å; I351-E354 PolarHBondContact O-N 3.38Å; I351-E354 VanDerWaalsContact O-N 3.13Å; I351-E355 HydrophobicContact CG2-CG 4.47Å; I351-E355 PolarHBondContact O-N 3.07Å
352	L	75.1	Confident	73.7	Confident	11 Å²	11	64.3 Å²	64.3	6%	0.058	32%	0.324	C	S	.	.	H	α-helix	trans	-61.7	-43	179.7	-176.8	54.5	0	0	0	112.6	F199 E221 F342 K348 T349 R350 E354 E355 F356 F394	F199-L352 HydrophobicContact CE1-CD1 4.17Å; E221-L352 HydrophobicContact CB-CD1 3.62Å; E221-L352 HydrophobicContact CG-CD1 3.23Å; E221-L352 HydrophobicContact CG-CD2 3.7Å; E221-L352 HydrophobicContact CG-CG 4.03Å; F342-L352 HydrophobicContact CD1-CD2 3.93Å; K348-L352 WeakPolarHBondContact O-CB 3.41Å; K348-L352 PolarHBondContact O-N 3.2Å; T349-L352 PolarHBondContact O-N 3.2Å; R350-L352 VanDerWaalsContact C-N 3.34Å; L352-E354 VanDerWaalsContact C-N 3.28Å; L352-E354 PolarHBondContact O-N 2.76Å; L352-E355 PolarHBondContact O-N 2.77Å; L352-F356 HydrophobicContact CD1-CD2 3.52Å; L352-F356 HydrophobicContact CD1-CE2 3.45Å; L352-F356 VanDerWaalsContact CD1-CE2 3.45Å; L352-F356 HydrophobicContact CD2-CE2 4.38Å; L352-F356 HydrophobicContact CG-CD2 3.81Å; L352-F356 HydrophobicContact CG-CE2 3.9Å; L352-F356 WeakPolarHBondContact O-CD2 3.32Å; L352-F356 PolarHBondContact O-N 3.02Å; L352-F394 HydrophobicContact CD2-CE1 4.45Å; L352-F394 HydrophobicContact CD2-CZ 4.47Å; L352-F394 HydrophobicContact CG-CE1 4.32Å; L352-F394 HydrophobicContact CG-CZ 4.13Å
353	K	77.3	Confident	75	Confident	47 Å²	47	63.4 Å²	63.4	20%	0.204	32%	0.32	C	S	.	.	H	α-helix	trans	-53	-49	173.1	-178.8	-170.7	176.3	-165.3	0	110.7	D153 Y155 T349 I351 F356 R357 F394	D153-K353 IonicContact OD1-NZ 3.58Å; D153-K353 PolarHBondContact OD1-NZ 3.09Å; Y155-K353 WeakPolarHBondContact OH-CE 3.41Å; Y155-K353 WeakPolarHBondContact OH-CG 3.49Å; T349-K353 VanDerWaalsContact O-CB 3.32Å; T349-K353 WeakPolarHBondContact O-CB 3.5Å; T349-K353 PolarHBondContact O-N 3.44Å; I351-K353 PolarHBondContact O-N 3.37Å; K353-F356 PolarHBondContact O-N 3.32Å; K353-R357 VanDerWaalsContact O-CB 3.31Å; K353-R357 WeakPolarHBondContact O-CB 3.41Å; K353-R357 PolarHBondContact O-N 3.21Å; K353-F394 HydrophobicContact CB-CB 4.21Å; K353-F394 HydrophobicContact CB-CD1 3.86Å; K353-F394 HydrophobicContact CB-CD2 4.28Å; K353-F394 HydrophobicContact CB-CE1 4.22Å; K353-F394 HydrophobicContact CB-CG 3.89Å; K353-F394 HydrophobicContact CD-CB 3.85Å; K353-F394 HydrophobicContact CD-CG 4.46Å; K353-F394 HydrophobicContact CG-CB 3.65Å; K353-F394 HydrophobicContact CG-CD1 4.23Å; K353-F394 HydrophobicContact CG-CD2 4.04Å; K353-F394 HydrophobicContact CG-CG 3.75Å
354	E	78.5	Confident	76.7	Confident	76 Å²	76	54.7 Å²	54.7	36%	0.355	29%	0.289	S	S	.	.	H	α-helix	trans	-68	-39	-177.7	-171.4	59.6	-164.9	0	0	112.3	R350 I351 L352 R357 L358	R350-E354 PolarHBondContact O-N 3.21Å; R350-E354 VanDerWaalsContact O-N 3.15Å; I351-E354 PolarHBondContact O-N 3.38Å; I351-E354 VanDerWaalsContact O-N 3.13Å; L352-E354 VanDerWaalsContact C-N 3.28Å; L352-E354 PolarHBondContact O-N 2.76Å; E354-R357 WeakPolarHBondContact O-CB 3.45Å; E354-R357 PolarHBondContact O-N 2.91Å; E354-R357 IonicContact OE1-CZ 3.14Å; E354-R357 IonicContact OE1-NE 3.29Å; E354-R357 PolarHBondContact OE1-NE 2.71Å; E354-R357 IonicContact OE1-NH2 3.68Å; E354-R357 PolarHBondContact OE1-NH2 2.81Å; E354-R357 IonicContact OE2-CZ 3.32Å; E354-R357 IonicContact OE2-NE 3.3Å; E354-R357 PolarHBondContact OE2-NE 3.43Å; E354-R357 IonicContact OE2-NH2 2.81Å; E354-L358 HydrophobicContact CG-CD1 4.3Å; E354-L358 VanDerWaalsContact O-CG 3.3Å; E354-L358 WeakPolarHBondContact O-CG 3.42Å; E354-L358 PolarHBondContact O-N 3.21Å
355	E	80.1	Confident	78.6	Confident	45 Å²	45	57.1 Å²	57.1	21%	0.21	29%	0.286	C	S	.	.	H	α-helix	trans	-62.9	-49	174.8	-71	-177.9	147.9	0	0	111.5	F199 I351 L352 R357 L358 H359	F199-E355 HydrophobicContact CD1-CB 3.94Å; F199-E355 WeakPolarHBondContact CD1-OE2 3.5Å; F199-E355 HydrophobicContact CE1-CB 3.82Å; I351-E355 HydrophobicContact CG2-CG 4.47Å; I351-E355 PolarHBondContact O-N 3.07Å; L352-E355 PolarHBondContact O-N 2.77Å; E355-R357 VanDerWaalsContact C-N 3.3Å; E355-R357 PolarHBondContact O-N 3.3Å; E355-L358 PolarHBondContact O-N 3Å; E355-H359 PolarHBondContact O-CD2 3.33Å; E355-H359 PolarHBondContact O-N 3.28Å
356	F	83.4	Confident	80.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-43	174.8	-91.4	-75.6	0	0	0	112	F199 M224 F225 I228 L352 K353 L358 H359 F360 L390 F394	F199-F356 HydrophobicContact CE1-CD2 4.32Å; F199-F356 HydrophobicContact CE1-CE2 4.27Å; F199-F356 HydrophobicContact CZ-CD1 4.44Å; F199-F356 HydrophobicContact CZ-CD2 4.48Å; F199-F356 HydrophobicContact CZ-CE1 4.2Å; F199-F356 HydrophobicContact CZ-CE2 4.26Å; F199-F356 HydrophobicContact CZ-CZ 4.09Å; M224-F356 HydrophobicContact CB-CZ 4.05Å; M224-F356 HydrophobicContact CE-CZ 4.21Å; M224-F356 HydrophobicContact CG-CE1 4.35Å; M224-F356 HydrophobicContact CG-CZ 3.73Å; M224-F356 HydrophobicContact SD-CE2 4.16Å; M224-F356 HydrophobicContact SD-CZ 3.82Å; F225-F356 HydrophobicContact CB-CE1 3.93Å; F225-F356 HydrophobicContact CB-CZ 4.24Å; F225-F356 HydrophobicContact CD2-CD1 4.3Å; F225-F356 HydrophobicContact CD2-CE1 4.03Å; I228-F356 HydrophobicContact CD1-CE1 4.13Å; L352-F356 HydrophobicContact CD1-CD2 3.52Å; L352-F356 HydrophobicContact CD1-CE2 3.45Å; L352-F356 VanDerWaalsContact CD1-CE2 3.45Å; L352-F356 HydrophobicContact CD2-CE2 4.38Å; L352-F356 HydrophobicContact CG-CD2 3.81Å; L352-F356 HydrophobicContact CG-CE2 3.9Å; L352-F356 WeakPolarHBondContact O-CD2 3.32Å; L352-F356 PolarHBondContact O-N 3.02Å; K353-F356 PolarHBondContact O-N 3.32Å; F356-L358 PolarHBondContact O-N 2.9Å; F356-H359 PolarHBondContact O-N 3.1Å; F356-F360 HydrophobicContact CD1-CD2 4.27Å; F356-F360 AromaticContact CD1-CE2 3.98Å; F356-F360 HydrophobicContact CD1-CE2 3.98Å; F356-F360 HydrophobicContact CE1-CE2 4.48Å; F356-F360 WeakPolarHBondContact O-CD2 3.5Å; F356-F360 PolarHBondContact O-N 2.99Å; F356-L390 HydrophobicContact CD1-CD1 3.78Å; F356-L390 HydrophobicContact CE1-CD1 4.42Å; F356-L390 HydrophobicContact CG-CD1 4.42Å; F356-F394 HydrophobicContact CB-CE2 4.05Å; F356-F394 HydrophobicContact CD2-CE2 4.06Å; F356-F394 AromaticContact CD2-CZ 3.81Å; F356-F394 HydrophobicContact CD2-CZ 3.81Å; F356-F394 HydrophobicContact CE2-CZ 4.42Å; F356-F394 HydrophobicContact CG-CE2 4.2Å; F356-F394 HydrophobicContact CG-CZ 4.41Å
357	R	82.7	Confident	81.8	Confident	25 Å²	25	50.3 Å²	50.3	9%	0.094	23%	0.233	C	C	.	.	H	α-helix	trans	-57.7	-48.3	177.2	-169.9	-169.9	74.9	79.2	-2.9	111.4	V154 Y155 K353 E354 E355 L361	V154-R357 WeakPolarHBondContact O-CD 3.38Å; V154-R357 WeakPolarHBondContact O-CG 3.36Å; V154-R357 PolarHBondContact O-NH1 3.09Å; Y155-R357 HydrophobicContact CD1-CB 3.93Å; Y155-R357 HydrophobicContact CD1-CG 4.02Å; Y155-R357 HydrophobicContact CD2-CB 4.47Å; Y155-R357 HydrophobicContact CD2-CG 3.81Å; Y155-R357 HydrophobicContact CE1-CB 3.77Å; Y155-R357 HydrophobicContact CE1-CG 4.17Å; Y155-R357 HydrophobicContact CE2-CB 4.33Å; Y155-R357 HydrophobicContact CE2-CG 3.97Å; Y155-R357 HydrophobicContact CG-CB 4.28Å; Y155-R357 HydrophobicContact CG-CG 3.84Å; K353-R357 VanDerWaalsContact O-CB 3.31Å; K353-R357 WeakPolarHBondContact O-CB 3.41Å; K353-R357 PolarHBondContact O-N 3.21Å; E354-R357 WeakPolarHBondContact O-CB 3.45Å; E354-R357 PolarHBondContact O-N 2.91Å; E354-R357 IonicContact OE1-CZ 3.14Å; E354-R357 IonicContact OE1-NE 3.29Å; E354-R357 PolarHBondContact OE1-NE 2.71Å; E354-R357 IonicContact OE1-NH2 3.68Å; E354-R357 PolarHBondContact OE1-NH2 2.81Å; E354-R357 IonicContact OE2-CZ 3.32Å; E354-R357 IonicContact OE2-NE 3.3Å; E354-R357 PolarHBondContact OE2-NE 3.43Å; E354-R357 IonicContact OE2-NH2 2.81Å; E355-R357 VanDerWaalsContact C-N 3.3Å; E355-R357 PolarHBondContact O-N 3.3Å; R357-L361 WeakPolarHBondContact O-CB 3.23Å; R357-L361 PolarHBondContact O-N 3.12Å
358	L	83.3	Confident	83	Confident	75 Å²	75	44.4 Å²	44.4	39%	0.393	20%	0.202	S	C	.	.	H	α-helix	trans	-65.6	-41.7	179.4	-70.6	171.4	0	0	0	112.4	E354 E355 F356 L361 N362	E354-L358 HydrophobicContact CG-CD1 4.3Å; E354-L358 VanDerWaalsContact O-CG 3.3Å; E354-L358 WeakPolarHBondContact O-CG 3.42Å; E354-L358 PolarHBondContact O-N 3.21Å; E355-L358 PolarHBondContact O-N 3Å; F356-L358 PolarHBondContact O-N 2.9Å; L358-L361 WeakPolarHBondContact O-CB 3.28Å; L358-L361 PolarHBondContact O-N 3.08Å; L358-N362 PolarHBondContact O-N 3.07Å
359	H	86.9	Confident	84.3	Confident	21 Å²	21	38.1 Å²	38.1	10%	0.097	18%	0.175	C	C	.	.	H	α-helix	trans	-65.3	-43.6	178.5	-68.5	-54.6	0	0	0	112.2	E196 F199 F225 E355 F356 L361 N362 I363	E196-H359 PolarHBondContact O-CE1 3.36Å; E196-H359 PolarHBondContact O-ND1 2.81Å; E196-H359 IonicContact OE2-ND1 3.66Å; F199-H359 AromaticContact CD1-NE2 3.91Å; F199-H359 AromaticContact CE1-CD2 3.68Å; F199-H359 AromaticContact CE1-NE2 3.88Å; F199-H359 AromaticContact CE2-CD2 3.87Å; F199-H359 AromaticContact CE2-NE2 3.98Å; F199-H359 AromaticContact CG-NE2 3.98Å; F199-H359 AromaticContact CZ-CD2 3.49Å; F199-H359 VanDerWaalsContact CZ-CD2 3.49Å; F199-H359 WeakPolarHBondContact CZ-CD2 3.18Å; F199-H359 AromaticContact CZ-NE2 3.91Å; F225-H359 HydrophobicContact CD2-CB 4.29Å; F225-H359 HydrophobicContact CE2-CB 3.6Å; F225-H359 HydrophobicContact CZ-CB 4.21Å; E355-H359 PolarHBondContact O-CD2 3.33Å; E355-H359 PolarHBondContact O-N 3.28Å; F356-H359 PolarHBondContact O-N 3.1Å; H359-L361 VanDerWaalsContact C-N 3.3Å; H359-L361 PolarHBondContact O-N 2.86Å; H359-N362 PolarHBondContact O-N 3.01Å; H359-I363 VanDerWaalsContact O-CG1 3.26Å; H359-I363 WeakPolarHBondContact O-CG1 3.28Å; H359-I363 PolarHBondContact O-N 2.86Å
360	F	88.7	Confident	85.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-68.3	-30.9	176.4	-86.7	-91.2	0	0	0	112.6	Y155 F225 I228 I229 F356 I363 S364 I386 L390	Y155-F360 CarbonylContact O-C 3.57Å; Y155-F360 VanDerWaalsContact O-CB 3.24Å; Y155-F360 WeakPolarHBondContact O-CB 3.15Å; F225-F360 HydrophobicContact CD2-CE2 4.14Å; F225-F360 HydrophobicContact CE2-CD2 4.46Å; F225-F360 HydrophobicContact CE2-CE2 4.09Å; I228-F360 HydrophobicContact CG2-CZ 3.78Å; I229-F360 HydrophobicContact CD1-CZ 4.44Å; F356-F360 HydrophobicContact CD1-CD2 4.27Å; F356-F360 AromaticContact CD1-CE2 3.98Å; F356-F360 HydrophobicContact CD1-CE2 3.98Å; F356-F360 HydrophobicContact CE1-CE2 4.48Å; F356-F360 WeakPolarHBondContact O-CD2 3.5Å; F356-F360 PolarHBondContact O-N 2.99Å; F360-I363 PolarHBondContact O-N 3.21Å; F360-S364 WeakPolarHBondContact O-CB 3.32Å; F360-S364 PolarHBondContact O-N 2.97Å; F360-I386 HydrophobicContact CD1-CG2 4.33Å; F360-I386 HydrophobicContact CE1-CB 3.87Å; F360-I386 HydrophobicContact CE1-CG2 3.33Å; F360-I386 HydrophobicContact CE2-CG2 4.46Å; F360-I386 HydrophobicContact CZ-CB 4.44Å; F360-I386 HydrophobicContact CZ-CG2 3.43Å; F360-I386 VanDerWaalsContact CZ-CG2 3.43Å; F360-L390 HydrophobicContact CD2-CD1 3.64Å; F360-L390 HydrophobicContact CE2-CD1 3.32Å; F360-L390 HydrophobicContact CG-CD1 4.39Å; F360-L390 HydrophobicContact CZ-CD1 3.84Å
361	L	87.3	Confident	86.2	Confident	21 Å²	21	28.9 Å²	28.9	11%	0.11	14%	0.138	C	C	.	.	H	α-helix	trans	-62.9	-44.3	172.2	-178.4	67.8	0	0	0	110.8	V154 Y155 D157 R357 L358 H359 S364 R365	V154-L361 HydrophobicContact CG1-CD1 4.32Å; Y155-L361 WeakPolarHBondContact O-CA 3.49Å; Y155-L361 PolarHBondContact O-N 3.29Å; D157-L361 HydrophobicContact CB-CD1 3.76Å; R357-L361 WeakPolarHBondContact O-CB 3.23Å; R357-L361 PolarHBondContact O-N 3.12Å; L358-L361 WeakPolarHBondContact O-CB 3.28Å; L358-L361 PolarHBondContact O-N 3.08Å; H359-L361 VanDerWaalsContact C-N 3.3Å; H359-L361 PolarHBondContact O-N 2.86Å; L361-S364 WeakPolarHBondContact O-CB 3.48Å; L361-S364 PolarHBondContact O-N 2.9Å; L361-R365 PolarHBondContact O-N 2.85Å
362	N	88.4	Confident	86.9	Confident	46 Å²	46	24.8 Å²	24.8	25%	0.246	12%	0.118	C	C	.	.	H	α-helix	trans	-66.8	-43.2	176.3	-71.7	-13.7	0	0	0	112.2	E196 L358 H359 S364 R365 I366	E196-N362 HydrophobicContact CG-CB 4.3Å; E196-N362 VanDerWaalsContact OE2-CB 3.26Å; E196-N362 WeakPolarHBondContact OE2-CB 3.31Å; E196-N362 PolarHBondContact OE2-ND2 3.46Å; L358-N362 PolarHBondContact O-N 3.07Å; H359-N362 PolarHBondContact O-N 3.01Å; N362-S364 VanDerWaalsContact C-N 3.28Å; N362-S364 PolarHBondContact O-N 2.77Å; N362-R365 WeakPolarHBondContact O-CA 3.13Å; N362-R365 WeakPolarHBondContact O-CB 3.46Å; N362-R365 PolarHBondContact O-N 2.8Å; N362-I366 WeakPolarHBondContact O-CG1 3.3Å; N362-I366 PolarHBondContact O-N 3.17Å
363	I	91.9	Very high	87.6	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.6	-43.5	175.5	-68	164.5	0	0	0	110.5	I193 E196 F225 I229 H359 F360 R365 I366 M367 T383	I193-I363 HydrophobicContact CG1-CG2 4.47Å; I193-I363 HydrophobicContact CG2-CD1 4.33Å; I193-I363 HydrophobicContact CG2-CG1 4.18Å; I193-I363 HydrophobicContact CG2-CG2 4.36Å; E196-I363 HydrophobicContact CG-CG1 4.4Å; F225-I363 HydrophobicContact CE2-CD1 3.63Å; F225-I363 HydrophobicContact CZ-CD1 3.47Å; F225-I363 VanDerWaalsContact CZ-CD1 3.47Å; F225-I363 HydrophobicContact CZ-CG1 4.45Å; I229-I363 HydrophobicContact CD1-CD1 3.62Å; H359-I363 VanDerWaalsContact O-CG1 3.26Å; H359-I363 WeakPolarHBondContact O-CG1 3.28Å; H359-I363 PolarHBondContact O-N 2.86Å; F360-I363 PolarHBondContact O-N 3.21Å; I363-R365 PolarHBondContact O-N 2.86Å; I363-I366 WeakPolarHBondContact O-CA 3.33Å; I363-I366 WeakPolarHBondContact O-CB 3.5Å; I363-I366 PolarHBondContact O-N 3.26Å; I363-M367 HydrophobicContact CG2-CE 3.93Å; I363-M367 WeakPolarHBondContact O-CG 3.4Å; I363-M367 PolarHBondContact O-N 2.97Å; I363-T383 HydrophobicContact CG2-CG2 3.57Å
364	S	88.8	Confident	88.2	Confident	10 Å²	10	24.3 Å²	24.3	7%	0.07	12%	0.117	C	C	.	.	H	α-helix	trans	-57.8	-36	176.1	-176.8	0	0	0	0	112.1	D157 F360 L361 N362 M367	D157-S364 PolarHBondContact N-OG 3.35Å; F360-S364 WeakPolarHBondContact O-CB 3.32Å; F360-S364 PolarHBondContact O-N 2.97Å; L361-S364 WeakPolarHBondContact O-CB 3.48Å; L361-S364 PolarHBondContact O-N 2.9Å; N362-S364 VanDerWaalsContact C-N 3.28Å; N362-S364 PolarHBondContact O-N 2.77Å; S364-M367 WeakPolarHBondContact O-CB 3.46Å; S364-M367 PolarHBondContact O-N 3.25Å
365	R	91	Very high	88.9	Confident	89 Å²	89	22.5 Å²	22.5	34%	0.336	11%	0.112	S	C	.	.	H	α-helix	trans	-73.7	-33.8	173.8	-70	173.4	175	169.3	2.1	112.8	P79 F80 D157 L361 N362 I363 M367 D368	P79-R365 HydrophobicContact CG-CB 4.24Å; F80-R365 HydrophobicContact CE2-CB 4.07Å; F80-R365 HydrophobicContact CZ-CB 4.18Å; D157-R365 HydrophobicContact CB-CG 3.87Å; D157-R365 IonicContact OD1-NH2 2.73Å; D157-R365 WeakPolarHBondContact OD2-CG 3.19Å; D157-R365 IonicContact OD2-NE 3.61Å; D157-R365 PolarHBondContact OD2-NE 3.32Å; L361-R365 PolarHBondContact O-N 2.85Å; N362-R365 WeakPolarHBondContact O-CA 3.13Å; N362-R365 WeakPolarHBondContact O-CB 3.46Å; N362-R365 PolarHBondContact O-N 2.8Å; I363-R365 PolarHBondContact O-N 2.86Å; R365-M367 PolarHBondContact O-N 2.9Å; R365-D368 WeakPolarHBondContact O-CB 3.26Å; R365-D368 PolarHBondContact O-N 3Å; R365-D368 VanDerWaalsContact O-N 3.08Å
366	I	93.6	Very high	89.5	Confident	4 Å²	4	20.3 Å²	20.3	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-64	-30.8	174	-65.7	166.2	0	0	0	110.3	F80 V189 C192 I193 E196 N362 I363 D368 C369	F80-I366 HydrophobicContact CD2-CG1 4.11Å; F80-I366 HydrophobicContact CE2-CB 4.31Å; F80-I366 HydrophobicContact CE2-CG1 3.5Å; F80-I366 HydrophobicContact CZ-CG1 4.21Å; V189-I366 HydrophobicContact CG1-CG2 4.05Å; C192-I366 HydrophobicContact CB-CD1 4.04Å; C192-I366 HydrophobicContact CB-CG2 4.39Å; I193-I366 HydrophobicContact CD1-CG2 4.33Å; I193-I366 HydrophobicContact CG1-CB 4.38Å; I193-I366 HydrophobicContact CG1-CD1 4.29Å; I193-I366 HydrophobicContact CG1-CG2 3.78Å; E196-I366 HydrophobicContact CG-CD1 3.8Å; N362-I366 WeakPolarHBondContact O-CG1 3.3Å; N362-I366 PolarHBondContact O-N 3.17Å; I363-I366 WeakPolarHBondContact O-CA 3.33Å; I363-I366 WeakPolarHBondContact O-CB 3.5Å; I363-I366 PolarHBondContact O-N 3.26Å; I366-D368 PolarHBondContact O-N 3.09Å; I366-C369 VanDerWaalsContact O-CB 3.27Å; I366-C369 WeakPolarHBondContact O-CB 3.43Å; I366-C369 PolarHBondContact O-N 3.42Å
367	M	93.9	Very high	89.9	Confident	8 Å²	8	20.3 Å²	20.3	4%	0.039	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-62.4	-22.3	174.3	-63.3	-56.9	164.4	0	0	113	I193 I363 S364 R365 C369 V370 R376 K380 T383	I193-M367 HydrophobicContact CD1-CE 3.51Å; I363-M367 HydrophobicContact CG2-CE 3.93Å; I363-M367 WeakPolarHBondContact O-CG 3.4Å; I363-M367 PolarHBondContact O-N 2.97Å; S364-M367 WeakPolarHBondContact O-CB 3.46Å; S364-M367 PolarHBondContact O-N 3.25Å; R365-M367 PolarHBondContact O-N 2.9Å; M367-C369 PolarHBondContact O-N 3.42Å; M367-V370 PolarHBondContact O-N 3.19Å; M367-V370 HydrophobicContact SD-CG2 4.18Å; M367-R376 WeakPolarHBondContact O-CD 3.27Å; M367-R376 VanDerWaalsContact O-CG 3.27Å; M367-R376 WeakPolarHBondContact O-CG 3.48Å; M367-R376 PolarHBondContact O-NE 3.37Å; M367-K380 HydrophobicContact CB-CG 3.77Å; M367-T383 HydrophobicContact CE-CG2 3.6Å; M367-T383 HydrophobicContact CG-CG2 4.49Å
368	D	92.1	Very high	90.6	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.011	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-68.9	-12.2	171.7	-64.7	-40.8	0	0	0	113.7	K76 R365 I366 R376 K380	K76-D368 WeakPolarHBondContact CD-OD2 3.48Å; K76-D368 WeakPolarHBondContact CE-OD2 3.36Å; K76-D368 IonicContact NZ-OD2 3.86Å; R365-D368 WeakPolarHBondContact O-CB 3.26Å; R365-D368 PolarHBondContact O-N 3Å; R365-D368 VanDerWaalsContact O-N 3.08Å; I366-D368 PolarHBondContact O-N 3.09Å; D368-R376 IonicContact OD1-CZ 3.06Å; D368-R376 IonicContact OD1-NE 3.39Å; D368-R376 IonicContact OD1-NH2 3.9Å; D368-R376 PolarHBondContact OD1-NH2 3.08Å; D368-K380 WeakPolarHBondContact OD1-CE 3.36Å; D368-K380 IonicContact OD1-NZ 3.12Å; D368-K380 PolarHBondContact OD1-NZ 3.24Å
369	C	92.9	Very high	91.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-99.4	7.1	179.8	-55.9	0	0	0	0	114.5	C78 W81 I366 M367	C78-C369 VanDerWaalsContact CA-SG 3.59Å; C78-C369 HydrophobicContact CB-CB 3.79Å; C78-C369 WeakPolarHBondContact CB-SG 3.5Å; C78-C369 WeakPolarHBondContact SG-CB 3.46Å; C78-C369 CovalentContact SG-SG 2.02Å; C78-C369 PolarHBondContact SG-SG 3.44Å; W81-C369 HydrophobicContact CH2-CB 4.1Å; W81-C369 HydrophobicContact CZ2-CB 3.39Å; I366-C369 VanDerWaalsContact O-CB 3.27Å; I366-C369 WeakPolarHBondContact O-CB 3.43Å; I366-C369 PolarHBondContact O-N 3.42Å; M367-C369 PolarHBondContact O-N 3.42Å
370	V	92.1	Very high	91.5	Very high	6 Å²	6	16.2 Å²	16.2	4%	0.036	8%	0.082	C	C	.	.			trans	-85.3	117.6	177.2	177.8	0	0	0	0	109.5	Y181 V189 M367 C372 C375 R376	Y181-V370 HydrophobicContact CE1-CG1 4.09Å; V189-V370 HydrophobicContact CG1-CG2 3.82Å; V189-V370 HydrophobicContact CG2-CG2 4.14Å; M367-V370 PolarHBondContact O-N 3.19Å; M367-V370 HydrophobicContact SD-CG2 4.18Å; V370-C372 VanDerWaalsContact C-N 3.28Å; V370-C372 HydrophobicContact CG1-CB 4.4Å; V370-C372 PolarHBondContact O-N 2.91Å; V370-C375 HydrophobicContact CG1-CB 3.79Å; V370-R376 HydrophobicContact CB-CB 3.92Å; V370-R376 HydrophobicContact CB-CG 4.47Å; V370-R376 HydrophobicContact CG1-CB 4.04Å
371	D	88.6	Confident	91.8	Very high	29 Å²	29	16.2 Å²	16.2	16%	0.155	8%	0.082	C	C	.	.	S	Bend	trans	-71.5	-20.1	-175.9	-56.9	-36.1	0	0	0	114	S83 Y181 S185	S83-D371 WeakPolarHBondContact CB-OD1 3.39Å; S83-D371 PolarHBondContact OG-OD1 3.15Å; Y181-D371 HydrophobicContact CE2-CB 4.13Å; S185-D371 WeakPolarHBondContact CB-OD2 3.37Å; S185-D371 PolarHBondContact OG-OD2 2.69Å
372	C	88.6	Confident	92.3	Very high	6 Å²	6	15.2 Å²	15.2	4%	0.041	8%	0.077	C	C	.	.	S	Bend	trans	-92.1	116.4	-179.5	160.9	0	0	0	0	110	T179 Y181 V370 K374 C375 R376	T179-C372 PolarHBondContact OG1-SG 3.25Å; T179-C372 VanDerWaalsContact OG1-SG 3.4Å; Y181-C372 HydrophobicContact CD1-CB 4.13Å; Y181-C372 HydrophobicContact CD2-CB 3.9Å; Y181-C372 HydrophobicContact CG-CB 3.7Å; V370-C372 VanDerWaalsContact C-N 3.28Å; V370-C372 HydrophobicContact CG1-CB 4.4Å; V370-C372 PolarHBondContact O-N 2.91Å; C372-K374 PolarHBondContact O-N 3.5Å; C372-C375 HydrophobicContact CB-CB 3.55Å; C372-C375 WeakPolarHBondContact CB-SG 3.47Å; C372-C375 CarbonylContact O-C 3.57Å; C372-C375 WeakPolarHBondContact O-CB 3.1Å; C372-C375 PolarHBondContact O-N 3.46Å; C372-C375 VanDerWaalsContact O-N 3.12Å; C372-C375 WeakPolarHBondContact SG-CB 3.34Å; C372-C375 PolarHBondContact SG-N 2.95Å; C372-C375 CovalentContact SG-SG 2.05Å; C372-C375 PolarHBondContact SG-SG 3.45Å; C372-R376 WeakPolarHBondContact O-CB 3.03Å; C372-R376 PolarHBondContact O-N 3.28Å
373	D	89.4	Confident	92.6	Very high	35 Å²	35	13 Å²	13	19%	0.187	7%	0.065	C	C	.	.	H	α-helix	trans	-62	-48.9	-172.1	-54.4	-44.2	0	0	0	112.5	M74 C92 I94 C375 R376 L377	M74-D373 HydrophobicContact CE-CB 4.38Å; M74-D373 WeakPolarHBondContact CE-O 3.07Å; C92-D373 WeakPolarHBondContact O-CB 3.37Å; I94-D373 HydrophobicContact CD1-CB 3.85Å; I94-D373 WeakPolarHBondContact CD1-O 3.43Å; I94-D373 HydrophobicContact CG1-CB 4.08Å; D373-C375 VanDerWaalsContact C-N 3.32Å; D373-C375 PolarHBondContact O-N 2.9Å; D373-R376 WeakPolarHBondContact O-CB 3.47Å; D373-R376 PolarHBondContact O-N 2.94Å; D373-R376 VanDerWaalsContact O-N 3.15Å; D373-L377 PolarHBondContact O-N 2.85Å
374	K	90.4	Very high	92.7	Very high	12 Å²	12	13.4 Å²	13.4	5%	0.052	7%	0.067	C	C	.	.	H	α-helix	trans	-59	-41.5	173.5	-72.8	-172.3	-162.5	166.9	0	113	E91 C92 G93 I94 T179 C372 R376 L377 W378	E91-K374 VanDerWaalsContact O-CD 3.22Å; E91-K374 WeakPolarHBondContact O-CD 3.49Å; E91-K374 WeakPolarHBondContact O-CE 3.42Å; E91-K374 PolarHBondContact O-NZ 3.19Å; C92-K374 PolarHBondContact O-N 2.88Å; G93-K374 WeakPolarHBondContact O-CE 3.43Å; I94-K374 HydrophobicContact CD1-CG 4.3Å; I94-K374 HydrophobicContact CG1-CG 3.78Å; T179-K374 HydrophobicContact CG2-CB 4.21Å; C372-K374 PolarHBondContact O-N 3.5Å; K374-R376 VanDerWaalsContact C-N 3.28Å; K374-R376 PolarHBondContact O-N 3.22Å; K374-L377 PolarHBondContact O-N 3Å; K374-W378 PolarHBondContact O-N 3.34Å
375	C	92.2	Very high	93.1	Very high	38 Å²	38	13 Å²	13	26%	0.257	6%	0.064	S	C	.	.	H	α-helix	trans	-64.2	-38.2	178.2	-47.3	0	0	0	0	111.1	T179 Y181 V370 C372 D373 G379	T179-C375 PolarHBondContact OG1-SG 3.15Å; Y181-C375 HydrophobicContact CD1-CB 4.42Å; V370-C375 HydrophobicContact CG1-CB 3.79Å; C372-C375 HydrophobicContact CB-CB 3.55Å; C372-C375 WeakPolarHBondContact CB-SG 3.47Å; C372-C375 CarbonylContact O-C 3.57Å; C372-C375 WeakPolarHBondContact O-CB 3.1Å; C372-C375 PolarHBondContact O-N 3.46Å; C372-C375 VanDerWaalsContact O-N 3.12Å; C372-C375 WeakPolarHBondContact SG-CB 3.34Å; C372-C375 PolarHBondContact SG-N 2.95Å; C372-C375 CovalentContact SG-SG 2.05Å; C372-C375 PolarHBondContact SG-SG 3.45Å; D373-C375 VanDerWaalsContact C-N 3.32Å; D373-C375 PolarHBondContact O-N 2.9Å; C375-G379 WeakPolarHBondContact O-CA 3.26Å; C375-G379 PolarHBondContact O-N 3.26Å
376	R	93	Very high	93.3	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-67.4	-45.7	176.3	176.9	165.3	-177.9	-151.1	0.8	111.9	M74 K76 M367 D368 V370 C372 D373 K374 G379 K380	M74-R376 HydrophobicContact CE-CB 3.91Å; M74-R376 HydrophobicContact CE-CG 3.72Å; M74-R376 PolarHBondContact O-NH1 3.14Å; M74-R376 HydrophobicContact SD-CG 4.46Å; K76-R376 PolarHBondContact O-NH2 3.01Å; M367-R376 WeakPolarHBondContact O-CD 3.27Å; M367-R376 VanDerWaalsContact O-CG 3.27Å; M367-R376 WeakPolarHBondContact O-CG 3.48Å; M367-R376 PolarHBondContact O-NE 3.37Å; D368-R376 IonicContact OD1-CZ 3.06Å; D368-R376 IonicContact OD1-NE 3.39Å; D368-R376 IonicContact OD1-NH2 3.9Å; D368-R376 PolarHBondContact OD1-NH2 3.08Å; V370-R376 HydrophobicContact CB-CB 3.92Å; V370-R376 HydrophobicContact CB-CG 4.47Å; V370-R376 HydrophobicContact CG1-CB 4.04Å; C372-R376 WeakPolarHBondContact O-CB 3.03Å; C372-R376 PolarHBondContact O-N 3.28Å; D373-R376 WeakPolarHBondContact O-CB 3.47Å; D373-R376 PolarHBondContact O-N 2.94Å; D373-R376 VanDerWaalsContact O-N 3.15Å; K374-R376 VanDerWaalsContact C-N 3.28Å; K374-R376 PolarHBondContact O-N 3.22Å; R376-G379 PolarHBondContact O-N 3.07Å; R376-K380 WeakPolarHBondContact O-CB 3.49Å; R376-K380 WeakPolarHBondContact O-CG 3.26Å; R376-K380 PolarHBondContact O-N 3.4Å
377	L	92.9	Very high	93.2	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-56.3	-54.8	176.2	172.4	70	0	0	0	110.9	Y70 T72 M74 I94 V169 L171 N174 D373 K374 G379 K380 L381	Y70-L377 HydrophobicContact CD1-CD1 4.09Å; T72-L377 HydrophobicContact CG2-CD1 3.87Å; M74-L377 HydrophobicContact CE-CB 4.17Å; M74-L377 HydrophobicContact SD-CB 4.32Å; M74-L377 HydrophobicContact SD-CD1 4.43Å; I94-L377 HydrophobicContact CD1-CB 3.48Å; I94-L377 VanDerWaalsContact CD1-CB 3.48Å; I94-L377 HydrophobicContact CD1-CD2 3.73Å; I94-L377 HydrophobicContact CD1-CG 4.14Å; I94-L377 HydrophobicContact CG1-CD2 4.4Å; V169-L377 HydrophobicContact CB-CD1 4.17Å; V169-L377 HydrophobicContact CG1-CD1 4.11Å; V169-L377 HydrophobicContact CG1-CD2 3.7Å; V169-L377 HydrophobicContact CG2-CD1 4.34Å; L171-L377 HydrophobicContact CD2-CD1 4.39Å; L171-L377 HydrophobicContact CD2-CD2 4.13Å; L171-L377 HydrophobicContact CD2-CG 4.38Å; N174-L377 HydrophobicContact CB-CD2 3.94Å; D373-L377 PolarHBondContact O-N 2.85Å; K374-L377 PolarHBondContact O-N 3Å; L377-G379 VanDerWaalsContact C-N 3.34Å; L377-G379 PolarHBondContact O-N 2.91Å; L377-K380 PolarHBondContact O-N 3.01Å; L377-L381 WeakPolarHBondContact O-CB 3.27Å; L377-L381 PolarHBondContact O-N 3.35Å
378	W	95.7	Very high	93.1	Very high	14 Å²	14	8.2 Å²	8.2	5%	0.053	5%	0.046	C	C	.	.	H	α-helix	trans	-66.4	-37	179.5	-74.2	105	0	0	0	112.1	L171 N174 E176 K374 L381 Q382 R426	L171-W378 HydrophobicContact CB-CH2 4.35Å; L171-W378 HydrophobicContact CB-CZ2 4.47Å; L171-W378 HydrophobicContact CD2-CH2 4.48Å; N174-W378 VanDerWaalsContact O-CE2 3.31Å; N174-W378 WeakPolarHBondContact O-CZ2 3.38Å; N174-W378 PolarHBondContact O-NE1 3.03Å; E176-W378 HydrophobicContact CB-CD2 3.73Å; E176-W378 HydrophobicContact CB-CE3 4.42Å; E176-W378 HydrophobicContact CB-CG 3.73Å; E176-W378 HydrophobicContact CB-CZ2 4.37Å; E176-W378 HydrophobicContact CG-CB 4.29Å; E176-W378 HydrophobicContact CG-CD2 4.39Å; E176-W378 HydrophobicContact CG-CG 3.98Å; K374-W378 PolarHBondContact O-N 3.34Å; W378-L381 HydrophobicContact CE3-CD2 4.02Å; W378-L381 HydrophobicContact CZ3-CD1 4.29Å; W378-L381 HydrophobicContact CZ3-CD2 3.97Å; W378-L381 PolarHBondContact O-N 3.28Å; W378-Q382 WeakPolarHBondContact O-CB 3.44Å; W378-Q382 WeakPolarHBondContact O-CG 3.38Å; W378-Q382 PolarHBondContact O-N 3.23Å; W378-R426 HydrophobicContact CE3-CG 3.91Å; W378-R426 VanDerWaalsContact CZ3-CD 3.46Å; W378-R426 HydrophobicContact CZ3-CG 3.71Å
379	G	95.2	Very high	93.1	Very high	5 Å²	5	8.1 Å²	8.1	5%	0.052	5%	0.045	C	C	.	.	H	α-helix	trans	-58.7	-48.1	172.9	0	0	0	0	0	112.5	C375 R376 L377 T383	C375-G379 WeakPolarHBondContact O-CA 3.26Å; C375-G379 PolarHBondContact O-N 3.26Å; R376-G379 PolarHBondContact O-N 3.07Å; L377-G379 VanDerWaalsContact C-N 3.34Å; L377-G379 PolarHBondContact O-N 2.91Å; G379-T383 WeakPolarHBondContact O-CB 3.35Å; G379-T383 VanDerWaalsContact O-CG2 3.26Å; G379-T383 WeakPolarHBondContact O-CG2 3.34Å; G379-T383 PolarHBondContact O-N 2.95Å; G379-T383 PolarHBondContact O-OG1 2.82Å
380	K	94.6	Very high	92.9	Very high	15 Å²	15	8.1 Å²	8.1	7%	0.065	5%	0.045	C	C	.	.	H	α-helix	trans	-61.8	-47.5	174.2	-75.9	-169.6	175.4	-160.9	0	111.5	D73 M367 D368 R376 L377 T383 H384	D73-K380 PolarHBondContact O-NZ 3.01Å; M367-K380 HydrophobicContact CB-CG 3.77Å; D368-K380 WeakPolarHBondContact OD1-CE 3.36Å; D368-K380 IonicContact OD1-NZ 3.12Å; D368-K380 PolarHBondContact OD1-NZ 3.24Å; R376-K380 WeakPolarHBondContact O-CB 3.49Å; R376-K380 WeakPolarHBondContact O-CG 3.26Å; R376-K380 PolarHBondContact O-N 3.4Å; L377-K380 PolarHBondContact O-N 3.01Å; K380-T383 PolarHBondContact O-OG1 3.02Å; K380-H384 WeakPolarHBondContact O-CB 3.39Å; K380-H384 PolarHBondContact O-N 3.09Å
381	L	95.6	Very high	92.6	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-62.8	-49	-177.2	-179.1	150.4	0	0	0	111.8	Y70 L171 L377 W378 H384 G385 N422	Y70-L381 HydrophobicContact CD1-CB 4.38Å; Y70-L381 HydrophobicContact CD1-CD1 4.19Å; Y70-L381 HydrophobicContact CD2-CD1 4.48Å; Y70-L381 HydrophobicContact CE1-CB 4.13Å; Y70-L381 HydrophobicContact CG-CD1 4.08Å; L171-L381 HydrophobicContact CD1-CD1 3.43Å; L171-L381 VanDerWaalsContact CD1-CD1 3.43Å; L171-L381 HydrophobicContact CD2-CD1 3.62Å; L171-L381 HydrophobicContact CG-CD1 4.18Å; L377-L381 WeakPolarHBondContact O-CB 3.27Å; L377-L381 PolarHBondContact O-N 3.35Å; W378-L381 HydrophobicContact CE3-CD2 4.02Å; W378-L381 HydrophobicContact CZ3-CD1 4.29Å; W378-L381 HydrophobicContact CZ3-CD2 3.97Å; W378-L381 PolarHBondContact O-N 3.28Å; L381-H384 PolarHBondContact O-N 3.04Å; L381-G385 PolarHBondContact O-N 3.16Å; L381-N422 HydrophobicContact CD1-CB 3.92Å; L381-N422 HydrophobicContact CD2-CB 3.56Å; L381-N422 HydrophobicContact CG-CB 4.22Å
382	Q	97.2	Very high	92.6	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-72.2	-38	-177	-68.1	176.6	-64.1	0	0	111.7	E176 L232 W378 H384 G385 I386 R426	E176-Q382 PolarHBondContact OE1-OE1 3.4Å; L232-Q382 HydrophobicContact CD1-CB 3.56Å; L232-Q382 HydrophobicContact CD1-CG 4.15Å; W378-Q382 WeakPolarHBondContact O-CB 3.44Å; W378-Q382 WeakPolarHBondContact O-CG 3.38Å; W378-Q382 PolarHBondContact O-N 3.23Å; Q382-H384 VanDerWaalsContact C-N 3.31Å; Q382-H384 PolarHBondContact O-N 2.05Å; Q382-G385 PolarHBondContact O-N 3.06Å; Q382-I386 WeakPolarHBondContact O-CB 3.48Å; Q382-I386 VanDerWaalsContact O-CG1 3.22Å; Q382-I386 WeakPolarHBondContact O-CG1 3.19Å; Q382-I386 PolarHBondContact O-N 3.35Å; Q382-R426 HydrophobicContact CG-CG 4.24Å
383	T	95.2	Very high	92.4	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-67.3	-35	174.5	54.2	0	0	0	0	112	L232 I363 M367 G379 K380 G387	L232-T383 HydrophobicContact CD2-CG2 3.83Å; I363-T383 HydrophobicContact CG2-CG2 3.57Å; M367-T383 HydrophobicContact CE-CG2 3.6Å; M367-T383 HydrophobicContact CG-CG2 4.49Å; G379-T383 WeakPolarHBondContact O-CB 3.35Å; G379-T383 VanDerWaalsContact O-CG2 3.26Å; G379-T383 WeakPolarHBondContact O-CG2 3.34Å; G379-T383 PolarHBondContact O-N 2.95Å; G379-T383 PolarHBondContact O-OG1 2.82Å; K380-T383 PolarHBondContact O-OG1 3.02Å; T383-G387 PolarHBondContact O-N 3.12Å
384	H	94.3	Very high	91.9	Very high	9 Å²	9	7.2 Å²	7.2	4%	0.042	4%	0.037	C	C	.	.	H	α-helix	trans	-62.5	-50.8	169.9	-170.8	-177.6	0	0	0	111.5	Y70 C156 K380 L381 Q382 I386 G387 T388 D416 A419	Y70-H384 AromaticContact CE2-ND1 3.87Å; Y70-H384 AromaticContact CZ-ND1 3.84Å; Y70-H384 PolarHBondContact OH-ND1 3.09Å; C156-H384 VanDerWaalsContact SG-CA 3.53Å; K380-H384 WeakPolarHBondContact O-CB 3.39Å; K380-H384 PolarHBondContact O-N 3.09Å; L381-H384 PolarHBondContact O-N 3.04Å; Q382-H384 VanDerWaalsContact C-N 3.31Å; Q382-H384 PolarHBondContact O-N 2.05Å; H384-I386 VanDerWaalsContact C-N 3.35Å; H384-I386 PolarHBondContact O-N 2.04Å; H384-G387 CarbonylContact O-C 3.01Å; H384-G387 WeakPolarHBondContact O-CA 3.27Å; H384-G387 PolarHBondContact O-N 3.46Å; H384-G387 VanDerWaalsContact O-N 3.07Å; H384-T388 PolarHBondContact CD2-OG1 2.93Å; H384-T388 PolarHBondContact O-N 2.8Å; H384-T388 PolarHBondContact O-OG1 3.25Å; H384-D416 IonicContact NE2-OD1 3.57Å; H384-D416 PolarHBondContact NE2-OD1 3.48Å; H384-A419 HydrophobicContact CB-CB 3.83Å
385	G	96	Very high	91.2	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-58.1	-44.1	179	0	0	0	0	0	113.2	L381 Q382 T388 A389	L381-G385 PolarHBondContact O-N 3.16Å; Q382-G385 PolarHBondContact O-N 3.06Å; G385-T388 PolarHBondContact O-N 3.37Å; G385-A389 WeakPolarHBondContact O-CB 3.36Å; G385-A389 PolarHBondContact O-N 3.2Å
386	I	95.3	Very high	89.9	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.6	-43.2	174.6	-64.9	166	0	0	0	111	I228 L232 V287 E291 F360 Q382 H384 T388 A389 L390 F427	I228-I386 HydrophobicContact CG2-CD1 4.13Å; I228-I386 HydrophobicContact CG2-CG2 3.51Å; L232-I386 HydrophobicContact CB-CD1 4.18Å; L232-I386 HydrophobicContact CD1-CD1 4.28Å; L232-I386 HydrophobicContact CD2-CD1 4.14Å; L232-I386 HydrophobicContact CG-CD1 4.43Å; V287-I386 HydrophobicContact CG1-CD1 4.28Å; V287-I386 HydrophobicContact CG1-CG1 4.24Å; E291-I386 WeakPolarHBondContact OE1-CG1 3.39Å; F360-I386 HydrophobicContact CD1-CG2 4.33Å; F360-I386 HydrophobicContact CE1-CB 3.87Å; F360-I386 HydrophobicContact CE1-CG2 3.33Å; F360-I386 HydrophobicContact CE2-CG2 4.46Å; F360-I386 HydrophobicContact CZ-CB 4.44Å; F360-I386 HydrophobicContact CZ-CG2 3.43Å; F360-I386 VanDerWaalsContact CZ-CG2 3.43Å; Q382-I386 WeakPolarHBondContact O-CB 3.48Å; Q382-I386 VanDerWaalsContact O-CG1 3.22Å; Q382-I386 WeakPolarHBondContact O-CG1 3.19Å; Q382-I386 PolarHBondContact O-N 3.35Å; H384-I386 VanDerWaalsContact C-N 3.35Å; H384-I386 PolarHBondContact O-N 2.04Å; I386-T388 VanDerWaalsContact C-N 3.34Å; I386-T388 PolarHBondContact O-N 3.45Å; I386-A389 WeakPolarHBondContact O-CB 3.47Å; I386-A389 PolarHBondContact O-N 3.02Å; I386-L390 HydrophobicContact CG2-CD1 4.29Å; I386-L390 WeakPolarHBondContact O-CG 3.49Å; I386-L390 PolarHBondContact O-N 3.21Å; I386-F427 HydrophobicContact CD1-CE2 4.29Å; I386-F427 HydrophobicContact CD1-CZ 4.14Å; I386-F427 HydrophobicContact CG1-CE2 4.32Å
387	G	92.3	Very high	88.3	Confident	0 Å²	0	14 Å²	14	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.2	-44.4	176	0	0	0	0	0	112	T383 H384 L390 K391	T383-G387 PolarHBondContact O-N 3.12Å; H384-G387 CarbonylContact O-C 3.01Å; H384-G387 WeakPolarHBondContact O-CA 3.27Å; H384-G387 PolarHBondContact O-N 3.46Å; H384-G387 VanDerWaalsContact O-N 3.07Å; G387-L390 PolarHBondContact O-N 2.88Å; G387-K391 WeakPolarHBondContact O-CB 3.49Å; G387-K391 PolarHBondContact O-N 2.85Å
388	T	91.6	Very high	86.2	Confident	2 Å²	2	16.8 Å²	16.8	1%	0.012	9%	0.091	C	C	.	.	H	α-helix	trans	-63.6	-41.4	174	-55.2	0	0	0	0	111.1	H384 G385 I386 L390 K391 I392 L412 D416 L420	H384-T388 PolarHBondContact CD2-OG1 2.93Å; H384-T388 PolarHBondContact O-N 2.8Å; H384-T388 PolarHBondContact O-OG1 3.25Å; G385-T388 PolarHBondContact O-N 3.37Å; I386-T388 VanDerWaalsContact C-N 3.34Å; I386-T388 PolarHBondContact O-N 3.45Å; T388-L390 PolarHBondContact O-N 3.02Å; T388-K391 WeakPolarHBondContact O-CB 3.37Å; T388-K391 PolarHBondContact O-N 2.69Å; T388-I392 HydrophobicContact CG2-CD1 4.07Å; T388-I392 WeakPolarHBondContact O-CD1 3.14Å; T388-I392 WeakPolarHBondContact O-CG1 3.38Å; T388-I392 PolarHBondContact O-N 2.73Å; T388-L412 HydrophobicContact CG2-CD2 3.74Å; T388-D416 HydrophobicContact CG2-CB 3.82Å; T388-D416 PolarHBondContact OG1-OD1 2.87Å; T388-L420 HydrophobicContact CG2-CB 4.36Å
389	A	92.2	Very high	83.8	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.1	-44.3	174.6	0	0	0	0	0	111.8	E291 A294 G385 I386 I392 L393 L420	E291-A389 HydrophobicContact CB-CB 4.42Å; E291-A389 HydrophobicContact CG-CB 3.94Å; A294-A389 HydrophobicContact CB-CB 3.66Å; G385-A389 WeakPolarHBondContact O-CB 3.36Å; G385-A389 PolarHBondContact O-N 3.2Å; I386-A389 WeakPolarHBondContact O-CB 3.47Å; I386-A389 PolarHBondContact O-N 3.02Å; A389-I392 WeakPolarHBondContact O-CB 3.36Å; A389-I392 PolarHBondContact O-N 3.28Å; A389-L393 WeakPolarHBondContact O-CB 3.29Å; A389-L393 WeakPolarHBondContact O-CG 3.48Å; A389-L393 PolarHBondContact O-N 3.25Å; A389-L420 HydrophobicContact CB-CD1 3.86Å
390	L	89	Confident	81.4	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.1	-44.2	175.2	-67.5	173.1	0	0	0	111.7	Y155 M224 I228 L290 F356 F360 I386 G387 T388 I392 L393 F394	Y155-L390 HydrophobicContact CD1-CB 4.37Å; Y155-L390 HydrophobicContact CE1-CB 4.11Å; M224-L390 HydrophobicContact CE-CD2 3.48Å; M224-L390 VanDerWaalsContact CE-CD2 3.48Å; I228-L390 HydrophobicContact CD1-CD1 4.36Å; I228-L390 HydrophobicContact CD1-CD2 4.19Å; L290-L390 HydrophobicContact CD2-CD2 4.1Å; F356-L390 HydrophobicContact CD1-CD1 3.78Å; F356-L390 HydrophobicContact CE1-CD1 4.42Å; F356-L390 HydrophobicContact CG-CD1 4.42Å; F360-L390 HydrophobicContact CD2-CD1 3.64Å; F360-L390 HydrophobicContact CE2-CD1 3.32Å; F360-L390 HydrophobicContact CG-CD1 4.39Å; F360-L390 HydrophobicContact CZ-CD1 3.84Å; I386-L390 HydrophobicContact CG2-CD1 4.29Å; I386-L390 WeakPolarHBondContact O-CG 3.49Å; I386-L390 PolarHBondContact O-N 3.21Å; G387-L390 PolarHBondContact O-N 2.88Å; T388-L390 PolarHBondContact O-N 3.02Å; L390-I392 PolarHBondContact O-N 2.71Å; L390-L393 PolarHBondContact O-N 3.08Å; L390-L393 VanDerWaalsContact O-N 3.1Å; L390-F394 HydrophobicContact CB-CD2 4.32Å; L390-F394 HydrophobicContact CB-CE2 4.33Å; L390-F394 HydrophobicContact CD2-CE2 4.36Å; L390-F394 WeakPolarHBondContact O-CD2 3.35Å; L390-F394 PolarHBondContact O-N 3.26Å
391	K	86.3	Confident	78.8	Confident	36 Å²	36	33.4 Å²	33.4	16%	0.157	20%	0.197	C	C	.	.	H	α-helix	trans	-51.5	-45.3	174.3	179.6	-178.5	165.9	-171.7	0	111.4	Y155 G387 T388 A395 F410 Q411 D416	Y155-K391 HydrophobicContact CD2-CB 3.56Å; Y155-K391 HydrophobicContact CD2-CD 4.15Å; Y155-K391 HydrophobicContact CD2-CG 3.88Å; Y155-K391 HydrophobicContact CE2-CB 3.46Å; Y155-K391 VanDerWaalsContact CE2-CB 3.46Å; Y155-K391 HydrophobicContact CE2-CD 4.42Å; Y155-K391 HydrophobicContact CE2-CG 3.69Å; Y155-K391 HydrophobicContact CG-CB 4.17Å; G387-K391 WeakPolarHBondContact O-CB 3.49Å; G387-K391 PolarHBondContact O-N 2.85Å; T388-K391 WeakPolarHBondContact O-CB 3.37Å; T388-K391 PolarHBondContact O-N 2.69Å; K391-A395 WeakPolarHBondContact O-CB 3.2Å; K391-A395 PolarHBondContact O-N 2.9Å; K391-A395 VanDerWaalsContact O-N 3.14Å; K391-F410 HydrophobicContact CG-CE2 4.15Å; K391-Q411 PolarHBondContact NZ-O 3.09Å; K391-D416 IonicContact NZ-OD2 3.42Å; K391-D416 PolarHBondContact NZ-OD2 3.25Å
392	I	87.4	Confident	76.1	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-50.4	175.8	-70.6	162.9	0	0	0	111.6	A294 K297 I298 T388 A389 L390 F394 A395 F410 L412 L420	A294-I392 HydrophobicContact CB-CB 4.1Å; A294-I392 HydrophobicContact CB-CD1 4.18Å; A294-I392 HydrophobicContact CB-CG2 3.89Å; A294-I392 WeakPolarHBondContact O-CG2 3.43Å; K297-I392 HydrophobicContact CB-CG2 4.02Å; K297-I392 HydrophobicContact CD-CG2 4.08Å; K297-I392 WeakPolarHBondContact CE-O 3.39Å; K297-I392 HydrophobicContact CG-CG2 4.17Å; K297-I392 PolarHBondContact NZ-O 3.18Å; I298-I392 HydrophobicContact CD1-CD1 3.82Å; I298-I392 HydrophobicContact CG1-CD1 4.28Å; I298-I392 HydrophobicContact CG2-CB 4.08Å; I298-I392 HydrophobicContact CG2-CD1 3.57Å; I298-I392 HydrophobicContact CG2-CG1 3.48Å; I298-I392 VanDerWaalsContact CG2-CG1 3.48Å; I298-I392 HydrophobicContact CG2-CG2 3.47Å; I298-I392 VanDerWaalsContact CG2-CG2 3.47Å; T388-I392 HydrophobicContact CG2-CD1 4.07Å; T388-I392 WeakPolarHBondContact O-CD1 3.14Å; T388-I392 WeakPolarHBondContact O-CG1 3.38Å; T388-I392 PolarHBondContact O-N 2.73Å; A389-I392 WeakPolarHBondContact O-CB 3.36Å; A389-I392 PolarHBondContact O-N 3.28Å; L390-I392 PolarHBondContact O-N 2.71Å; I392-F394 VanDerWaalsContact C-N 3.26Å; I392-F394 PolarHBondContact O-N 3.34Å; I392-A395 WeakPolarHBondContact O-CB 3.36Å; I392-A395 PolarHBondContact O-N 3.39Å; I392-F410 HydrophobicContact CB-CZ 4.3Å; I392-F410 HydrophobicContact CG1-CE1 4.27Å; I392-F410 HydrophobicContact CG1-CE2 4.43Å; I392-F410 HydrophobicContact CG1-CZ 3.53Å; I392-L412 HydrophobicContact CD1-CD1 4.4Å; I392-L412 HydrophobicContact CG1-CD2 4.46Å; I392-L420 HydrophobicContact CD1-CD2 3.65Å
393	L	84	Confident	73.2	Confident	6 Å²	6	40.4 Å²	40.4	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-34.4	-175.1	-70.6	171.3	0	0	0	111.9	L290 R293 A294 K297 F342 A389 L390	L290-L393 HydrophobicContact CD1-CD1 3.31Å; L290-L393 HydrophobicContact CG-CD1 3.77Å; R293-L393 HydrophobicContact CB-CD2 4.25Å; R293-L393 HydrophobicContact CG-CD2 3.71Å; A294-L393 HydrophobicContact CB-CD1 4.47Å; A294-L393 HydrophobicContact CB-CD2 4.34Å; A294-L393 HydrophobicContact CB-CG 4.06Å; K297-L393 PolarHBondContact NZ-O 3.41Å; F342-L393 HydrophobicContact CE2-CB 4.22Å; F342-L393 HydrophobicContact CZ-CB 4.24Å; A389-L393 WeakPolarHBondContact O-CB 3.29Å; A389-L393 WeakPolarHBondContact O-CG 3.48Å; A389-L393 PolarHBondContact O-N 3.25Å; L390-L393 PolarHBondContact O-N 3.08Å; L390-L393 VanDerWaalsContact O-N 3.1Å
394	F	79.2	Confident	70.2	Confident	15 Å²	15	45.5 Å²	45.5	7%	0.066	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-8.5	174	-71.7	-63.9	0	0	0	114.9	F342 T349 L352 K353 F356 L390 I392 D396	F342-F394 HydrophobicContact CD1-CD1 4.29Å; F342-F394 AromaticContact CD1-CE1 3.4Å; F342-F394 HydrophobicContact CD1-CE1 3.4Å; F342-F394 VanDerWaalsContact CD1-CE1 3.4Å; F342-F394 AromaticContact CD1-CZ 3.84Å; F342-F394 HydrophobicContact CD1-CZ 3.84Å; F342-F394 HydrophobicContact CD2-CE1 4.43Å; F342-F394 AromaticContact CE1-CD1 3.96Å; F342-F394 HydrophobicContact CE1-CD1 3.96Å; F342-F394 AromaticContact CE1-CE1 3.1Å; F342-F394 HydrophobicContact CE1-CE1 3.1Å; F342-F394 HydrophobicContact CE1-CE2 4.05Å; F342-F394 AromaticContact CE1-CZ 3.15Å; F342-F394 HydrophobicContact CE1-CZ 3.15Å; F342-F394 HydrophobicContact CE2-CD1 4.28Å; F342-F394 HydrophobicContact CE2-CE1 4.2Å; F342-F394 HydrophobicContact CG-CE1 4.05Å; F342-F394 AromaticContact CZ-CD1 3.92Å; F342-F394 HydrophobicContact CZ-CD1 3.92Å; F342-F394 AromaticContact CZ-CE1 3.52Å; F342-F394 HydrophobicContact CZ-CE1 3.52Å; F342-F394 HydrophobicContact CZ-CE2 4.19Å; F342-F394 HydrophobicContact CZ-CG 4.42Å; F342-F394 AromaticContact CZ-CZ 3.67Å; F342-F394 HydrophobicContact CZ-CZ 3.67Å; T349-F394 HydrophobicContact CG2-CD1 4.23Å; T349-F394 HydrophobicContact CG2-CE1 4.43Å; L352-F394 HydrophobicContact CD2-CE1 4.45Å; L352-F394 HydrophobicContact CD2-CZ 4.47Å; L352-F394 HydrophobicContact CG-CE1 4.32Å; L352-F394 HydrophobicContact CG-CZ 4.13Å; K353-F394 HydrophobicContact CB-CB 4.21Å; K353-F394 HydrophobicContact CB-CD1 3.86Å; K353-F394 HydrophobicContact CB-CD2 4.28Å; K353-F394 HydrophobicContact CB-CE1 4.22Å; K353-F394 HydrophobicContact CB-CG 3.89Å; K353-F394 HydrophobicContact CD-CB 3.85Å; K353-F394 HydrophobicContact CD-CG 4.46Å; K353-F394 HydrophobicContact CG-CB 3.65Å; K353-F394 HydrophobicContact CG-CD1 4.23Å; K353-F394 HydrophobicContact CG-CD2 4.04Å; K353-F394 HydrophobicContact CG-CG 3.75Å; F356-F394 HydrophobicContact CB-CE2 4.05Å; F356-F394 HydrophobicContact CD2-CE2 4.06Å; F356-F394 AromaticContact CD2-CZ 3.81Å; F356-F394 HydrophobicContact CD2-CZ 3.81Å; F356-F394 HydrophobicContact CE2-CZ 4.42Å; F356-F394 HydrophobicContact CG-CE2 4.2Å; F356-F394 HydrophobicContact CG-CZ 4.41Å; L390-F394 HydrophobicContact CB-CD2 4.32Å; L390-F394 HydrophobicContact CB-CE2 4.33Å; L390-F394 HydrophobicContact CD2-CE2 4.36Å; L390-F394 WeakPolarHBondContact O-CD2 3.35Å; L390-F394 PolarHBondContact O-N 3.26Å; I392-F394 VanDerWaalsContact C-N 3.26Å; I392-F394 PolarHBondContact O-N 3.34Å; F394-D396 PolarHBondContact O-N 3.04Å
395	A	76.6	Confident	67.5	Low	13 Å²	13	49.1 Å²	49.1	11%	0.107	32%	0.317	C	S	.	.			trans	-72.3	125.2	176.5	0	0	0	0	0	110.3	K297 K391 I392 L397 F410	K297-A395 WeakPolarHBondContact CE-O 3.39Å; K297-A395 PolarHBondContact NZ-O 3.28Å; K391-A395 WeakPolarHBondContact O-CB 3.2Å; K391-A395 PolarHBondContact O-N 2.9Å; K391-A395 VanDerWaalsContact O-N 3.14Å; I392-A395 WeakPolarHBondContact O-CB 3.36Å; I392-A395 PolarHBondContact O-N 3.39Å; A395-L397 HydrophobicContact CB-CD2 3.94Å; A395-L397 HydrophobicContact CB-CG 3.94Å; A395-L397 PolarHBondContact O-N 3.21Å; A395-F410 HydrophobicContact CB-CD2 3.5Å; A395-F410 HydrophobicContact CB-CE2 3.6Å; A395-F410 HydrophobicContact CB-CG 4.41Å
396	D	64.4	Low	64.7	Low	151 Å²	151	55.7 Å²	55.7	81%	0.807	36%	0.359	S	S	*	.			trans	-74	71.5	164.2	-73.2	-28.9	0	0	0	108.3	F394	F394-D396 PolarHBondContact O-N 3.04Å
397	L	58.6	Low	62.3	Low	29 Å²	29	61.5 Å²	61.5	15%	0.152	38%	0.384	C	S	.	.			trans	-62.5	126.6	176.9	-65.8	176.6	0	0	0	108.1	K297 Y301 A395 S399 F410	K297-L397 HydrophobicContact CD-CD1 4.24Å; K297-L397 HydrophobicContact CG-CD1 3.68Å; Y301-L397 HydrophobicContact CD2-CD1 4.24Å; Y301-L397 HydrophobicContact CE2-CB 4.18Å; Y301-L397 HydrophobicContact CE2-CD1 3.74Å; Y301-L397 HydrophobicContact CE2-CD2 4.1Å; Y301-L397 HydrophobicContact CE2-CG 4.23Å; A395-L397 HydrophobicContact CB-CD2 3.94Å; A395-L397 HydrophobicContact CB-CG 3.94Å; A395-L397 PolarHBondContact O-N 3.21Å; L397-S399 PolarHBondContact O-N 2.76Å; L397-F410 HydrophobicContact CD2-CB 3.58Å; L397-F410 HydrophobicContact CD2-CD1 3.58Å; L397-F410 HydrophobicContact CD2-CD2 3.92Å; L397-F410 HydrophobicContact CD2-CE1 4.25Å; L397-F410 HydrophobicContact CD2-CG 3.4Å; L397-F410 VanDerWaalsContact CD2-CG 3.4Å
398	P	48.9	Very low	60.2	Low	58 Å²	58	67.5 Å²	67.5	38%	0.377	41%	0.41	S	S	.	.			trans	-60.8	115.2	175.4	22.2	-28.4	0	0	0	107.8	Y301 A400	Y301-P398 PolarHBondContact OH-O 2.69Å; Y301-P398 VanDerWaalsContact OH-O 3.04Å; P398-A400 PolarHBondContact O-N 3.39Å
399	S	45.5	Very low	58.5	Low	88 Å²	88	77.8 Å²	77.8	62%	0.615	45%	0.449	S	S	*	.			trans	-53.8	133.3	165.3	-165.6	0	0	0	0	106.5	L397 Q401 S402	L397-S399 PolarHBondContact O-N 2.76Å; S399-Q401 PolarHBondContact O-N 3.4Å; S399-S402 PolarHBondContact O-N 2.89Å; S399-S402 PolarHBondContact O-OG 3.39Å
400	A	44.8	Very low	57.2	Low	109 Å²	109	80.1 Å²	80.1	90%	0.901	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	0.8	-170.4	0	0	0	0	0	115.2	P398	P398-A400 PolarHBondContact O-N 3.39Å
401	Q	40	Very low	56.4	Low	186 Å²	186	84.4 Å²	84.4	87%	0.869	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-6.1	-177.7	-62.1	-178.9	5.6	0	0	115	S399	S399-Q401 PolarHBondContact O-N 3.4Å
402	S	38.6	Very low	56	Low	63 Å²	63	83.8 Å²	83.8	44%	0.441	48%	0.477	S	S	.	.			trans	-101.8	93.9	-179.2	65.7	0	0	0	0	112.7	S399 T404	S399-S402 PolarHBondContact O-N 2.89Å; S399-S402 PolarHBondContact O-OG 3.39Å; S402-T404 PolarHBondContact O-N 3.41Å
403	G	36.6	Very low	55.8	Low	83 Å²	83	87 Å²	87	86%	0.856	49%	0.492	S	S	*	.			trans	-76	40.4	-179.1	0	0	0	0	0	116.3
404	T	32.6	Very low	55.7	Low	108 Å²	108	88.5 Å²	88.5	66%	0.663	50%	0.498	S	S	*	.			trans	-133.7	121.1	180	27.5	0	0	0	0	113.3	S402	S402-T404 PolarHBondContact O-N 3.41Å
405	S	36.9	Very low	56.2	Low	85 Å²	85	88 Å²	88	59%	0.594	50%	0.496	S	S	*	.			trans	75.9	139.3	173.9	61.7	0	0	0	0	117.7	K407	S405-K407 PolarHBondContact O-N 3.29Å
406	P	39	Very low	56.8	Low	137 Å²	137	88 Å²	88	89%	0.89	49%	0.494	S	S	*	.			trans	-73	74.3	174.3	32.6	-32.6	0	0	0	108.2	K408	P406-K408 PolarHBondContact O-N 3.18Å
407	K	43.7	Very low	58	Low	123 Å²	123	81 Å²	81	54%	0.535	46%	0.456	S	S	.	.			trans	-64.7	131.7	172.2	-70.3	-177.6	179.4	177	0	107.3	S405 R409	S405-K407 PolarHBondContact O-N 3.29Å; K407-R409 PolarHBondContact O-N 2.86Å
408	K	49.1	Very low	59.6	Low	125 Å²	125	79.7 Å²	79.7	54%	0.543	45%	0.45	S	S	.	.			trans	-20.1	116.6	179.7	-84	-176.2	159	-161.8	0	111.6	D153 P406 F410	D153-K408 IonicContact OD2-NZ 2.66Å; D153-K408 PolarHBondContact OD2-NZ 3.46Å; P406-K408 PolarHBondContact O-N 3.18Å; K408-F410 PolarHBondContact O-N 3.37Å
409	R	54.9	Low	61.9	Low	219 Å²	219	76.9 Å²	76.9	83%	0.826	43%	0.432	S	S	*	.			trans	-56.6	103.8	174.2	-89	-175.5	174.4	178.5	-2	107.8	K407 Q411	K407-R409 PolarHBondContact O-N 2.86Å; R409-Q411 HydrophobicContact CB-CG 4.24Å; R409-Q411 PolarHBondContact O-N 2.96Å; R409-Q411 VanDerWaalsContact O-N 3.13Å
410	F	65.7	Low	64.3	Low	49 Å²	49	72.7 Å²	72.7	22%	0.215	40%	0.402	C	S	.	.			trans	-61.8	114.2	169.1	179.8	-97	0	0	0	107.2	I298 K391 I392 A395 L397 K408 L412	I298-F410 HydrophobicContact CG2-CE1 4Å; I298-F410 HydrophobicContact CG2-CZ 4.42Å; K391-F410 HydrophobicContact CG-CE2 4.15Å; I392-F410 HydrophobicContact CB-CZ 4.3Å; I392-F410 HydrophobicContact CG1-CE1 4.27Å; I392-F410 HydrophobicContact CG1-CE2 4.43Å; I392-F410 HydrophobicContact CG1-CZ 3.53Å; A395-F410 HydrophobicContact CB-CD2 3.5Å; A395-F410 HydrophobicContact CB-CE2 3.6Å; A395-F410 HydrophobicContact CB-CG 4.41Å; L397-F410 HydrophobicContact CD2-CB 3.58Å; L397-F410 HydrophobicContact CD2-CD1 3.58Å; L397-F410 HydrophobicContact CD2-CD2 3.92Å; L397-F410 HydrophobicContact CD2-CE1 4.25Å; L397-F410 HydrophobicContact CD2-CG 3.4Å; L397-F410 VanDerWaalsContact CD2-CG 3.4Å; K408-F410 PolarHBondContact O-N 3.37Å; F410-L412 HydrophobicContact CD1-CG 4.5Å; F410-L412 HydrophobicContact CE1-CD1 3.87Å; F410-L412 HydrophobicContact CE1-CD2 3.93Å; F410-L412 HydrophobicContact CE1-CG 3.61Å; F410-L412 HydrophobicContact CZ-CD1 4.35Å; F410-L412 HydrophobicContact CZ-CD2 3.72Å; F410-L412 HydrophobicContact CZ-CG 3.96Å
411	Q	70.8	Confident	66.8	Low	90 Å²	90	67.5 Å²	67.5	42%	0.421	36%	0.36	S	S	.	.			trans	-121.2	131.9	179.9	-69.5	-177	38.6	0	0	109.4	K391 R409	K391-Q411 PolarHBondContact NZ-O 3.09Å; R409-Q411 HydrophobicContact CB-CG 4.24Å; R409-Q411 PolarHBondContact O-N 2.96Å; R409-Q411 VanDerWaalsContact O-N 3.13Å
412	L	78.4	Confident	69.5	Low	22 Å²	22	59 Å²	59	12%	0.115	32%	0.32	C	S	.	.			trans	-107	133.3	167.5	-65.5	174.9	0	0	0	107.4	I298 T388 I392 F410 D416 V417	I298-L412 HydrophobicContact CD1-CD1 3.8Å; I298-L412 HydrophobicContact CG2-CD1 4.23Å; T388-L412 HydrophobicContact CG2-CD2 3.74Å; I392-L412 HydrophobicContact CD1-CD1 4.4Å; I392-L412 HydrophobicContact CG1-CD2 4.46Å; F410-L412 HydrophobicContact CD1-CG 4.5Å; F410-L412 HydrophobicContact CE1-CD1 3.87Å; F410-L412 HydrophobicContact CE1-CD2 3.93Å; F410-L412 HydrophobicContact CE1-CG 3.61Å; F410-L412 HydrophobicContact CZ-CD1 4.35Å; F410-L412 HydrophobicContact CZ-CD2 3.72Å; F410-L412 HydrophobicContact CZ-CG 3.96Å; L412-D416 WeakPolarHBondContact CA-OD2 3.21Å; L412-D416 HydrophobicContact CB-CB 4.13Å; L412-D416 HydrophobicContact CD2-CB 3.97Å; L412-V417 HydrophobicContact CB-CG2 4.2Å; L412-V417 HydrophobicContact CD1-CG2 4.48Å
413	Q	82.5	Confident	72.3	Confident	68 Å²	68	56 Å²	56	32%	0.318	30%	0.299	S	S	.	.			trans	-81.7	173.9	170.8	-58.7	-61.1	-29.9	0	0	110.3	E161 N415 D416 V417	E161-Q413 WeakPolarHBondContact OE1-CB 3.49Å; Q413-N415 VanDerWaalsContact C-N 3.34Å; Q413-N415 PolarHBondContact O-N 3.14Å; Q413-D416 PolarHBondContact N-OD2 3.29Å; Q413-D416 WeakPolarHBondContact O-CB 2.84Å; Q413-D416 PolarHBondContact O-N 3.49Å; Q413-V417 PolarHBondContact O-N 3.32Å
414	R	83.5	Confident	75.3	Confident	37 Å²	37	52.1 Å²	52.1	14%	0.14	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-47.5	177.2	-173.3	-171.8	-168.6	88.4	24	110.5	C66 E161 Y308 D416 V417 V418	C66-R414 VanDerWaalsContact CA-NH2 3.34Å; C66-R414 PolarHBondContact O-NH2 3.18Å; E161-R414 PolarHBondContact OE1-N 3.14Å; Y308-R414 PolarHBondContact O-NH1 3Å; Y308-R414 PolarHBondContact O-NH2 3.45Å; R414-D416 VanDerWaalsContact C-N 3.28Å; R414-D416 PolarHBondContact O-N 3Å; R414-V417 PolarHBondContact O-N 2.98Å; R414-V417 VanDerWaalsContact O-N 3.11Å; R414-V418 HydrophobicContact CG-CG2 4.28Å; R414-V418 WeakPolarHBondContact O-CG2 3.34Å; R414-V418 PolarHBondContact O-N 3.42Å
415	N	88.8	Confident	78.4	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-34.6	179.5	-100.1	9.8	0	0	0	113.1	Y70 K71 E161 Q413 V417 A419	Y70-N415 HydrophobicContact CE2-CB 4.32Å; K71-N415 WeakPolarHBondContact CB-OD1 3.42Å; K71-N415 PolarHBondContact N-OD1 3.12Å; K71-N415 PolarHBondContact O-ND2 3.03Å; E161-N415 WeakPolarHBondContact OE1-CB 3.44Å; E161-N415 PolarHBondContact OE1-N 3.16Å; Q413-N415 VanDerWaalsContact C-N 3.34Å; Q413-N415 PolarHBondContact O-N 3.14Å; N415-V417 VanDerWaalsContact C-N 3.32Å; N415-V417 PolarHBondContact O-N 3.24Å; N415-A419 WeakPolarHBondContact O-CB 3.44Å; N415-A419 PolarHBondContact O-N 3.44Å
416	D	89.2	Confident	81.3	Confident	15 Å²	15	44.6 Å²	44.6	8%	0.08	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-47.3	174	-84.5	-51.7	0	0	0	110.2	H384 T388 K391 L412 Q413 R414 L420	H384-D416 IonicContact NE2-OD1 3.57Å; H384-D416 PolarHBondContact NE2-OD1 3.48Å; T388-D416 HydrophobicContact CG2-CB 3.82Å; T388-D416 PolarHBondContact OG1-OD1 2.87Å; K391-D416 IonicContact NZ-OD2 3.42Å; K391-D416 PolarHBondContact NZ-OD2 3.25Å; L412-D416 WeakPolarHBondContact CA-OD2 3.21Å; L412-D416 HydrophobicContact CB-CB 4.13Å; L412-D416 HydrophobicContact CD2-CB 3.97Å; Q413-D416 PolarHBondContact N-OD2 3.29Å; Q413-D416 WeakPolarHBondContact O-CB 2.84Å; Q413-D416 PolarHBondContact O-N 3.49Å; R414-D416 VanDerWaalsContact C-N 3.28Å; R414-D416 PolarHBondContact O-N 3Å; D416-L420 WeakPolarHBondContact O-CB 3.19Å; D416-L420 PolarHBondContact O-N 3.43Å
417	V	90.3	Very high	84.1	Confident	2 Å²	2	38 Å²	38	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-68.5	-47	-178.7	178.4	0	0	0	0	110.7	L67 L306 F307 L412 Q413 R414 N415 A419 L420 F421	L67-V417 HydrophobicContact CD2-CG1 4.39Å; L306-V417 HydrophobicContact CB-CG2 4.44Å; L306-V417 HydrophobicContact CD1-CG2 4.13Å; L306-V417 HydrophobicContact CD2-CG2 4.18Å; L306-V417 HydrophobicContact CG-CG2 4.49Å; F307-V417 HydrophobicContact CE1-CG1 3.58Å; F307-V417 HydrophobicContact CZ-CG1 3.67Å; L412-V417 HydrophobicContact CB-CG2 4.2Å; L412-V417 HydrophobicContact CD1-CG2 4.48Å; Q413-V417 PolarHBondContact O-N 3.32Å; R414-V417 PolarHBondContact O-N 2.98Å; R414-V417 VanDerWaalsContact O-N 3.11Å; N415-V417 VanDerWaalsContact C-N 3.32Å; N415-V417 PolarHBondContact O-N 3.24Å; V417-A419 VanDerWaalsContact C-N 3.31Å; V417-A419 PolarHBondContact O-N 3.3Å; V417-L420 PolarHBondContact O-N 2.86Å; V417-F421 HydrophobicContact CG1-CD2 3.76Å; V417-F421 HydrophobicContact CG1-CE2 3.8Å; V417-F421 WeakPolarHBondContact O-CD2 3.25Å; V417-F421 PolarHBondContact O-N 3.14Å
418	V	92.7	Very high	86.7	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.012	14%	0.138	C	C	.	.	H	α-helix	trans	-56.5	-47.9	176.6	173.2	0	0	0	0	110.5	L67 Y70 L171 R414 N422	L67-V418 HydrophobicContact CD2-CG2 4.28Å; Y70-V418 HydrophobicContact CD2-CB 4.4Å; Y70-V418 HydrophobicContact CD2-CG1 3.85Å; Y70-V418 HydrophobicContact CG-CG1 4.44Å; L171-V418 HydrophobicContact CD1-CG1 4.5Å; R414-V418 HydrophobicContact CG-CG2 4.28Å; R414-V418 WeakPolarHBondContact O-CG2 3.34Å; R414-V418 PolarHBondContact O-N 3.42Å; V418-N422 VanDerWaalsContact O-CB 3.32Å; V418-N422 WeakPolarHBondContact O-CB 3.18Å; V418-N422 PolarHBondContact O-N 3.22Å; V418-N422 PolarHBondContact O-ND2 3Å
419	A	95.5	Very high	89	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.3	-45	-179.7	0	0	0	0	0	112	Y70 H384 N415 V417 S423	Y70-A419 HydrophobicContact CE2-CB 4.13Å; H384-A419 HydrophobicContact CB-CB 3.83Å; N415-A419 WeakPolarHBondContact O-CB 3.44Å; N415-A419 PolarHBondContact O-N 3.44Å; V417-A419 VanDerWaalsContact C-N 3.31Å; V417-A419 PolarHBondContact O-N 3.3Å; A419-S423 WeakPolarHBondContact O-CB 3.27Å; A419-S423 PolarHBondContact O-N 2.94Å
420	L	96	Very high	91.1	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.1	-51.9	178.9	178.9	63.8	0	0	0	111.9	I298 T388 A389 I392 D416 V417 S423 I424	I298-L420 HydrophobicContact CD1-CD2 3.65Å; T388-L420 HydrophobicContact CG2-CB 4.36Å; A389-L420 HydrophobicContact CB-CD1 3.86Å; I392-L420 HydrophobicContact CD1-CD2 3.65Å; D416-L420 WeakPolarHBondContact O-CB 3.19Å; D416-L420 PolarHBondContact O-N 3.43Å; V417-L420 PolarHBondContact O-N 2.86Å; L420-S423 PolarHBondContact O-N 3.28Å; L420-I424 HydrophobicContact CD1-CD1 4.12Å; L420-I424 HydrophobicContact CG-CD1 4.12Å; L420-I424 WeakPolarHBondContact O-CG1 3.42Å; L420-I424 PolarHBondContact O-N 3.42Å
421	F	96.9	Very high	92.5	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65	-43.4	-178.4	-86.1	-102	0	0	0	111.9	L61 L62 L67 L295 L302 F307 I322 L325 V417 S423 I424 G425	L61-F421 HydrophobicContact CD2-CD1 3.77Å; L61-F421 HydrophobicContact CD2-CE1 3.62Å; L62-F421 HydrophobicContact CD2-CB 3.96Å; L67-F421 HydrophobicContact CD1-CB 3.95Å; L67-F421 HydrophobicContact CD1-CD1 3.93Å; L67-F421 HydrophobicContact CD1-CG 4.03Å; L67-F421 HydrophobicContact CD2-CB 4.02Å; L67-F421 HydrophobicContact CD2-CD2 4.48Å; L67-F421 HydrophobicContact CD2-CG 4.24Å; L295-F421 HydrophobicContact CD1-CE1 4.31Å; L295-F421 HydrophobicContact CD1-CE2 3.7Å; L295-F421 HydrophobicContact CD1-CZ 3.59Å; L295-F421 HydrophobicContact CD2-CE1 4.36Å; L295-F421 HydrophobicContact CD2-CZ 4.43Å; L302-F421 HydrophobicContact CD1-CZ 4.22Å; L302-F421 HydrophobicContact CD2-CE2 4.44Å; F307-F421 HydrophobicContact CE1-CE2 4.4Å; F307-F421 HydrophobicContact CZ-CE2 4.19Å; F307-F421 HydrophobicContact CZ-CZ 4.27Å; I322-F421 HydrophobicContact CG1-CE1 4.41Å; I322-F421 HydrophobicContact CG1-CZ 4.47Å; I322-F421 HydrophobicContact CG2-CZ 4.49Å; L325-F421 HydrophobicContact CD2-CD1 4.42Å; L325-F421 HydrophobicContact CD2-CE1 3.86Å; V417-F421 HydrophobicContact CG1-CD2 3.76Å; V417-F421 HydrophobicContact CG1-CE2 3.8Å; V417-F421 WeakPolarHBondContact O-CD2 3.25Å; V417-F421 PolarHBondContact O-N 3.14Å; F421-S423 VanDerWaalsContact C-N 3.34Å; F421-S423 PolarHBondContact O-N 3.13Å; F421-I424 PolarHBondContact O-N 3.38Å; F421-G425 PolarHBondContact O-N 3.02Å
422	N	97.9	Very high	93.7	Very high	8 Å²	8	14.1 Å²	14.1	4%	0.043	7%	0.065	C	C	.	.	H	α-helix	trans	-66.5	-36.5	178.1	-81.5	-81.1	0	0	0	111.9	L62 L67 L171 L381 V418 G425 R426	L62-N422 HydrophobicContact CD2-CB 4.36Å; L67-N422 PolarHBondContact O-ND2 2.6Å; L171-N422 HydrophobicContact CD1-CB 4.31Å; L171-N422 VanDerWaalsContact CD1-CG 3.43Å; L171-N422 WeakPolarHBondContact CD1-ND2 3.3Å; L171-N422 WeakPolarHBondContact CD1-OD1 3.33Å; L381-N422 HydrophobicContact CD1-CB 3.92Å; L381-N422 HydrophobicContact CD2-CB 3.56Å; L381-N422 HydrophobicContact CG-CB 4.22Å; V418-N422 VanDerWaalsContact O-CB 3.32Å; V418-N422 WeakPolarHBondContact O-CB 3.18Å; V418-N422 PolarHBondContact O-N 3.22Å; V418-N422 PolarHBondContact O-ND2 3Å; N422-G425 WeakPolarHBondContact O-CA 3.1Å; N422-G425 PolarHBondContact O-N 2.92Å; N422-R426 WeakPolarHBondContact O-CG 3.35Å; N422-R426 PolarHBondContact O-N 3.44Å
423	S	98.1	Very high	94.6	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.5	-50.4	173.7	-166.6	0	0	0	0	111.4	E291 A419 L420 F421 G425 R426 F427	E291-S423 VanDerWaalsContact CD-OG 3.31Å; E291-S423 VanDerWaalsContact OE1-CB 3.3Å; E291-S423 WeakPolarHBondContact OE1-CB 3.08Å; E291-S423 PolarHBondContact OE1-OG 3.47Å; E291-S423 VanDerWaalsContact OE2-C 3.28Å; E291-S423 PolarHBondContact OE2-OG 3.38Å; A419-S423 WeakPolarHBondContact O-CB 3.27Å; A419-S423 PolarHBondContact O-N 2.94Å; L420-S423 PolarHBondContact O-N 3.28Å; F421-S423 VanDerWaalsContact C-N 3.34Å; F421-S423 PolarHBondContact O-N 3.13Å; S423-G425 PolarHBondContact O-N 2.75Å; S423-R426 WeakPolarHBondContact O-CB 2.99Å; S423-R426 PolarHBondContact O-N 3.07Å; S423-F427 WeakPolarHBondContact O-CD2 3.31Å; S423-F427 PolarHBondContact O-N 3.17Å; S423-F427 WeakPolarHBondContact OG-CE2 2.97Å
424	I	97.7	Very high	95.2	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-56.3	-41.9	174.9	-67.6	168.1	0	0	0	110.3	L58 F288 E291 M292 L295 L420 F421 R426 F427 S428	L58-I424 HydrophobicContact CD1-CG2 3.73Å; L58-I424 HydrophobicContact CD2-CG2 4.23Å; F288-I424 HydrophobicContact CE2-CG2 4.28Å; E291-I424 HydrophobicContact CB-CD1 4.13Å; E291-I424 HydrophobicContact CB-CG1 3.52Å; E291-I424 HydrophobicContact CG-CG1 4.46Å; E291-I424 VanDerWaalsContact OE2-CA 3.31Å; E291-I424 WeakPolarHBondContact OE2-CA 3.46Å; E291-I424 WeakPolarHBondContact OE2-CG1 3.4Å; E291-I424 PolarHBondContact OE2-N 3.23Å; M292-I424 HydrophobicContact SD-CG2 3.52Å; M292-I424 VanDerWaalsContact SD-CG2 3.52Å; L295-I424 HydrophobicContact CB-CD1 3.88Å; L295-I424 HydrophobicContact CD2-CD1 3.77Å; L295-I424 HydrophobicContact CG-CD1 4.36Å; L420-I424 HydrophobicContact CD1-CD1 4.12Å; L420-I424 HydrophobicContact CG-CD1 4.12Å; L420-I424 WeakPolarHBondContact O-CG1 3.42Å; L420-I424 PolarHBondContact O-N 3.42Å; F421-I424 PolarHBondContact O-N 3.38Å; I424-R426 PolarHBondContact O-N 3.46Å; I424-F427 PolarHBondContact O-N 3.12Å; I424-S428 WeakPolarHBondContact O-CB 3.49Å; I424-S428 PolarHBondContact O-N 3.12Å
425	G	97.9	Very high	95.6	Very high	3 Å²	3	10.3 Å²	10.3	3%	0.031	5%	0.051	C	C	.	.	H	α-helix	trans	-56.8	-43.7	174.4	0	0	0	0	0	114.1	F421 N422 S423 S429	F421-G425 PolarHBondContact O-N 3.02Å; N422-G425 WeakPolarHBondContact O-CA 3.1Å; N422-G425 PolarHBondContact O-N 2.92Å; S423-G425 PolarHBondContact O-N 2.75Å; G425-S429 WeakPolarHBondContact O-CB 3.31Å; G425-S429 PolarHBondContact O-N 2.76Å; G425-S429 PolarHBondContact O-OG 3.38Å
426	R	98.3	Very high	95.8	Very high	32 Å²	32	12 Å²	12	12%	0.121	6%	0.059	C	C	.	.	H	α-helix	trans	-64.8	-47.3	176.6	-66.9	-48.7	-54.2	150.9	5.5	111.4	E176 S239 W378 Q382 N422 S423 I424 S428 S429 S430	E176-R426 IonicContact OE1-NE 3.5Å; E176-R426 IonicContact OE2-CZ 3.13Å; E176-R426 VanDerWaalsContact OE2-CZ 3.24Å; E176-R426 IonicContact OE2-NE 2.76Å; E176-R426 PolarHBondContact OE2-NE 2.89Å; E176-R426 IonicContact OE2-NH2 3.12Å; E176-R426 PolarHBondContact OE2-NH2 3.27Å; S239-R426 PolarHBondContact OG-NH2 3.37Å; W378-R426 HydrophobicContact CE3-CG 3.91Å; W378-R426 VanDerWaalsContact CZ3-CD 3.46Å; W378-R426 HydrophobicContact CZ3-CG 3.71Å; Q382-R426 HydrophobicContact CG-CG 4.24Å; N422-R426 WeakPolarHBondContact O-CG 3.35Å; N422-R426 PolarHBondContact O-N 3.44Å; S423-R426 WeakPolarHBondContact O-CB 2.99Å; S423-R426 PolarHBondContact O-N 3.07Å; I424-R426 PolarHBondContact O-N 3.46Å; R426-S428 PolarHBondContact O-N 3.26Å; R426-S429 PolarHBondContact O-N 3.06Å; R426-S430 PolarHBondContact O-N 2.83Å; R426-S430 PolarHBondContact O-OG 3.11Å; R426-S430 VanDerWaalsContact O-OG 3.1Å
427	F	98.1	Very high	96	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-63.2	-42.6	176.9	-71.9	-69.2	0	0	0	112.3	L232 L284 V287 F288 E291 I386 S423 I424 S429 S430 I431	L232-F427 HydrophobicContact CB-CZ 4.41Å; L232-F427 HydrophobicContact CD1-CZ 4.27Å; L284-F427 HydrophobicContact CD1-CD1 3.7Å; L284-F427 HydrophobicContact CD1-CE1 4.19Å; V287-F427 HydrophobicContact CB-CD1 4.23Å; V287-F427 HydrophobicContact CB-CE1 3.79Å; V287-F427 HydrophobicContact CB-CE2 4.39Å; V287-F427 HydrophobicContact CB-CZ 3.9Å; V287-F427 HydrophobicContact CG1-CD1 4.3Å; V287-F427 HydrophobicContact CG1-CD2 4.1Å; V287-F427 HydrophobicContact CG1-CE1 3.71Å; V287-F427 HydrophobicContact CG1-CE2 3.47Å; V287-F427 VanDerWaalsContact CG1-CE2 3.47Å; V287-F427 HydrophobicContact CG1-CZ 3.26Å; F288-F427 HydrophobicContact CB-CB 4.04Å; F288-F427 HydrophobicContact CD2-CB 3.89Å; F288-F427 HydrophobicContact CG-CB 4.44Å; E291-F427 VanDerWaalsContact OE2-CD2 3.27Å; E291-F427 WeakPolarHBondContact OE2-CD2 3.14Å; I386-F427 HydrophobicContact CD1-CE2 4.29Å; I386-F427 HydrophobicContact CD1-CZ 4.14Å; I386-F427 HydrophobicContact CG1-CE2 4.32Å; S423-F427 WeakPolarHBondContact O-CD2 3.31Å; S423-F427 PolarHBondContact O-N 3.17Å; S423-F427 WeakPolarHBondContact OG-CE2 2.97Å; I424-F427 PolarHBondContact O-N 3.12Å; F427-S429 VanDerWaalsContact C-N 3.33Å; F427-S429 PolarHBondContact O-N 2.53Å; F427-S430 PolarHBondContact O-N 3.14Å; F427-I431 WeakPolarHBondContact O-CG1 3.3Å; F427-I431 PolarHBondContact O-N 3.15Å
428	S	97.8	Very high	95.9	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-57.7	-45.5	173.9	176.1	0	0	0	0	111.7	N50 H55 I424 R426 I431 R432	N50-S428 PolarHBondContact ND2-O 2.84Å; N50-S428 WeakPolarHBondContact OD1-CA 3.18Å; N50-S428 WeakPolarHBondContact OD1-CB 3.26Å; N50-S428 PolarHBondContact OD1-OG 3.36Å; H55-S428 PolarHBondContact ND1-OG 2.9Å; I424-S428 WeakPolarHBondContact O-CB 3.49Å; I424-S428 PolarHBondContact O-N 3.12Å; R426-S428 PolarHBondContact O-N 3.26Å; S428-I431 PolarHBondContact O-N 3.09Å; S428-R432 PolarHBondContact O-N 3.08Å
429	S	98.1	Very high	95.8	Very high	27 Å²	27	17.1 Å²	17.1	19%	0.189	8%	0.081	C	C	.	.	H	α-helix	trans	-64.5	-42.1	177	-57.3	0	0	0	0	111.6	G425 R426 F427 I431 R432 E433	G425-S429 WeakPolarHBondContact O-CB 3.31Å; G425-S429 PolarHBondContact O-N 2.76Å; G425-S429 PolarHBondContact O-OG 3.38Å; R426-S429 PolarHBondContact O-N 3.06Å; F427-S429 VanDerWaalsContact C-N 3.33Å; F427-S429 PolarHBondContact O-N 2.53Å; S429-I431 PolarHBondContact O-N 2.02Å; S429-R432 WeakPolarHBondContact O-CB 3.44Å; S429-R432 PolarHBondContact O-N 3.16Å; S429-E433 WeakPolarHBondContact O-CG 3.37Å; S429-E433 PolarHBondContact O-N 3.4Å
430	S	98.1	Very high	95.6	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.007	10%	0.097	C	C	.	.	H	α-helix	trans	-62.4	-42.3	176.7	-62	0	0	0	0	112.4	S235 R426 F427 R432 E433 V434	S235-S430 VanDerWaalsContact CA-OG 3.31Å; S235-S430 WeakPolarHBondContact CA-OG 3.42Å; S235-S430 WeakPolarHBondContact CB-OG 3.39Å; S235-S430 PolarHBondContact O-OG 3.15Å; S235-S430 PolarHBondContact OG-OG 3.33Å; R426-S430 PolarHBondContact O-N 2.83Å; R426-S430 PolarHBondContact O-OG 3.11Å; R426-S430 VanDerWaalsContact O-OG 3.1Å; F427-S430 PolarHBondContact O-N 3.14Å; S430-R432 VanDerWaalsContact C-N 3.31Å; S430-R432 PolarHBondContact O-N 2.99Å; S430-E433 PolarHBondContact O-N 2.91Å; S430-V434 WeakPolarHBondContact O-CG2 3.21Å; S430-V434 PolarHBondContact O-N 3.32Å
431	I	95.4	Very high	95.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.8	-41.7	175.1	-69.5	169.1	0	0	0	110.5	V46 D47 N50 L284 Y285 F288 F427 S428 S429 E433 V434 A435	V46-I431 HydrophobicContact CG1-CD1 4.48Å; D47-I431 WeakPolarHBondContact OD1-CG2 3.26Å; N50-I431 HydrophobicContact CB-CG2 4.11Å; L284-I431 HydrophobicContact CD2-CG1 3.9Å; L284-I431 HydrophobicContact CG-CG1 4.3Å; Y285-I431 HydrophobicContact CD1-CD1 3.9Å; Y285-I431 HydrophobicContact CD1-CG1 4.17Å; Y285-I431 HydrophobicContact CE1-CB 4.5Å; Y285-I431 HydrophobicContact CE1-CD1 4.04Å; Y285-I431 HydrophobicContact CE1-CG1 3.94Å; Y285-I431 HydrophobicContact CE1-CG2 3.81Å; F288-I431 HydrophobicContact CB-CD1 3.7Å; F288-I431 HydrophobicContact CD1-CD1 3.45Å; F288-I431 VanDerWaalsContact CD1-CD1 3.45Å; F288-I431 HydrophobicContact CD2-CD1 4.05Å; F288-I431 HydrophobicContact CE1-CD1 4.06Å; F288-I431 HydrophobicContact CG-CD1 3.44Å; F288-I431 VanDerWaalsContact CG-CD1 3.44Å; F427-I431 WeakPolarHBondContact O-CG1 3.3Å; F427-I431 PolarHBondContact O-N 3.15Å; S428-I431 PolarHBondContact O-N 3.09Å; S429-I431 PolarHBondContact O-N 2.02Å; I431-E433 VanDerWaalsContact C-N 3.35Å; I431-E433 PolarHBondContact O-N 2.66Å; I431-V434 PolarHBondContact O-N 2.92Å; I431-A435 PolarHBondContact O-N 3.41Å
432	R	96.4	Very high	94.2	Very high	76 Å²	76	28.2 Å²	28.2	29%	0.287	14%	0.135	S	C	.	.	H	α-helix	trans	-61	-44.8	175.2	177.9	60.7	-171.4	-158.9	2.6	111.9	N51 S428 S429 S430 V434 A435 E436	N51-R432 WeakPolarHBondContact OD1-CA 3.49Å; N51-R432 WeakPolarHBondContact OD1-CB 3.31Å; N51-R432 PolarHBondContact OD1-N 3.21Å; S428-R432 PolarHBondContact O-N 3.08Å; S429-R432 WeakPolarHBondContact O-CB 3.44Å; S429-R432 PolarHBondContact O-N 3.16Å; S430-R432 VanDerWaalsContact C-N 3.31Å; S430-R432 PolarHBondContact O-N 2.99Å; R432-V434 VanDerWaalsContact C-N 3.33Å; R432-V434 PolarHBondContact O-N 3.25Å; R432-A435 WeakPolarHBondContact O-CB 3.44Å; R432-A435 PolarHBondContact O-N 3.19Å; R432-E436 IonicContact CZ-OE1 3.91Å; R432-E436 IonicContact NE-OE1 3.82Å; R432-E436 PolarHBondContact NE-OE1 3.36Å; R432-E436 VanDerWaalsContact NE-OE1 3.12Å; R432-E436 IonicContact NH2-OE1 2.71Å; R432-E436 PolarHBondContact NH2-OE1 3.45Å; R432-E436 PolarHBondContact O-N 3.45Å; R432-E436 VanDerWaalsContact O-N 3.11Å
433	E	97.1	Very high	93.2	Very high	30 Å²	30	32.4 Å²	32.4	14%	0.14	17%	0.165	C	C	.	.	H	α-helix	trans	-67	-32.4	179.4	-72.1	-59.8	147.3	0	0	112.7	I238 A242 R259 S429 S430 I431 A435 E436 F437	I238-E433 HydrophobicContact CG2-CB 3.66Å; A242-E433 HydrophobicContact CB-CB 4.12Å; A242-E433 HydrophobicContact CB-CG 3.65Å; A242-E433 WeakPolarHBondContact CB-OE2 3.41Å; R259-E433 IonicContact CZ-OE1 3.75Å; R259-E433 IonicContact CZ-OE2 3.52Å; R259-E433 IonicContact NE-OE1 3.56Å; R259-E433 IonicContact NE-OE2 3.71Å; R259-E433 PolarHBondContact NE-OE2 3.32Å; R259-E433 IonicContact NH2-OE1 2.73Å; R259-E433 PolarHBondContact NH2-OE1 3.33Å; R259-E433 IonicContact NH2-OE2 3.29Å; R259-E433 PolarHBondContact NH2-OE2 3.47Å; S429-E433 WeakPolarHBondContact O-CG 3.37Å; S429-E433 PolarHBondContact O-N 3.4Å; S430-E433 PolarHBondContact O-N 2.91Å; I431-E433 VanDerWaalsContact C-N 3.35Å; I431-E433 PolarHBondContact O-N 2.66Å; E433-A435 VanDerWaalsContact C-N 3.31Å; E433-A435 PolarHBondContact O-N 3.22Å; E433-E436 PolarHBondContact O-N 3.23Å; E433-F437 HydrophobicContact CB-CD2 4.49Å; E433-F437 HydrophobicContact CB-CE2 4.47Å; E433-F437 WeakPolarHBondContact O-CD2 3.42Å; E433-F437 PolarHBondContact O-N 3.25Å
434	V	94.4	Very high	91.5	Very high	1 Å²	1	38 Å²	38	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-57.3	-46.3	171	169.8	0	0	0	0	110.7	I238 F264 L281 L284 S430 I431 R432 E436 F437 Q438	I238-V434 HydrophobicContact CD1-CG2 3.6Å; I238-V434 HydrophobicContact CG1-CG2 4.38Å; F264-V434 HydrophobicContact CE2-CG2 4.37Å; L281-V434 HydrophobicContact CD2-CG2 3.86Å; L284-V434 HydrophobicContact CD2-CG2 4.2Å; S430-V434 WeakPolarHBondContact O-CG2 3.21Å; S430-V434 PolarHBondContact O-N 3.32Å; I431-V434 PolarHBondContact O-N 2.92Å; R432-V434 VanDerWaalsContact C-N 3.33Å; R432-V434 PolarHBondContact O-N 3.25Å; V434-E436 PolarHBondContact O-N 3.01Å; V434-F437 PolarHBondContact O-N 3.25Å; V434-Q438 VanDerWaalsContact O-CG 3.27Å; V434-Q438 WeakPolarHBondContact O-CG 3.36Å; V434-Q438 PolarHBondContact O-N 3.24Å
435	A	91.9	Very high	91.2	Very high	16 Å²	16	40 Å²	40	13%	0.132	21%	0.214	C	C	.	.	H	α-helix	trans	-64.6	-37.5	177.3	0	0	0	0	0	112.5	I431 R432 E433 Q438 K439	I431-A435 PolarHBondContact O-N 3.41Å; R432-A435 WeakPolarHBondContact O-CB 3.44Å; R432-A435 PolarHBondContact O-N 3.19Å; E433-A435 VanDerWaalsContact C-N 3.31Å; E433-A435 PolarHBondContact O-N 3.22Å; A435-Q438 PolarHBondContact O-N 3Å; A435-K439 WeakPolarHBondContact O-CG 2.77Å; A435-K439 PolarHBondContact O-N 3.29Å
436	E	94.4	Very high	90.9	Very high	38 Å²	38	41.9 Å²	41.9	18%	0.178	22%	0.224	C	C	.	.	H	α-helix	trans	-68	-41.7	175.5	-65.3	-53.5	147.7	0	0	112.3	R432 E433 V434 Q438 K439 L440	R432-E436 IonicContact CZ-OE1 3.91Å; R432-E436 IonicContact NE-OE1 3.82Å; R432-E436 PolarHBondContact NE-OE1 3.36Å; R432-E436 VanDerWaalsContact NE-OE1 3.12Å; R432-E436 IonicContact NH2-OE1 2.71Å; R432-E436 PolarHBondContact NH2-OE1 3.45Å; R432-E436 PolarHBondContact O-N 3.45Å; R432-E436 VanDerWaalsContact O-N 3.11Å; E433-E436 PolarHBondContact O-N 3.23Å; V434-E436 PolarHBondContact O-N 3.01Å; E436-Q438 VanDerWaalsContact C-N 3.32Å; E436-Q438 PolarHBondContact O-N 2.89Å; E436-K439 PolarHBondContact O-N 3.18Å; E436-K439 IonicContact OE1-NZ 3.68Å; E436-K439 PolarHBondContact OE1-NZ 2.53Å; E436-K439 IonicContact OE2-NZ 2.98Å; E436-K439 PolarHBondContact OE2-NZ 3.13Å; E436-L440 WeakPolarHBondContact O-CG 3.27Å; E436-L440 PolarHBondContact O-N 3.37Å; E436-L440 VanDerWaalsContact O-N 3.09Å
437	F	94	Very high	90.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.1	-41.7	173.4	-81.6	-61.3	0	0	0	112	A241 A242 R259 V261 F264 E433 V434 K439 L440 L441	A241-F437 HydrophobicContact CB-CE2 4.14Å; A241-F437 HydrophobicContact CB-CZ 3.8Å; A242-F437 HydrophobicContact CB-CE2 3.99Å; A242-F437 HydrophobicContact CB-CZ 4.22Å; R259-F437 HydrophobicContact CB-CE1 3.92Å; R259-F437 HydrophobicContact CB-CZ 4.21Å; R259-F437 HydrophobicContact CG-CZ 4.49Å; V261-F437 HydrophobicContact CG2-CD1 4.29Å; V261-F437 HydrophobicContact CG2-CE1 4.35Å; F264-F437 HydrophobicContact CB-CD1 3.82Å; F264-F437 HydrophobicContact CB-CD2 4.32Å; F264-F437 HydrophobicContact CB-CE1 3.86Å; F264-F437 HydrophobicContact CB-CE2 4.35Å; F264-F437 HydrophobicContact CB-CG 4.07Å; F264-F437 HydrophobicContact CB-CZ 4.12Å; F264-F437 HydrophobicContact CD1-CB 3.82Å; F264-F437 HydrophobicContact CD1-CD1 4.31Å; F264-F437 HydrophobicContact CD1-CD2 4.47Å; F264-F437 AromaticContact CD1-CG 3.97Å; F264-F437 HydrophobicContact CD1-CG 3.97Å; F264-F437 HydrophobicContact CD2-CB 4.07Å; F264-F437 HydrophobicContact CD2-CD1 4.22Å; F264-F437 AromaticContact CD2-CD2 3.25Å; F264-F437 HydrophobicContact CD2-CD2 3.25Å; F264-F437 AromaticContact CD2-CE2 3.64Å; F264-F437 HydrophobicContact CD2-CE2 3.64Å; F264-F437 AromaticContact CD2-CG 3.59Å; F264-F437 HydrophobicContact CD2-CG 3.59Å; F264-F437 HydrophobicContact CD2-CZ 4.27Å; F264-F437 HydrophobicContact CE1-CB 3.78Å; F264-F437 HydrophobicContact CE1-CG 4.31Å; F264-F437 HydrophobicContact CE2-CB 4.03Å; F264-F437 AromaticContact CE2-CD2 3.56Å; F264-F437 HydrophobicContact CE2-CD2 3.56Å; F264-F437 HydrophobicContact CE2-CE2 4.29Å; F264-F437 AromaticContact CE2-CG 3.96Å; F264-F437 HydrophobicContact CE2-CG 3.96Å; F264-F437 HydrophobicContact CG-CB 3.97Å; F264-F437 AromaticContact CG-CD1 3.86Å; F264-F437 HydrophobicContact CG-CD1 3.86Å; F264-F437 AromaticContact CG-CD2 3.77Å; F264-F437 HydrophobicContact CG-CD2 3.77Å; F264-F437 HydrophobicContact CG-CE1 4.29Å; F264-F437 HydrophobicContact CG-CE2 4.2Å; F264-F437 AromaticContact CG-CG 3.59Å; F264-F437 HydrophobicContact CG-CG 3.59Å; F264-F437 HydrophobicContact CG-CZ 4.44Å; F264-F437 HydrophobicContact CZ-CB 3.88Å; F264-F437 HydrophobicContact CZ-CD2 4.29Å; F264-F437 HydrophobicContact CZ-CG 4.31Å; E433-F437 HydrophobicContact CB-CD2 4.49Å; E433-F437 HydrophobicContact CB-CE2 4.47Å; E433-F437 WeakPolarHBondContact O-CD2 3.42Å; E433-F437 PolarHBondContact O-N 3.25Å; V434-F437 PolarHBondContact O-N 3.25Å; F437-K439 VanDerWaalsContact C-N 3.33Å; F437-K439 PolarHBondContact O-N 2.91Å; F437-L440 PolarHBondContact O-N 3.14Å; F437-L441 WeakPolarHBondContact O-CB 3.32Å; F437-L441 WeakPolarHBondContact O-CG 3.48Å; F437-L441 PolarHBondContact O-N 2.96Å
438	Q	87.9	Confident	90	Very high	26 Å²	26	44.9 Å²	44.9	12%	0.121	24%	0.243	C	C	.	.	H	α-helix	trans	-59.4	-42.3	176.6	-74.7	167.6	-2.5	0	0	112.3	P27 V434 A435 E436 L441 Q442	P27-Q438 VanDerWaalsContact CG-CD 3.5Å; V434-Q438 VanDerWaalsContact O-CG 3.27Å; V434-Q438 WeakPolarHBondContact O-CG 3.36Å; V434-Q438 PolarHBondContact O-N 3.24Å; A435-Q438 PolarHBondContact O-N 3Å; E436-Q438 VanDerWaalsContact C-N 3.32Å; E436-Q438 PolarHBondContact O-N 2.89Å; Q438-L441 PolarHBondContact O-N 3.41Å; Q438-Q442 WeakPolarHBondContact O-CG 3.26Å; Q438-Q442 PolarHBondContact O-N 3.45Å; Q438-Q442 VanDerWaalsContact O-N 3.07Å
439	K	90.1	Very high	89.5	Confident	101 Å²	101	47.8 Å²	47.8	44%	0.439	26%	0.259	S	S	.	.	H	α-helix	trans	-61.3	-46.2	174.8	-67	170.1	-167.6	168.8	0	111.7	A435 E436 F437 L441 Q442 S443	A435-K439 WeakPolarHBondContact O-CG 2.77Å; A435-K439 PolarHBondContact O-N 3.29Å; E436-K439 PolarHBondContact O-N 3.18Å; E436-K439 IonicContact OE1-NZ 3.68Å; E436-K439 PolarHBondContact OE1-NZ 2.53Å; E436-K439 IonicContact OE2-NZ 2.98Å; E436-K439 PolarHBondContact OE2-NZ 3.13Å; F437-K439 VanDerWaalsContact C-N 3.33Å; F437-K439 PolarHBondContact O-N 2.91Å; K439-L441 VanDerWaalsContact C-N 3.27Å; K439-L441 PolarHBondContact O-N 2.95Å; K439-Q442 PolarHBondContact O-N 2.85Å; K439-S443 PolarHBondContact O-N 3.49Å; K439-S443 VanDerWaalsContact O-N 3.1Å; K439-S443 PolarHBondContact O-OG 3.25Å
440	L	90.9	Very high	89	Confident	64 Å²	64	49.1 Å²	49.1	34%	0.335	26%	0.263	S	S	.	.	H	α-helix	trans	-61.6	-38.2	178.9	-69.5	173.4	0	0	0	111.7	R259 V261 E436 F437 Q442 S443 S444	R259-L440 HydrophobicContact CB-CD1 4.14Å; V261-L440 HydrophobicContact CG2-CB 4.06Å; V261-L440 HydrophobicContact CG2-CD1 3.88Å; E436-L440 WeakPolarHBondContact O-CG 3.27Å; E436-L440 PolarHBondContact O-N 3.37Å; E436-L440 VanDerWaalsContact O-N 3.09Å; F437-L440 PolarHBondContact O-N 3.14Å; L440-Q442 VanDerWaalsContact C-N 3.35Å; L440-S443 WeakPolarHBondContact CA-OG 3.2Å; L440-S443 PolarHBondContact O-N 3.49Å; L440-S443 PolarHBondContact O-OG 3.38Å; L440-S444 PolarHBondContact O-N 3.22Å; L440-S444 PolarHBondContact O-OG 3.01Å
441	L	86.3	Confident	88.3	Confident	16 Å²	16	52.6 Å²	52.6	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-69	-29	177.5	-72.6	176.7	0	0	0	114.3	V261 F264 K265 F437 Q438 K439 S444	V261-L441 HydrophobicContact CG1-CD2 3.36Å; V261-L441 HydrophobicContact CG1-CG 4.03Å; F264-L441 HydrophobicContact CD1-CD1 4.15Å; F264-L441 HydrophobicContact CE1-CD1 4.16Å; K265-L441 HydrophobicContact CD-CD2 3.56Å; K265-L441 HydrophobicContact CG-CD1 4.49Å; K265-L441 HydrophobicContact CG-CD2 3.63Å; F437-L441 WeakPolarHBondContact O-CB 3.32Å; F437-L441 WeakPolarHBondContact O-CG 3.48Å; F437-L441 PolarHBondContact O-N 2.96Å; Q438-L441 PolarHBondContact O-N 3.41Å; K439-L441 VanDerWaalsContact C-N 3.27Å; K439-L441 PolarHBondContact O-N 2.95Å; L441-S444 PolarHBondContact O-OG 3.07Å
442	Q	78.3	Confident	87.8	Confident	153 Å²	153	56.6 Å²	56.6	72%	0.715	30%	0.303	S	S	*	.	H	α-helix	trans	-79.3	-27.3	174.5	-70.1	170.6	7.4	0	0	112.2	Q438 K439 L440	Q438-Q442 WeakPolarHBondContact O-CG 3.26Å; Q438-Q442 PolarHBondContact O-N 3.45Å; Q438-Q442 VanDerWaalsContact O-N 3.07Å; K439-Q442 PolarHBondContact O-N 2.85Å; L440-Q442 VanDerWaalsContact C-N 3.35Å
443	S	76.4	Confident	87	Confident	97 Å²	97	55 Å²	55	68%	0.678	30%	0.304	S	S	*	.	H	α-helix	trans	-81.8	-14.3	177.1	66.4	0	0	0	0	114.3	K439 L440	K439-S443 PolarHBondContact O-N 3.49Å; K439-S443 VanDerWaalsContact O-N 3.1Å; K439-S443 PolarHBondContact O-OG 3.25Å; L440-S443 WeakPolarHBondContact CA-OG 3.2Å; L440-S443 PolarHBondContact O-N 3.49Å; L440-S443 PolarHBondContact O-OG 3.38Å
444	S	62.8	Low	86.1	Confident	118 Å²	118	57.3 Å²	57.3	83%	0.825	32%	0.319	S	S	*	.			trans	-97.4	0	178.6	64.5	0	0	0	0	111.4	L440 L441	L440-S444 PolarHBondContact O-N 3.22Å; L440-S444 PolarHBondContact O-OG 3.01Å; L441-S444 PolarHBondContact O-OG 3.07Å

Retrieved 444 of 444 residues in 270.5 ms (Link to these results)

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