H9Z884_MACMU Loading...

ERO1-like protein alpha

AlphaFold DB , UniProt , Accession H9Z884, Species MACMU (Macaca mulatta, Rhesus macaque), Gene ERO1A, Length 468 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	35.9	Very low	34.2	Very low	236 Å²	236	161.3 Å²	161.3	100%	1.163	85%	0.853	S	S	*	*				0	112.8	0	-80.2	156.6	108.2	0	0	107.5
2	D	34.6	Very low	34.3	Very low	138 Å²	138	162.9 Å²	162.9	74%	0.738	86%	0.861	S	S	*	*			trans	55.4	101.7	152.3	-59.3	-40.6	0	0	0	122.9
3	R	36.5	Very low	34.2	Very low	246 Å²	246	155.4 Å²	155.4	93%	0.928	85%	0.846	S	S	*	*				53.5	124.7	116.9	-72.8	-179.5	167.6	-173	-2.4	120.4
4	G	33.6	Very low	34.5	Very low	73 Å²	73	151.6 Å²	151.6	75%	0.753	85%	0.847	S	S	*	*				136.1	108.1	129.4	0	0	0	0	0	116.7
5	W	34.4	Very low	34.5	Very low	269 Å²	269	149.5 Å²	149.5	100%	1.019	84%	0.838	S	S	*	*			trans	-50.5	157.1	164.8	-57.8	1.6	0	0	0	111.7
6	G	32.8	Very low	34.4	Very low	64 Å²	64	154.9 Å²	154.9	66%	0.66	84%	0.842	S	S	*	*			cis	135.3	124	26.5	0	0	0	0	0	107.9
7	F	32.5	Very low	34.3	Very low	192 Å²	192	154.9 Å²	154.9	84%	0.842	84%	0.84	S	S	*	*			trans	62.2	119.6	158.5	-83.2	-84.7	0	0	0	121.8
8	L	32.2	Very low	34.2	Very low	153 Å²	153	155.1 Å²	155.1	80%	0.801	84%	0.839	S	S	*	*				172.9	119.5	101.2	-99.3	147.1	0	0	0	114.2
9	I	37.3	Very low	34	Very low	151 Å²	151	153 Å²	153	77%	0.774	84%	0.838	S	S	*	*			trans	9.1	131.1	140.6	-60	156.6	0	0	0	118.8
10	G	30.3	Very low	33.9	Very low	76 Å²	76	150.3 Å²	150.3	78%	0.784	83%	0.83	S	S	*	*			trans	-174.1	74.2	162.3	0	0	0	0	0	113
11	L	36.1	Very low	33.6	Very low	176 Å²	176	146.5 Å²	146.5	92%	0.921	83%	0.826	S	S	*	*			trans	-85.4	114.3	174.1	-101.8	151	0	0	0	110	G13	L11-G13 PolarHBondContact O-N 3.37Å
12	L	35	Very low	33.3	Very low	181 Å²	181	143.6 Å²	143.6	95%	0.948	81%	0.809	S	S	*	*			trans	-74	100.1	166.7	-83.5	154.5	0	0	0	109.2
13	G	33.3	Very low	33.1	Very low	65 Å²	65	140.2 Å²	140.2	67%	0.67	81%	0.807	S	S	*	*			trans	-105.4	115.2	168.6	0	0	0	0	0	110.3	L11 V15	L11-G13 PolarHBondContact O-N 3.37Å; G13-V15 PolarHBondContact O-N 3.37Å
14	A	38.4	Very low	32.7	Very low	103 Å²	103	137.4 Å²	137.4	85%	0.851	80%	0.804	S	S	*	*			trans	-70.5	112.6	169.9	0	0	0	0	0	109.5
15	V	35.2	Very low	32.6	Very low	119 Å²	119	143 Å²	143	72%	0.721	81%	0.811	S	S	*	*			trans	-100.2	111.3	168.7	178.3	0	0	0	0	107.7	G13 L17	G13-V15 PolarHBondContact O-N 3.37Å; V15-L17 HydrophobicContact CG1-CG 4.37Å; V15-L17 PolarHBondContact O-N 2.75Å
16	W	32.8	Very low	32.6	Very low	237 Å²	237	138.2 Å²	138.2	90%	0.898	80%	0.8	S	S	*	*			trans	-67.4	107.1	162.9	-91.8	61.6	0	0	0	108.5
17	L	32.1	Very low	32.9	Very low	154 Å²	154	140.4 Å²	140.4	81%	0.806	80%	0.802	S	S	*	*			trans	-89.2	110.9	165.4	-86.3	158.2	0	0	0	108.5	V15 S19	V15-L17 HydrophobicContact CG1-CG 4.37Å; V15-L17 PolarHBondContact O-N 2.75Å; L17-S19 PolarHBondContact O-N 2.96Å
18	L	32.6	Very low	33.6	Very low	158 Å²	158	137 Å²	137	83%	0.827	80%	0.8	S	S	*	*			trans	-62.3	97.5	161.4	-76.3	159	0	0	0	108.2	S20	L18-S20 PolarHBondContact O-N 3.31Å
19	S	30.6	Very low	34.5	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	79%	0.786	S	S	*	*			trans	-80.5	94.8	161.9	-167.1	0	0	0	0	107.4	L17 G21	L17-S19 PolarHBondContact O-N 2.96Å; S19-G21 VanDerWaalsContact C-N 3.29Å; S19-G21 PolarHBondContact O-N 2.94Å
20	S	31.8	Very low	35.6	Very low	99 Å²	99	129.5 Å²	129.5	69%	0.692	76%	0.76	S	S	*	*			trans	-63.7	94.6	162.9	-63.2	0	0	0	0	107.7	L18 H22	L18-S20 PolarHBondContact O-N 3.31Å; S20-H22 VanDerWaalsContact C-N 3.29Å; S20-H22 PolarHBondContact O-N 3.34Å
21	G	28.4	Very low	36.7	Very low	71 Å²	71	126.4 Å²	126.4	73%	0.732	73%	0.727	S	S	*	*			trans	-60.5	94.2	166.7	0	0	0	0	0	109.1	S19 G23	S19-G21 VanDerWaalsContact C-N 3.29Å; S19-G21 PolarHBondContact O-N 2.94Å; G21-G23 PolarHBondContact O-N 3.39Å
22	H	29.5	Very low	37.1	Very low	174 Å²	174	118.4 Å²	118.4	81%	0.806	69%	0.686	S	S	*	*			trans	-65.2	95.7	155	-84.8	40.2	0	0	0	105.8	S20 E24	S20-H22 VanDerWaalsContact C-N 3.29Å; S20-H22 PolarHBondContact O-N 3.34Å; H22-E24 VanDerWaalsContact C-N 3.33Å; H22-E24 PolarHBondContact O-N 3.44Å
23	G	28.9	Very low	37.7	Very low	68 Å²	68	114 Å²	114	70%	0.701	66%	0.66	S	S	*	*			trans	-59.8	107	153.7	0	0	0	0	0	105.9	G21 Q25	G21-G23 PolarHBondContact O-N 3.39Å; G23-Q25 VanDerWaalsContact C-N 3.29Å; G23-Q25 PolarHBondContact O-N 3.18Å
24	E	29.7	Very low	38.1	Very low	187 Å²	187	113.9 Å²	113.9	87%	0.874	64%	0.64	S	S	*	*			trans	-55.8	100.9	163.3	-80	179.1	143.6	0	0	106.6	H22 Q26	H22-E24 VanDerWaalsContact C-N 3.33Å; H22-E24 PolarHBondContact O-N 3.44Å; E24-Q26 VanDerWaalsContact C-N 3.32Å; E24-Q26 PolarHBondContact O-N 3.07Å
25	Q	31.9	Very low	38.1	Very low	190 Å²	190	109 Å²	109	89%	0.888	60%	0.599	S	S	*	*			trans	-61.9	104.7	158.8	-80.7	176.7	-30.4	0	0	105.4	G23	G23-Q25 VanDerWaalsContact C-N 3.29Å; G23-Q25 PolarHBondContact O-N 3.18Å
26	Q	34.2	Very low	38.8	Very low	169 Å²	169	103.7 Å²	103.7	79%	0.79	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-49.1	132	165.6	-82.6	175.8	-43.9	0	0	107.5	E24	E24-Q26 VanDerWaalsContact C-N 3.32Å; E24-Q26 PolarHBondContact O-N 3.07Å
27	P	38.7	Very low	39.3	Very low	109 Å²	109	96 Å²	96	71%	0.708	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-54.2	143.2	174.7	22.2	-30.9	0	0	0	108.8	E29	P27-E29 PolarHBondContact O-N 2.87Å; P27-E29 VanDerWaalsContact O-N 3.13Å
28	P	47.6	Very low	40.1	Very low	122 Å²	122	93.1 Å²	93.1	79%	0.792	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-53.7	124.5	-179.7	20.9	-31.3	0	0	0	109.5	T30	P28-T30 PolarHBondContact O-N 3.11Å
29	E	50.8	Low	40.8	Very low	108 Å²	108	85.7 Å²	85.7	51%	0.505	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-55.5	125.8	-177.6	-70.9	-174.6	162.4	0	0	110.5	P27 Q33 R34	P27-E29 PolarHBondContact O-N 2.87Å; P27-E29 VanDerWaalsContact O-N 3.13Å; E29-Q33 HydrophobicContact CB-CB 4.48Å; E29-R34 HydrophobicContact CB-CG 3.74Å; E29-R34 PolarHBondContact O-NE 3.33Å; E29-R34 VanDerWaalsContact O-NE 3.14Å
30	T	60.7	Low	41.4	Very low	38 Å²	38	83.4 Å²	83.4	23%	0.233	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-63.2	152.7	178.4	66	0	0	0	0	109.6	P28 A32 Q33 R34 H468	P28-T30 PolarHBondContact O-N 3.11Å; T30-A32 PolarHBondContact O-N 3.39Å; T30-Q33 WeakPolarHBondContact O-CA 3.12Å; T30-Q33 WeakPolarHBondContact O-CB 2.66Å; T30-Q33 PolarHBondContact O-N 3.23Å; T30-Q33 VanDerWaalsContact OG1-CG 3.26Å; T30-Q33 WeakPolarHBondContact OG1-CG 3.46Å; T30-Q33 PolarHBondContact OG1-N 2.89Å; T30-Q33 PolarHBondContact OG1-OE1 3.23Å; T30-Q33 VanDerWaalsContact OG1-OE1 3.12Å; T30-R34 WeakPolarHBondContact O-CG 3.32Å; T30-R34 PolarHBondContact O-N 3.03Å; T30-H468 WeakPolarHBondContact CB-NE2 3.43Å; T30-H468 VanDerWaalsContact CG2-NE2 3.31Å; T30-H468 WeakPolarHBondContact CG2-NE2 3.33Å
31	A	52.5	Low	42.1	Very low	10 Å²	10	80 Å²	80	8%	0.083	46%	0.457	C	S	.	.	H	α-helix	trans	-56.9	-33.2	176.4	0	0	0	0	0	113	R34 C35 L464	A31-R34 PolarHBondContact O-N 3.34Å; A31-C35 WeakPolarHBondContact O-CB 3.15Å; A31-C35 PolarHBondContact O-N 3.48Å; A31-C35 PolarHBondContact O-SG 3.27Å; A31-L464 HydrophobicContact CB-CD2 3.81Å
32	A	45	Very low	43	Very low	8 Å²	8	84.9 Å²	84.9	7%	0.066	45%	0.454	C	S	.	.	H	α-helix	trans	-62.8	-42.6	173.1	0	0	0	0	0	111.6	T30 F36 L464 Q465	T30-A32 PolarHBondContact O-N 3.39Å; A32-F36 WeakPolarHBondContact O-CB 3.42Å; A32-F36 WeakPolarHBondContact O-CD2 3.04Å; A32-F36 PolarHBondContact O-N 3.5Å; A32-L464 HydrophobicContact CB-CB 4.02Å; A32-Q465 HydrophobicContact CB-CG 3.98Å
33	Q	47.2	Very low	44.1	Very low	89 Å²	89	76.9 Å²	76.9	42%	0.416	42%	0.417	S	S	.	.	H	α-helix	trans	-64.8	-44.1	176	-73.3	165.3	-32.7	0	0	111.4	E29 T30 C35 F36 C37	E29-Q33 HydrophobicContact CB-CB 4.48Å; T30-Q33 WeakPolarHBondContact O-CA 3.12Å; T30-Q33 WeakPolarHBondContact O-CB 2.66Å; T30-Q33 PolarHBondContact O-N 3.23Å; T30-Q33 VanDerWaalsContact OG1-CG 3.26Å; T30-Q33 WeakPolarHBondContact OG1-CG 3.46Å; T30-Q33 PolarHBondContact OG1-N 2.89Å; T30-Q33 PolarHBondContact OG1-OE1 3.23Å; T30-Q33 VanDerWaalsContact OG1-OE1 3.12Å; Q33-C35 VanDerWaalsContact C-N 3.34Å; Q33-C35 PolarHBondContact O-N 3.46Å; Q33-F36 PolarHBondContact O-N 2.76Å; Q33-C37 WeakPolarHBondContact CA-SG 3.41Å; Q33-C37 WeakPolarHBondContact O-CB 3.32Å; Q33-C37 PolarHBondContact O-N 3.18Å; Q33-C37 PolarHBondContact O-SG 3.14Å
34	R	40.9	Very low	45	Very low	62 Å²	62	79.8 Å²	79.8	23%	0.234	42%	0.417	C	S	.	.	H	α-helix	trans	-66	-31.7	-179.8	-65.3	-175.9	-74	135.3	-15.1	114	E29 T30 A31 D289 G290 I291	E29-R34 HydrophobicContact CB-CG 3.74Å; E29-R34 PolarHBondContact O-NE 3.33Å; E29-R34 VanDerWaalsContact O-NE 3.14Å; T30-R34 WeakPolarHBondContact O-CG 3.32Å; T30-R34 PolarHBondContact O-N 3.03Å; A31-R34 PolarHBondContact O-N 3.34Å; R34-D289 VanDerWaalsContact CB-OD2 3.27Å; R34-D289 WeakPolarHBondContact CB-OD2 3.35Å; R34-D289 IonicContact CZ-OD2 3.13Å; R34-D289 IonicContact NE-OD2 2.88Å; R34-D289 IonicContact NH1-OD1 3.94Å; R34-D289 PolarHBondContact NH1-OD1 2.98Å; R34-D289 VanDerWaalsContact NH1-OD1 3.13Å; R34-D289 IonicContact NH1-OD2 3.43Å; R34-D289 PolarHBondContact NH1-OD2 2.65Å; R34-G290 WeakPolarHBondContact O-CA 3.43Å; R34-G290 PolarHBondContact O-N 3.21Å; R34-I291 HydrophobicContact CB-CG1 4.37Å; R34-I291 VanDerWaalsContact CD-CG1 3.49Å; R34-I291 HydrophobicContact CG-CD1 3.85Å; R34-I291 HydrophobicContact CG-CG1 3.93Å
35	C	38.8	Very low	46.1	Very low	0 Å²	0	74 Å²	74	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-81.5	-35	176.6	-65.8	0	0	0	0	113.1	A31 Q33 F284 L464	A31-C35 WeakPolarHBondContact O-CB 3.15Å; A31-C35 PolarHBondContact O-N 3.48Å; A31-C35 PolarHBondContact O-SG 3.27Å; Q33-C35 VanDerWaalsContact C-N 3.34Å; Q33-C35 PolarHBondContact O-N 3.46Å; C35-F284 HydrophobicContact CB-CE1 4.48Å; C35-L464 HydrophobicContact CB-CD1 4.33Å
36	F	50.3	Low	47.3	Very low	9 Å²	9	65.1 Å²	65.1	4%	0.039	35%	0.351	C	S	.	.	H	α-helix	trans	-122.5	-18.6	-163.9	-62.6	-73.8	0	0	0	116	A32 Q33 Q38 V39 S40 F284 L301 L457 F460 R461 L464	A32-F36 WeakPolarHBondContact O-CB 3.42Å; A32-F36 WeakPolarHBondContact O-CD2 3.04Å; A32-F36 PolarHBondContact O-N 3.5Å; Q33-F36 PolarHBondContact O-N 2.76Å; F36-Q38 VanDerWaalsContact C-N 3.25Å; F36-Q38 PolarHBondContact O-N 2.67Å; F36-V39 CarbonylContact O-C 3.33Å; F36-V39 WeakPolarHBondContact O-CA 2.93Å; F36-V39 PolarHBondContact O-N 2.88Å; F36-S40 PolarHBondContact O-N 2.92Å; F36-F284 HydrophobicContact CE1-CZ 4.44Å; F36-F284 HydrophobicContact CE2-CE1 4.31Å; F36-F284 AromaticContact CZ-CE1 3.92Å; F36-F284 HydrophobicContact CZ-CE1 3.92Å; F36-F284 AromaticContact CZ-CZ 3.85Å; F36-F284 HydrophobicContact CZ-CZ 3.85Å; F36-L301 HydrophobicContact CE1-CD1 4.4Å; F36-L457 HydrophobicContact CE1-CB 4.06Å; F36-L457 HydrophobicContact CE1-CD2 4.31Å; F36-L457 WeakPolarHBondContact CZ-O 3.23Å; F36-F460 HydrophobicContact CZ-CB 4.34Å; F36-R461 HydrophobicContact CD2-CB 4.03Å; F36-R461 HydrophobicContact CD2-CG 3.88Å; F36-R461 HydrophobicContact CE2-CB 3.72Å; F36-R461 HydrophobicContact CE2-CG 4.1Å; F36-R461 HydrophobicContact CG-CG 4.38Å; F36-R461 HydrophobicContact CZ-CB 4.1Å; F36-L464 HydrophobicContact CE2-CD1 4Å
37	C	42.9	Very low	48.4	Very low	76 Å²	76	61.7 Å²	61.7	51%	0.514	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-68	-24.9	178.5	-72	0	0	0	0	113.1	Q33 V39 S40	Q33-C37 WeakPolarHBondContact CA-SG 3.41Å; Q33-C37 WeakPolarHBondContact O-CB 3.32Å; Q33-C37 PolarHBondContact O-N 3.18Å; Q33-C37 PolarHBondContact O-SG 3.14Å; C37-V39 VanDerWaalsContact C-N 3.28Å; C37-S40 PolarHBondContact O-OG 3.19Å
38	Q	49.8	Very low	49.5	Very low	92 Å²	92	56.9 Å²	56.9	43%	0.43	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-85.1	-4.8	172.8	-168.5	173.6	12	0	0	112.6	F36 P298 K302	F36-Q38 VanDerWaalsContact C-N 3.25Å; F36-Q38 PolarHBondContact O-N 2.67Å; Q38-P298 HydrophobicContact CB-CB 3.66Å; Q38-P298 HydrophobicContact CB-CG 3.95Å; Q38-P298 HydrophobicContact CG-CB 3.77Å; Q38-P298 HydrophobicContact CG-CG 4.35Å; Q38-K302 VanDerWaalsContact O-CE 3.23Å; Q38-K302 WeakPolarHBondContact O-CE 3.25Å
39	V	47.3	Very low	50.9	Low	2 Å²	2	53 Å²	53	1%	0.012	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-110	9.7	177.6	-162.2	0	0	0	0	111	F36 C37 V50 P298 L301 K302 Y305	F36-V39 CarbonylContact O-C 3.33Å; F36-V39 WeakPolarHBondContact O-CA 2.93Å; F36-V39 PolarHBondContact O-N 2.88Å; C37-V39 VanDerWaalsContact C-N 3.28Å; V39-V50 WeakPolarHBondContact O-CB 3.41Å; V39-V50 WeakPolarHBondContact O-CG2 3.38Å; V39-P298 HydrophobicContact CG2-CB 3.69Å; V39-P298 HydrophobicContact CG2-CG 4.49Å; V39-L301 HydrophobicContact CG1-CB 4.05Å; V39-L301 HydrophobicContact CG2-CB 4.02Å; V39-L301 HydrophobicContact CG2-CD1 4.07Å; V39-K302 HydrophobicContact CG1-CG 4.45Å; V39-Y305 HydrophobicContact CG1-CD2 4.06Å; V39-Y305 HydrophobicContact CG1-CE2 3.78Å
40	S	42.4	Very low	52.4	Low	69 Å²	69	48 Å²	48	48%	0.483	26%	0.26	S	S	.	.			trans	-95.6	149	173.2	55.6	0	0	0	0	112	F36 C37	F36-S40 PolarHBondContact O-N 2.92Å; C37-S40 PolarHBondContact O-OG 3.19Å
41	G	47.8	Very low	53.6	Low	28 Å²	28	51.4 Å²	51.4	29%	0.289	27%	0.273	S	S	.	.	S	Bend	trans	97.2	-165.4	179.1	0	0	0	0	0	114	D49	G41-D49 WeakPolarHBondContact CA-OD1 3.34Å; G41-D49 PolarHBondContact N-OD1 3.09Å
42	Y	45.7	Very low	55.3	Low	172 Å²	172	53 Å²	53	68%	0.675	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	140.9	-179.9	-66.6	-77	0	0	0	111.8
43	L	53.7	Low	57.5	Low	7 Å²	7	52.6 Å²	52.6	4%	0.037	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131.7	168.4	-64.1	164.6	0	0	0	108.6	D45 C46 V50 I53 K302 L309	L43-D45 PolarHBondContact O-N 2.7Å; L43-C46 CarbonylContact C-O 3.58Å; L43-C46 HydrophobicContact CB-CB 3.97Å; L43-C46 WeakPolarHBondContact CB-O 3.36Å; L43-C46 HydrophobicContact CD1-CB 4.18Å; L43-C46 PolarHBondContact N-O 3.43Å; L43-C46 CarbonylContact O-C 3.59Å; L43-C46 PolarHBondContact O-N 2.8Å; L43-V50 HydrophobicContact CD2-CG2 4.41Å; L43-I53 HydrophobicContact CD1-CD1 4.22Å; L43-K302 HydrophobicContact CD2-CB 4.09Å; L43-K302 HydrophobicContact CD2-CG 4.05Å; L43-L309 HydrophobicContact CD1-CD1 3.67Å
44	D	47.5	Very low	59.7	Low	129 Å²	129	49 Å²	49	69%	0.69	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-20.7	-168.9	-55.4	-65.1	0	0	0	114.4	K302	D44-K302 IonicContact OD2-NZ 3.41Å; D44-K302 PolarHBondContact OD2-NZ 3.37Å
45	D	53	Low	62.2	Low	65 Å²	65	53.3 Å²	53.3	35%	0.348	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	3.6	173.1	-59.6	-41	0	0	0	114	L43 R249 F363	L43-D45 PolarHBondContact O-N 2.7Å; D45-R249 IonicContact OD2-CZ 3.32Å; D45-R249 IonicContact OD2-NH1 2.77Å; D45-R249 PolarHBondContact OD2-NH1 3.07Å; D45-F363 HydrophobicContact CB-CZ 4.46Å
46	C	57	Low	64.8	Low	4 Å²	4	54 Å²	54	3%	0.027	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	120.9	177.2	-57	0	0	0	0	109.6	L43 C48 L309	L43-C46 CarbonylContact C-O 3.58Å; L43-C46 HydrophobicContact CB-CB 3.97Å; L43-C46 WeakPolarHBondContact CB-O 3.36Å; L43-C46 HydrophobicContact CD1-CB 4.18Å; L43-C46 PolarHBondContact N-O 3.43Å; L43-C46 CarbonylContact O-C 3.59Å; L43-C46 PolarHBondContact O-N 2.8Å; C46-C48 PolarHBondContact O-N 2.9Å; C46-L309 HydrophobicContact CB-CD1 3.74Å
47	T	56.2	Low	67	Low	96 Å²	96	53.5 Å²	53.5	59%	0.589	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	56.3	-178.6	45.3	0	0	0	0	112.1	H357	T47-H357 PolarHBondContact OG1-O 3.4Å
48	C	63.4	Low	69.6	Low	9 Å²	9	50.2 Å²	50.2	6%	0.061	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.1	175.5	-162.7	0	0	0	0	110.1	C46 I53 L309	C46-C48 PolarHBondContact O-N 2.9Å; C48-I53 HydrophobicContact CB-CD1 4.36Å; C48-L309 HydrophobicContact CB-CD1 4.34Å
49	D	76	Confident	71.9	Confident	41 Å²	41	52.6 Å²	52.6	22%	0.219	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	137.3	174.2	175.1	45	0	0	0	110.6	G41 E51 T52 I53	G41-D49 WeakPolarHBondContact CA-OD1 3.34Å; G41-D49 PolarHBondContact N-OD1 3.09Å; D49-E51 VanDerWaalsContact C-N 3.25Å; D49-E51 PolarHBondContact O-N 3.12Å; D49-E51 WeakPolarHBondContact OD2-CB 3.25Å; D49-T52 WeakPolarHBondContact O-CB 3.46Å; D49-T52 PolarHBondContact O-N 3.24Å; D49-I53 PolarHBondContact O-N 3.07Å
50	V	82.7	Confident	74.1	Confident	3 Å²	3	59 Å²	59	2%	0.018	29%	0.287	C	S	.	.	H	α-helix	trans	-59.2	-35.4	-175.3	168.2	0	0	0	0	112.2	V39 L43 T52 I53 D54 Y305	V39-V50 WeakPolarHBondContact O-CB 3.41Å; V39-V50 WeakPolarHBondContact O-CG2 3.38Å; L43-V50 HydrophobicContact CD2-CG2 4.41Å; V50-T52 VanDerWaalsContact C-N 3.25Å; V50-T52 PolarHBondContact O-N 2.86Å; V50-I53 PolarHBondContact O-N 3.1Å; V50-I53 VanDerWaalsContact O-N 3.16Å; V50-D54 PolarHBondContact O-N 2.88Å; V50-Y305 HydrophobicContact CG1-CE1 3.89Å; V50-Y305 HydrophobicContact CG1-CE2 3.84Å; V50-Y305 VanDerWaalsContact CG1-CZ 3.47Å; V50-Y305 WeakPolarHBondContact CG1-OH 3.26Å; V50-Y305 HydrophobicContact CG2-CD2 4.3Å; V50-Y305 HydrophobicContact CG2-CE2 4.4Å; V50-Y305 HydrophobicContact CG2-CG 4.45Å
51	E	86.1	Confident	76.7	Confident	109 Å²	109	55.8 Å²	55.8	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-65.5	-30.9	178.1	-56.1	-175.7	173.4	0	0	112.5	D49 R55	D49-E51 VanDerWaalsContact C-N 3.25Å; D49-E51 PolarHBondContact O-N 3.12Å; D49-E51 WeakPolarHBondContact OD2-CB 3.25Å; E51-R55 VanDerWaalsContact O-CB 3.32Å; E51-R55 WeakPolarHBondContact O-CB 3.14Å; E51-R55 PolarHBondContact O-N 3.31Å
52	T	88	Confident	79.1	Confident	43 Å²	43	56.2 Å²	56.2	26%	0.264	26%	0.258	S	S	.	.	H	α-helix	trans	-70	-40.1	175.7	-62.4	0	0	0	0	110.8	D49 V50 F56 F354	D49-T52 WeakPolarHBondContact O-CB 3.46Å; D49-T52 PolarHBondContact O-N 3.24Å; V50-T52 VanDerWaalsContact C-N 3.25Å; V50-T52 PolarHBondContact O-N 2.86Å; T52-F56 VanDerWaalsContact O-CB 3.29Å; T52-F56 WeakPolarHBondContact O-CB 3.27Å; T52-F56 PolarHBondContact O-N 3.13Å; T52-F354 HydrophobicContact CG2-CE2 3.99Å; T52-F354 HydrophobicContact CG2-CZ 4.32Å
53	I	90.7	Very high	81.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-49.7	174.8	-57.6	171.6	0	0	0	110.1	L43 C48 D49 V50 R55 F56 N57 Y305 Y308 L309 F354	L43-I53 HydrophobicContact CD1-CD1 4.22Å; C48-I53 HydrophobicContact CB-CD1 4.36Å; D49-I53 PolarHBondContact O-N 3.07Å; V50-I53 PolarHBondContact O-N 3.1Å; V50-I53 VanDerWaalsContact O-N 3.16Å; I53-R55 PolarHBondContact O-N 3.31Å; I53-F56 PolarHBondContact O-N 2.83Å; I53-N57 VanDerWaalsContact O-CB 3.27Å; I53-N57 WeakPolarHBondContact O-CB 3.33Å; I53-N57 PolarHBondContact O-N 3Å; I53-Y305 HydrophobicContact CB-CD1 4.29Å; I53-Y305 HydrophobicContact CB-CE1 4.31Å; I53-Y305 HydrophobicContact CD1-CD1 3.92Å; I53-Y305 HydrophobicContact CG2-CD1 3.9Å; I53-Y305 HydrophobicContact CG2-CE1 4.02Å; I53-Y308 HydrophobicContact CG2-CD1 3.68Å; I53-Y308 HydrophobicContact CG2-CE1 3.48Å; I53-Y308 VanDerWaalsContact CG2-CE1 3.48Å; I53-L309 HydrophobicContact CD1-CD1 4.07Å; I53-L309 HydrophobicContact CD1-CD2 3.99Å; I53-L309 HydrophobicContact CD1-CG 4.15Å; I53-L309 HydrophobicContact CG1-CD2 4.31Å; I53-F354 HydrophobicContact CG1-CZ 4.16Å
54	D	92.6	Very high	83.7	Confident	14 Å²	14	54.2 Å²	54.2	8%	0.075	26%	0.258	C	S	.	.	H	α-helix	trans	-57.3	-49.1	-179.6	-73	-12.8	0	0	0	110.5	V50 F56 N58 Y305 V454 R461	V50-D54 PolarHBondContact O-N 2.88Å; D54-F56 PolarHBondContact O-N 3.39Å; D54-N58 WeakPolarHBondContact O-CB 3.42Å; D54-N58 PolarHBondContact O-N 3.14Å; D54-N58 PolarHBondContact O-ND2 3.1Å; D54-Y305 WeakPolarHBondContact OD1-CE1 2.93Å; D54-Y305 PolarHBondContact OD1-OH 3.26Å; D54-V454 WeakPolarHBondContact OD1-CG1 3.44Å; D54-R461 IonicContact OD2-NH2 2.89Å; D54-R461 PolarHBondContact OD2-NH2 2.98Å
55	R	93.7	Very high	86.1	Confident	151 Å²	151	48.1 Å²	48.1	57%	0.57	23%	0.226	S	C	*	.	H	α-helix	trans	-63.6	-42.9	179.9	-176.5	170.7	58.3	-117.4	-4.8	112.5	E51 I53	E51-R55 VanDerWaalsContact O-CB 3.32Å; E51-R55 WeakPolarHBondContact O-CB 3.14Å; E51-R55 PolarHBondContact O-N 3.31Å; I53-R55 PolarHBondContact O-N 3.31Å
56	F	94.3	Very high	88.2	Confident	14 Å²	14	49.1 Å²	49.1	6%	0.061	23%	0.228	C	C	.	.	I	π-helix	trans	-65.5	-52.6	178.4	171.9	-103	0	0	0	111.5	T52 I53 D54 R60 L61 L312 F354	T52-F56 VanDerWaalsContact O-CB 3.29Å; T52-F56 WeakPolarHBondContact O-CB 3.27Å; T52-F56 PolarHBondContact O-N 3.13Å; I53-F56 PolarHBondContact O-N 2.83Å; D54-F56 PolarHBondContact O-N 3.39Å; F56-R60 HydrophobicContact CD2-CB 4.46Å; F56-R60 WeakPolarHBondContact O-CB 3.45Å; F56-R60 PolarHBondContact O-N 2.9Å; F56-R60 VanDerWaalsContact O-N 3.07Å; F56-L61 HydrophobicContact CE1-CB 4.45Å; F56-L61 HydrophobicContact CE1-CD2 3.85Å; F56-L61 HydrophobicContact CZ-CD2 4.38Å; F56-L61 PolarHBondContact O-N 3.46Å; F56-L312 HydrophobicContact CE1-CD1 3.98Å; F56-L312 HydrophobicContact CE1-CD2 4.46Å; F56-F354 HydrophobicContact CB-CD2 3.87Å; F56-F354 HydrophobicContact CB-CE2 3.74Å; F56-F354 AromaticContact CD1-CD2 3.59Å; F56-F354 HydrophobicContact CD1-CD2 3.59Å; F56-F354 AromaticContact CD1-CE2 3.92Å; F56-F354 HydrophobicContact CD1-CE2 3.92Å; F56-F354 HydrophobicContact CD1-CG 4.22Å; F56-F354 AromaticContact CD2-CD2 3.72Å; F56-F354 HydrophobicContact CD2-CD2 3.72Å; F56-F354 HydrophobicContact CD2-CE2 4.46Å; F56-F354 HydrophobicContact CE1-CB 4.24Å; F56-F354 HydrophobicContact CE1-CD2 4.01Å; F56-F354 HydrophobicContact CE1-CG 4.23Å; F56-F354 HydrophobicContact CE2-CB 4.15Å; F56-F354 HydrophobicContact CE2-CD2 4.14Å; F56-F354 AromaticContact CG-CD2 3.43Å; F56-F354 HydrophobicContact CG-CD2 3.43Å; F56-F354 VanDerWaalsContact CG-CD2 3.43Å; F56-F354 AromaticContact CG-CE2 3.79Å; F56-F354 HydrophobicContact CG-CE2 3.79Å; F56-F354 HydrophobicContact CG-CG 4.39Å; F56-F354 HydrophobicContact CZ-CB 3.99Å; F56-F354 HydrophobicContact CZ-CD2 4.28Å; F56-F354 HydrophobicContact CZ-CG 4.41Å
57	N	97.1	Very high	90.1	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.256	C	S	.	.	I	π-helix	trans	-63.1	-56.6	-177.9	-179.5	70.9	0	0	0	111.2	I53 Y59 L61 F62 Y308 S451 V454	I53-N57 VanDerWaalsContact O-CB 3.27Å; I53-N57 WeakPolarHBondContact O-CB 3.33Å; I53-N57 PolarHBondContact O-N 3Å; N57-Y59 VanDerWaalsContact C-N 3.29Å; N57-Y59 PolarHBondContact O-N 2.74Å; N57-L61 PolarHBondContact O-N 3.34Å; N57-F62 WeakPolarHBondContact O-CB 3.22Å; N57-F62 PolarHBondContact O-N 3.03Å; N57-Y308 HydrophobicContact CB-CE2 4.31Å; N57-Y308 WeakPolarHBondContact OD1-CE2 3.3Å; N57-Y308 PolarHBondContact OD1-OH 3.05Å; N57-S451 PolarHBondContact ND2-O 3.21Å; N57-S451 VanDerWaalsContact OD1-CB 3.3Å; N57-S451 WeakPolarHBondContact OD1-CB 3.46Å; N57-S451 PolarHBondContact OD1-OG 3.13Å; N57-V454 HydrophobicContact CB-CG1 4.07Å
58	N	97.5	Very high	92.1	Very high	7 Å²	7	51.1 Å²	51.1	4%	0.037	23%	0.228	C	C	.	.	I	π-helix	trans	-71.8	-24.2	-164.6	-62.4	-9.6	0	0	0	113.4	D54 K455 E458	D54-N58 WeakPolarHBondContact O-CB 3.42Å; D54-N58 PolarHBondContact O-N 3.14Å; D54-N58 PolarHBondContact O-ND2 3.1Å; N58-K455 HydrophobicContact CB-CD 3.71Å; N58-K455 VanDerWaalsContact OD1-CA 3.31Å; N58-K455 WeakPolarHBondContact OD1-CA 3.47Å; N58-K455 PolarHBondContact OD1-N 3.33Å; N58-E458 WeakPolarHBondContact CB-OE2 3.4Å; N58-E458 WeakPolarHBondContact ND2-CB 3.42Å; N58-E458 PolarHBondContact ND2-OE2 3.29Å
59	Y	96.3	Very high	93.7	Very high	141 Å²	141	51.1 Å²	51.1	55%	0.553	23%	0.227	S	C	*	.	I	π-helix	trans	-118.7	-33.1	-172.6	-60.4	-80.3	0	0	0	114.4	N57 E458	N57-Y59 VanDerWaalsContact C-N 3.29Å; N57-Y59 PolarHBondContact O-N 2.74Å; Y59-E458 PolarHBondContact OH-OE1 2.88Å
60	R	94.9	Very high	94.6	Very high	137 Å²	137	53.4 Å²	53.4	52%	0.517	24%	0.237	S	C	.	.	I	π-helix	trans	-95.2	-41.9	179.3	-52.6	-166.5	102.2	-152.3	9.6	112.4	F56 E350	F56-R60 HydrophobicContact CD2-CB 4.46Å; F56-R60 WeakPolarHBondContact O-CB 3.45Å; F56-R60 PolarHBondContact O-N 2.9Å; F56-R60 VanDerWaalsContact O-N 3.07Å; R60-E350 IonicContact CZ-OE2 3.82Å; R60-E350 IonicContact NH1-OE2 2.7Å; R60-E350 PolarHBondContact NH1-OE2 3.06Å
61	L	96.8	Very high	94.9	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.01	24%	0.24	C	C	.	.	I	π-helix	trans	-94.9	-51.6	-169.6	-169.1	63.4	0	0	0	113.3	F56 N57 R64 L65 L312 I347 I351 F447	F56-L61 HydrophobicContact CE1-CB 4.45Å; F56-L61 HydrophobicContact CE1-CD2 3.85Å; F56-L61 HydrophobicContact CZ-CD2 4.38Å; F56-L61 PolarHBondContact O-N 3.46Å; N57-L61 PolarHBondContact O-N 3.34Å; L61-R64 PolarHBondContact O-N 3.32Å; L61-L65 WeakPolarHBondContact O-CB 3.46Å; L61-L65 PolarHBondContact O-N 2.75Å; L61-L312 HydrophobicContact CD2-CD1 4.37Å; L61-I347 HydrophobicContact CD1-CG2 3.85Å; L61-I351 HydrophobicContact CD1-CD1 4.2Å; L61-I351 HydrophobicContact CD1-CG1 3.87Å; L61-I351 HydrophobicContact CD2-CG1 4.31Å; L61-F447 HydrophobicContact CD2-CE1 3.62Å; L61-F447 HydrophobicContact CD2-CZ 3.68Å
62	F	97.8	Very high	94.7	Very high	37 Å²	37	50.8 Å²	50.8	16%	0.162	23%	0.227	C	C	.	.	H	α-helix	trans	-50.7	-52.4	-168.9	-177.4	-98.3	0	0	0	115	N57 R64 L65 Q66 T452 K455	N57-F62 WeakPolarHBondContact O-CB 3.22Å; N57-F62 PolarHBondContact O-N 3.03Å; F62-R64 VanDerWaalsContact C-N 3.3Å; F62-R64 PolarHBondContact O-N 3.02Å; F62-L65 PolarHBondContact O-N 3.46Å; F62-Q66 WeakPolarHBondContact O-CB 3.5Å; F62-Q66 PolarHBondContact O-N 2.79Å; F62-T452 HydrophobicContact CE2-CG2 4.49Å; F62-K455 HydrophobicContact CD1-CG 4.3Å; F62-K455 HydrophobicContact CD2-CB 4.09Å; F62-K455 HydrophobicContact CD2-CG 4.48Å; F62-K455 HydrophobicContact CE1-CG 4.19Å; F62-K455 HydrophobicContact CE2-CB 4.11Å; F62-K455 HydrophobicContact CE2-CG 4.38Å; F62-K455 HydrophobicContact CG-CB 4.44Å; F62-K455 HydrophobicContact CG-CG 4.45Å; F62-K455 HydrophobicContact CZ-CB 4.43Å; F62-K455 HydrophobicContact CZ-CG 4.23Å
63	P	97.8	Very high	94.4	Very high	71 Å²	71	49.3 Å²	49.3	46%	0.461	22%	0.217	S	C	.	.	H	α-helix	trans	-64.8	-34	-177	24.5	-34.1	0	0	0	113.1	K67	P63-K67 PolarHBondContact O-N 2.95Å
64	R	97.8	Very high	94.4	Very high	65 Å²	65	49.3 Å²	49.3	25%	0.245	22%	0.217	C	C	.	.	H	α-helix	trans	-76.4	-42.6	179.4	-61.4	172.5	73.2	178.6	13.9	111	L61 F62 Q66 K67 L68 L343 E346 I347 E350	L61-R64 PolarHBondContact O-N 3.32Å; F62-R64 VanDerWaalsContact C-N 3.3Å; F62-R64 PolarHBondContact O-N 3.02Å; R64-Q66 VanDerWaalsContact C-N 3.34Å; R64-K67 WeakPolarHBondContact O-CB 3.4Å; R64-K67 PolarHBondContact O-N 3.31Å; R64-L68 PolarHBondContact O-N 3.28Å; R64-L343 HydrophobicContact CB-CD1 4.35Å; R64-E346 IonicContact CZ-OE2 3.74Å; R64-E346 IonicContact NH2-OE2 2.72Å; R64-E346 PolarHBondContact NH2-OE2 3.28Å; R64-I347 HydrophobicContact CB-CD1 4.2Å; R64-I347 HydrophobicContact CB-CG1 4.04Å; R64-E350 VanDerWaalsContact NH1-CG 3.29Å; R64-E350 IonicContact NH1-OE1 3.45Å; R64-E350 PolarHBondContact NH1-OE1 3.05Å
65	L	98.1	Very high	94.2	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-44.8	174.9	-179.5	61.7	0	0	0	110.9	L61 F62 K67 L68 L69 F447	L61-L65 WeakPolarHBondContact O-CB 3.46Å; L61-L65 PolarHBondContact O-N 2.75Å; F62-L65 PolarHBondContact O-N 3.46Å; L65-K67 VanDerWaalsContact C-N 3.34Å; L65-K67 PolarHBondContact O-N 2.91Å; L65-L68 WeakPolarHBondContact O-CB 3.46Å; L65-L68 PolarHBondContact O-N 3.19Å; L65-L68 VanDerWaalsContact O-N 3.16Å; L65-L69 HydrophobicContact CD1-CD1 4.41Å; L65-L69 HydrophobicContact CD1-CG 4.36Å; L65-L69 HydrophobicContact CG-CD1 4.2Å; L65-L69 VanDerWaalsContact O-CG 3.32Å; L65-L69 WeakPolarHBondContact O-CG 3.47Å; L65-L69 PolarHBondContact O-N 3.45Å; L65-F447 HydrophobicContact CD1-CD1 4.49Å; L65-F447 HydrophobicContact CD2-CD1 3.66Å; L65-F447 HydrophobicContact CD2-CE1 3.74Å
66	Q	97.7	Very high	93.7	Very high	86 Å²	86	44.7 Å²	44.7	40%	0.402	20%	0.198	S	C	.	.	H	α-helix	trans	-58.8	-46	176.2	-175.2	179.8	-13.9	0	0	111.5	F62 R64 L68 L69 E70	F62-Q66 WeakPolarHBondContact O-CB 3.5Å; F62-Q66 PolarHBondContact O-N 2.79Å; R64-Q66 VanDerWaalsContact C-N 3.34Å; Q66-L68 VanDerWaalsContact C-N 3.29Å; Q66-L68 PolarHBondContact O-N 3.05Å; Q66-L69 PolarHBondContact O-N 3.06Å; Q66-L69 VanDerWaalsContact O-N 3.14Å; Q66-E70 WeakPolarHBondContact CG-OE1 3.27Å; Q66-E70 PolarHBondContact NE2-OE1 3.36Å; Q66-E70 WeakPolarHBondContact O-CG 3.43Å; Q66-E70 PolarHBondContact O-N 2.65Å; Q66-E70 VanDerWaalsContact O-N 3.07Å
67	K	97.7	Very high	93.2	Very high	141 Å²	141	44.2 Å²	44.2	61%	0.613	20%	0.196	S	C	*	.	H	α-helix	trans	-57.7	-40.8	175.7	-174.4	179.9	179.5	-174.6	0	112.3	P63 R64 L65 E70 L343	P63-K67 PolarHBondContact O-N 2.95Å; R64-K67 WeakPolarHBondContact O-CB 3.4Å; R64-K67 PolarHBondContact O-N 3.31Å; L65-K67 VanDerWaalsContact C-N 3.34Å; L65-K67 PolarHBondContact O-N 2.91Å; K67-E70 PolarHBondContact O-N 2.98Å; K67-L343 HydrophobicContact CB-CD2 4.33Å; K67-L343 HydrophobicContact CD-CD2 4.18Å; K67-L343 HydrophobicContact CG-CD2 4.08Å
68	L	97.4	Very high	92.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-43.6	176.2	-176.2	69.4	0	0	0	111.7	R64 L65 Q66 E70 S71 F74 L343 L344 I347 F444	R64-L68 PolarHBondContact O-N 3.28Å; L65-L68 WeakPolarHBondContact O-CB 3.46Å; L65-L68 PolarHBondContact O-N 3.19Å; L65-L68 VanDerWaalsContact O-N 3.16Å; Q66-L68 VanDerWaalsContact C-N 3.29Å; Q66-L68 PolarHBondContact O-N 3.05Å; L68-E70 VanDerWaalsContact C-N 3.25Å; L68-E70 PolarHBondContact O-N 3.42Å; L68-S71 VanDerWaalsContact O-CB 3.28Å; L68-S71 WeakPolarHBondContact O-CB 3.26Å; L68-S71 PolarHBondContact O-N 3.23Å; L68-S71 VanDerWaalsContact O-N 3.13Å; L68-S71 PolarHBondContact O-OG 3.46Å; L68-F74 HydrophobicContact CD1-CD2 3.87Å; L68-F74 HydrophobicContact CD1-CE2 3.63Å; L68-F74 HydrophobicContact CD2-CD2 4.42Å; L68-F74 HydrophobicContact CD2-CE2 4.03Å; L68-F74 HydrophobicContact CD2-CZ 4.32Å; L68-F74 HydrophobicContact CG-CD2 3.75Å; L68-F74 HydrophobicContact CG-CE2 3.73Å; L68-F74 HydrophobicContact CG-CZ 4.47Å; L68-F74 WeakPolarHBondContact O-CD2 3.38Å; L68-L343 HydrophobicContact CB-CD2 4.03Å; L68-L343 HydrophobicContact CB-CG 4.4Å; L68-L343 HydrophobicContact CD1-CB 4.5Å; L68-L343 HydrophobicContact CD1-CD2 4.2Å; L68-L343 HydrophobicContact CD1-CG 4.28Å; L68-L344 HydrophobicContact CD1-CB 4.16Å; L68-L344 HydrophobicContact CD2-CB 4.19Å; L68-L344 HydrophobicContact CD2-CD1 4.43Å; L68-L344 HydrophobicContact CD2-CG 4.45Å; L68-I347 HydrophobicContact CB-CD1 3.88Å; L68-I347 HydrophobicContact CD2-CD1 3.84Å; L68-I347 HydrophobicContact CG-CD1 4.4Å; L68-F444 HydrophobicContact CD2-CD1 4.03Å; L68-F444 HydrophobicContact CD2-CE1 4.27Å
69	L	96.7	Very high	91.7	Very high	9 Å²	9	45.6 Å²	45.6	5%	0.047	20%	0.202	C	C	.	.	H	α-helix	trans	-70.2	-20.5	-178.6	-63	177.9	0	0	0	113.7	L65 Q66 S71 F74 F444 N445	L65-L69 HydrophobicContact CD1-CD1 4.41Å; L65-L69 HydrophobicContact CD1-CG 4.36Å; L65-L69 HydrophobicContact CG-CD1 4.2Å; L65-L69 VanDerWaalsContact O-CG 3.32Å; L65-L69 WeakPolarHBondContact O-CG 3.47Å; L65-L69 PolarHBondContact O-N 3.45Å; Q66-L69 PolarHBondContact O-N 3.06Å; Q66-L69 VanDerWaalsContact O-N 3.14Å; L69-S71 VanDerWaalsContact C-N 3.33Å; L69-F74 HydrophobicContact CD2-CB 4.27Å; L69-F74 HydrophobicContact CD2-CD1 4.44Å; L69-F74 HydrophobicContact CD2-CG 4.48Å; L69-F444 HydrophobicContact CD2-CB 4.01Å; L69-N445 HydrophobicContact CD2-CB 4.49Å
70	E	94.8	Very high	91.1	Very high	89 Å²	89	39 Å²	39	42%	0.416	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-12.8	173.3	-71.4	168.7	-177.4	0	0	113	Q66 K67 L68 L182	Q66-E70 WeakPolarHBondContact CG-OE1 3.27Å; Q66-E70 PolarHBondContact NE2-OE1 3.36Å; Q66-E70 WeakPolarHBondContact O-CG 3.43Å; Q66-E70 PolarHBondContact O-N 2.65Å; Q66-E70 VanDerWaalsContact O-N 3.07Å; K67-E70 PolarHBondContact O-N 2.98Å; L68-E70 VanDerWaalsContact C-N 3.25Å; L68-E70 PolarHBondContact O-N 3.42Å; E70-L182 HydrophobicContact CG-CD2 4.03Å
71	S	88.7	Confident	90.6	Very high	13 Å²	13	33.5 Å²	33.5	9%	0.091	16%	0.157	C	C	.	.	S	Bend	trans	-68.7	156.8	178.1	74.1	0	0	0	0	112.7	L68 L69 Y73 F74 R75 N340	L68-S71 VanDerWaalsContact O-CB 3.28Å; L68-S71 WeakPolarHBondContact O-CB 3.26Å; L68-S71 PolarHBondContact O-N 3.23Å; L68-S71 VanDerWaalsContact O-N 3.13Å; L68-S71 PolarHBondContact O-OG 3.46Å; L69-S71 VanDerWaalsContact C-N 3.33Å; S71-Y73 PolarHBondContact O-N 3.12Å; S71-F74 PolarHBondContact O-N 3.1Å; S71-F74 WeakPolarHBondContact OG-CD2 3.2Å; S71-R75 WeakPolarHBondContact O-CB 3.46Å; S71-R75 WeakPolarHBondContact O-CG 3.39Å; S71-R75 PolarHBondContact O-N 2.92Å; S71-N340 VanDerWaalsContact CB-OD1 3.28Å; S71-N340 WeakPolarHBondContact CB-OD1 3.37Å
72	D	81.6	Confident	90	Very high	44 Å²	44	39 Å²	39	24%	0.235	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-32.9	-178.8	-73.3	-24.4	0	0	0	113.1	F74 R75 Y76 P110 I113 T331	D72-F74 VanDerWaalsContact C-N 3.34Å; D72-F74 PolarHBondContact O-N 3.04Å; D72-R75 IonicContact OD1-NH1 3.01Å; D72-Y76 HydrophobicContact CB-CE2 4.5Å; D72-Y76 VanDerWaalsContact O-CD2 3.27Å; D72-Y76 WeakPolarHBondContact O-CD2 3.38Å; D72-P110 HydrophobicContact CB-CG 4.15Å; D72-I113 VanDerWaalsContact O-CD1 3.26Å; D72-I113 WeakPolarHBondContact O-CD1 3.41Å; D72-T331 HydrophobicContact CB-CG2 4.26Å
73	Y	83.5	Confident	89.3	Confident	12 Å²	12	39.4 Å²	39.4	5%	0.047	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-41.7	176.6	-166.9	-85.5	0	0	0	111.7	S71 L329 T331 R437 I440 V441	S71-Y73 PolarHBondContact O-N 3.12Å; Y73-L329 HydrophobicContact CD1-CD2 3.8Å; Y73-L329 VanDerWaalsContact CD2-C 3.45Å; Y73-L329 HydrophobicContact CD2-CB 3.77Å; Y73-L329 HydrophobicContact CD2-CD2 4.12Å; Y73-L329 WeakPolarHBondContact CD2-O 3.32Å; Y73-L329 HydrophobicContact CE1-CD2 3.58Å; Y73-L329 HydrophobicContact CE2-CB 4.05Å; Y73-L329 HydrophobicContact CE2-CD2 3.91Å; Y73-L329 HydrophobicContact CG-CB 4.11Å; Y73-L329 HydrophobicContact CG-CD2 4.05Å; Y73-T331 HydrophobicContact CD2-CG2 3.98Å; Y73-T331 HydrophobicContact CG-CG2 4.38Å; Y73-R437 HydrophobicContact CE1-CG 4.36Å; Y73-R437 HydrophobicContact CE2-CG 4.39Å; Y73-R437 PolarHBondContact O-NH2 2.6Å; Y73-I440 HydrophobicContact CE1-CG2 3.91Å; Y73-V441 HydrophobicContact CD1-CG2 4.25Å; Y73-V441 HydrophobicContact CE1-CG2 4.1Å; Y73-V441 WeakPolarHBondContact O-CG2 3.44Å
74	F	90.5	Very high	88.8	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-97.9	-21	-169.7	-72.9	-77.2	0	0	0	115.1	L68 L69 S71 D72 L329 L344 I440 F444 N445	L68-F74 HydrophobicContact CD1-CD2 3.87Å; L68-F74 HydrophobicContact CD1-CE2 3.63Å; L68-F74 HydrophobicContact CD2-CD2 4.42Å; L68-F74 HydrophobicContact CD2-CE2 4.03Å; L68-F74 HydrophobicContact CD2-CZ 4.32Å; L68-F74 HydrophobicContact CG-CD2 3.75Å; L68-F74 HydrophobicContact CG-CE2 3.73Å; L68-F74 HydrophobicContact CG-CZ 4.47Å; L68-F74 WeakPolarHBondContact O-CD2 3.38Å; L69-F74 HydrophobicContact CD2-CB 4.27Å; L69-F74 HydrophobicContact CD2-CD1 4.44Å; L69-F74 HydrophobicContact CD2-CG 4.48Å; S71-F74 PolarHBondContact O-N 3.1Å; S71-F74 WeakPolarHBondContact OG-CD2 3.2Å; D72-F74 VanDerWaalsContact C-N 3.34Å; D72-F74 PolarHBondContact O-N 3.04Å; F74-L329 HydrophobicContact CE2-CD1 4.21Å; F74-L329 HydrophobicContact CE2-CD2 4.49Å; F74-L329 HydrophobicContact CZ-CD2 4.37Å; F74-L344 HydrophobicContact CE2-CD1 4.17Å; F74-L344 HydrophobicContact CZ-CD1 3.68Å; F74-I440 HydrophobicContact CE1-CG2 3.91Å; F74-I440 HydrophobicContact CZ-CG2 4.13Å; F74-F444 HydrophobicContact CD1-CB 3.95Å; F74-F444 HydrophobicContact CD1-CG 4.49Å; F74-F444 HydrophobicContact CE1-CB 3.7Å; F74-F444 AromaticContact CE1-CD2 3.61Å; F74-F444 HydrophobicContact CE1-CD2 3.61Å; F74-F444 HydrophobicContact CE1-CE2 4.42Å; F74-F444 AromaticContact CE1-CG 3.77Å; F74-F444 HydrophobicContact CE1-CG 3.77Å; F74-F444 HydrophobicContact CZ-CD2 4.06Å; F74-F444 HydrophobicContact CZ-CE2 4.46Å; F74-F444 HydrophobicContact CZ-CG 4.28Å; F74-N445 PolarHBondContact O-ND2 2.86Å
75	R	87.4	Confident	88.3	Confident	55 Å²	55	38.4 Å²	38.4	21%	0.208	18%	0.184	C	C	.	.	H	α-helix	trans	-76.1	-23.7	-179	73.3	-176.4	-71.1	-172.7	-1.8	114.3	S71 D72 D180 L181 L182	S71-R75 WeakPolarHBondContact O-CB 3.46Å; S71-R75 WeakPolarHBondContact O-CG 3.39Å; S71-R75 PolarHBondContact O-N 2.92Å; D72-R75 IonicContact OD1-NH1 3.01Å; R75-D180 IonicContact CZ-OD1 3.37Å; R75-D180 IonicContact CZ-OD2 3.44Å; R75-D180 IonicContact NE-OD1 2.73Å; R75-D180 PolarHBondContact NE-OD1 3.43Å; R75-D180 VanDerWaalsContact NE-OD1 3.11Å; R75-D180 IonicContact NE-OD2 3.64Å; R75-D180 IonicContact NH2-OD1 3.18Å; R75-D180 IonicContact NH2-OD2 3.28Å; R75-D180 PolarHBondContact NH2-OD2 2.72Å; R75-L181 WeakPolarHBondContact O-CB 3.41Å; R75-L181 VanDerWaalsContact O-CG 3.27Å; R75-L181 WeakPolarHBondContact O-CG 3.48Å; R75-L181 PolarHBondContact O-N 3.32Å; R75-L182 HydrophobicContact CB-CD1 4.35Å; R75-L182 HydrophobicContact CB-CG 4.1Å
76	Y	82.8	Confident	87.8	Confident	13 Å²	13	42.2 Å²	42.2	5%	0.051	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.8	-178	-61.9	-66.1	0	0	0	111.7	D72 E108 V109 P110 I113 D180 R437	D72-Y76 HydrophobicContact CB-CE2 4.5Å; D72-Y76 VanDerWaalsContact O-CD2 3.27Å; D72-Y76 WeakPolarHBondContact O-CD2 3.38Å; Y76-E108 PolarHBondContact OH-O 3.25Å; Y76-E108 VanDerWaalsContact OH-O 3.12Å; Y76-V109 HydrophobicContact CD1-CG2 4.47Å; Y76-P110 VanDerWaalsContact CE2-CD 3.41Å; Y76-P110 HydrophobicContact CE2-CG 4.07Å; Y76-I113 HydrophobicContact CD2-CD1 3.86Å; Y76-D180 HydrophobicContact CD1-CB 4.14Å; Y76-D180 HydrophobicContact CE1-CB 3.92Å; Y76-R437 PolarHBondContact O-NH1 3.44Å
77	Y	84.7	Confident	87.2	Confident	5 Å²	5	42.8 Å²	42.8	2%	0.02	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.1	179	-178.4	-114.4	0	0	0	110.7	V79 V179 L399 L403 Q406 Q438 V441	Y77-V79 HydrophobicContact CD1-CB 3.91Å; Y77-V79 HydrophobicContact CD1-CG1 4.13Å; Y77-V79 HydrophobicContact CE1-CB 3.7Å; Y77-V79 HydrophobicContact CE1-CG1 4.36Å; Y77-V79 HydrophobicContact CE1-CG2 4.09Å; Y77-V179 PolarHBondContact N-O 2.94Å; Y77-V179 PolarHBondContact O-N 2.93Å; Y77-L399 HydrophobicContact CD1-CD1 3.91Å; Y77-L399 HydrophobicContact CE1-CD1 4.41Å; Y77-L403 HydrophobicContact CD1-CB 4.39Å; Y77-L403 HydrophobicContact CD1-CD1 4.04Å; Y77-L403 HydrophobicContact CD2-CD1 4.27Å; Y77-L403 HydrophobicContact CE1-CB 3.91Å; Y77-L403 HydrophobicContact CE1-CD1 4.35Å; Y77-L403 HydrophobicContact CE1-CG 4.42Å; Y77-L403 HydrophobicContact CE2-CG 4.5Å; Y77-L403 HydrophobicContact CG-CD1 3.99Å; Y77-Q406 PolarHBondContact OH-OE1 2.83Å; Y77-Q438 HydrophobicContact CD2-CG 4.35Å; Y77-Q438 HydrophobicContact CE2-CG 3.67Å; Y77-V441 HydrophobicContact CD2-CB 4.5Å; Y77-V441 HydrophobicContact CD2-CG1 3.89Å
78	K	80.1	Confident	86.6	Confident	33 Å²	33	38.2 Å²	38.2	14%	0.143	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	125.1	176.8	-172.2	174.1	-179.1	178.9	0	109.3	I171 A176 E177 Y178 Q438	K78-I171 HydrophobicContact CD-CG2 4.37Å; K78-I171 VanDerWaalsContact CE-O 3.27Å; K78-I171 WeakPolarHBondContact CE-O 3.25Å; K78-I171 PolarHBondContact NZ-O 3.41Å; K78-A176 HydrophobicContact CG-CB 4.24Å; K78-E177 WeakPolarHBondContact CA-O 3.33Å; K78-Y178 HydrophobicContact CB-CD1 3.97Å; K78-Y178 HydrophobicContact CB-CE1 3.76Å; K78-Y178 HydrophobicContact CB-CE2 4.41Å; K78-Y178 HydrophobicContact CB-CG 4.41Å; K78-Y178 HydrophobicContact CD-CE2 4.07Å; K78-Y178 HydrophobicContact CG-CE2 4.39Å; K78-Q438 PolarHBondContact O-NE2 2.69Å
79	V	82.5	Confident	85.7	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	144.8	-177.5	60.9	0	0	0	0	111.6	Y77 L81 E177 V179 L399 K402	Y77-V79 HydrophobicContact CD1-CB 3.91Å; Y77-V79 HydrophobicContact CD1-CG1 4.13Å; Y77-V79 HydrophobicContact CE1-CB 3.7Å; Y77-V79 HydrophobicContact CE1-CG1 4.36Å; Y77-V79 HydrophobicContact CE1-CG2 4.09Å; V79-L81 HydrophobicContact CG1-CD1 4.36Å; V79-L81 HydrophobicContact CG1-CD2 4.13Å; V79-L81 HydrophobicContact CG1-CG 3.96Å; V79-L81 HydrophobicContact CG2-CD2 3.79Å; V79-L81 HydrophobicContact CG2-CG 4.29Å; V79-E177 PolarHBondContact N-O 3.49Å; V79-E177 PolarHBondContact O-N 2.87Å; V79-E177 VanDerWaalsContact O-N 3.07Å; V79-V179 HydrophobicContact CG1-CB 4.5Å; V79-V179 HydrophobicContact CG1-CG2 3.78Å; V79-L399 HydrophobicContact CG1-CD1 3.65Å; V79-K402 HydrophobicContact CG2-CB 4.44Å; V79-K402 HydrophobicContact CG2-CD 3.64Å
80	N	84.3	Confident	84.1	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.016	26%	0.26	C	S	.	.			trans	-95	110.6	167	-173.9	-19.9	0	0	0	109.8	K82 R83 D170 S173 A176	N80-K82 PolarHBondContact OD1-N 2.92Å; N80-R83 HydrophobicContact CB-CG 4.37Å; N80-R83 PolarHBondContact OD1-N 2.83Å; N80-D170 WeakPolarHBondContact CB-OD1 3.4Å; N80-S173 PolarHBondContact ND2-OG 2.96Å; N80-A176 HydrophobicContact CB-CB 4.27Å
81	L	83.9	Confident	82.5	Confident	21 Å²	21	50.1 Å²	50.1	11%	0.11	25%	0.254	C	S	.	.			trans	-96.6	-6.3	176.7	-61.4	178.2	0	0	0	113.3	V79 V101 F395 R398 L399	V79-L81 HydrophobicContact CG1-CD1 4.36Å; V79-L81 HydrophobicContact CG1-CD2 4.13Å; V79-L81 HydrophobicContact CG1-CG 3.96Å; V79-L81 HydrophobicContact CG2-CD2 3.79Å; V79-L81 HydrophobicContact CG2-CG 4.29Å; L81-V101 HydrophobicContact CD1-CB 3.88Å; L81-V101 HydrophobicContact CD1-CG1 3.8Å; L81-V101 HydrophobicContact CD1-CG2 3.9Å; L81-F395 HydrophobicContact CB-CD1 4.33Å; L81-R398 HydrophobicContact CD2-CB 4.35Å; L81-R398 HydrophobicContact CD2-CG 3.89Å; L81-R398 PolarHBondContact O-NH1 2.97Å; L81-L399 HydrophobicContact CD1-CB 4.49Å; L81-L399 HydrophobicContact CD2-CB 4.13Å
82	K	83.4	Confident	80.9	Confident	119 Å²	119	51.9 Å²	51.9	52%	0.517	27%	0.267	S	S	.	.			trans	-93.4	-8	-173.3	-61.8	178.6	-169.9	162.5	0	113.5	N80 D175 E177	N80-K82 PolarHBondContact OD1-N 2.92Å; K82-D175 HydrophobicContact CD-CB 4.42Å; K82-E177 IonicContact NZ-OE1 2.67Å; K82-E177 PolarHBondContact NZ-OE1 2.96Å
83	R	84.2	Confident	79.8	Confident	45 Å²	45	57.4 Å²	57.4	17%	0.17	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-55	133.2	177.5	-73.7	-176.2	177.8	-143.4	0.5	111.7	N80 E167 D169 D170 D390 R398	N80-R83 HydrophobicContact CB-CG 4.37Å; N80-R83 PolarHBondContact OD1-N 2.83Å; R83-E167 IonicContact CZ-OE2 2.66Å; R83-E167 IonicContact NH1-OE2 3.72Å; R83-E167 PolarHBondContact NH1-OE2 3.06Å; R83-D169 PolarHBondContact NH2-O 2.95Å; R83-D170 WeakPolarHBondContact CD-OD1 3.3Å; R83-D170 IonicContact CZ-OD1 2.76Å; R83-D170 IonicContact NE-OD1 3.53Å; R83-D170 PolarHBondContact NE-OD1 3.19Å; R83-D170 IonicContact NH1-OD1 3.27Å; R83-D170 IonicContact NH2-OD1 3.62Å; R83-D170 PolarHBondContact NH2-OD1 3.3Å; R83-D170 VanDerWaalsContact NH2-OD1 3.17Å; R83-D390 HydrophobicContact CB-CB 4.16Å; R83-R398 PolarHBondContact O-NH1 3.4Å
84	P	86.2	Confident	78.6	Confident	105 Å²	105	58.4 Å²	58.4	68%	0.682	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-71.2	152.9	172.3	31.2	-34.1	0	0	0	110.2	P86	P84-P86 WeakPolarHBondContact O-CD 3.01Å
85	C	87.9	Confident	76.9	Confident	10 Å²	10	62.6 Å²	62.6	7%	0.068	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-64.4	123.5	173.5	176.5	0	0	0	0	110.1	F87 W88 I91 D390 C391	C85-F87 PolarHBondContact O-N 3.29Å; C85-W88 VanDerWaalsContact CB-O 3.3Å; C85-W88 WeakPolarHBondContact CB-O 3.38Å; C85-W88 PolarHBondContact SG-N 2.03Å; C85-W88 VanDerWaalsContact SG-N 3.37Å; C85-W88 PolarHBondContact SG-O 3.36Å; C85-I91 HydrophobicContact CB-CD1 3.65Å; C85-I91 HydrophobicContact CB-CG1 4.11Å; C85-D390 PolarHBondContact N-O 3.24Å; C85-C391 VanDerWaalsContact CA-SG 3.55Å; C85-C391 HydrophobicContact CB-CB 3.77Å; C85-C391 WeakPolarHBondContact CB-SG 3.08Å; C85-C391 WeakPolarHBondContact SG-CB 3.37Å; C85-C391 CovalentContact SG-SG 2.03Å; C85-C391 PolarHBondContact SG-SG 3.37Å
86	P	87.4	Confident	75.7	Confident	81 Å²	81	64.1 Å²	64.1	53%	0.526	35%	0.349	S	S	.	.	S	Bend	trans	-77.2	-9.6	179.8	29.8	-34.6	0	0	0	113.5	P84 R387	P84-P86 WeakPolarHBondContact O-CD 3.01Å; P86-R387 HydrophobicContact CG-CB 4.25Å
87	F	86.6	Confident	74.7	Confident	99 Å²	99	74.5 Å²	74.5	43%	0.434	39%	0.388	S	S	.	.	S	Bend	trans	-106.5	-30.1	-170.7	-56.9	-63.8	0	0	0	114.5	C85 R387 I388	C85-F87 PolarHBondContact O-N 3.29Å; F87-R387 HydrophobicContact CE2-CB 4.08Å; F87-R387 HydrophobicContact CZ-CB 4.15Å; F87-I388 HydrophobicContact CD2-CG1 4.31Å; F87-I388 HydrophobicContact CE2-CB 4.38Å; F87-I388 HydrophobicContact CE2-CG1 3.61Å; F87-I388 HydrophobicContact CZ-CG1 4.25Å
88	W	85	Confident	73.7	Confident	44 Å²	44	75.3 Å²	75.3	17%	0.167	39%	0.392	C	S	.	.			trans	-158.7	156.6	179.7	53.2	82	0	0	0	112.2	C85 K198 I199 V202 C391	C85-W88 VanDerWaalsContact CB-O 3.3Å; C85-W88 WeakPolarHBondContact CB-O 3.38Å; C85-W88 PolarHBondContact SG-N 2.03Å; C85-W88 VanDerWaalsContact SG-N 3.37Å; C85-W88 PolarHBondContact SG-O 3.36Å; W88-K198 HydrophobicContact CH2-CD 4.38Å; W88-K198 HydrophobicContact CH2-CG 4.35Å; W88-K198 HydrophobicContact CZ2-CD 4.08Å; W88-K198 HydrophobicContact CZ2-CG 4.34Å; W88-I199 HydrophobicContact CH2-CD1 4.27Å; W88-I199 HydrophobicContact CZ2-CD1 3.71Å; W88-V202 HydrophobicContact CH2-CG2 4.12Å; W88-V202 HydrophobicContact CZ3-CG2 4.26Å; W88-C391 HydrophobicContact CH2-CB 4.27Å; W88-C391 HydrophobicContact CZ2-CB 3.55Å
89	N	77.2	Confident	72.9	Confident	156 Å²	156	73.8 Å²	73.8	83%	0.834	39%	0.386	S	S	*	.	S	Bend	trans	-93.3	-15.3	-176.9	-72.1	-25.9	0	0	0	114.2	I91	N89-I91 VanDerWaalsContact C-N 3.29Å; N89-I91 PolarHBondContact O-N 3.47Å
90	D	63	Low	72.3	Confident	132 Å²	132	76.5 Å²	76.5	71%	0.706	41%	0.408	S	S	*	.			trans	-81.2	72.7	-176.9	-54.6	-33.5	0	0	0	110.6	S92	D90-S92 PolarHBondContact O-N 2.81Å
91	I	60.8	Low	71.5	Confident	60 Å²	60	77.6 Å²	77.6	31%	0.308	42%	0.415	S	S	.	.			trans	-92.5	95.6	171.7	-50	176.3	0	0	0	107.5	C85 N89 Q93	C85-I91 HydrophobicContact CB-CD1 3.65Å; C85-I91 HydrophobicContact CB-CG1 4.11Å; N89-I91 VanDerWaalsContact C-N 3.29Å; N89-I91 PolarHBondContact O-N 3.47Å; I91-Q93 PolarHBondContact O-N 3.17Å; I91-Q93 VanDerWaalsContact O-N 3.1Å
92	S	56.9	Low	70.7	Confident	51 Å²	51	81.9 Å²	81.9	36%	0.357	43%	0.433	S	S	.	.			trans	-61	112.2	164.1	54.4	0	0	0	0	108.5	D90 C94 D195	D90-S92 PolarHBondContact O-N 2.81Å; S92-C94 PolarHBondContact O-N 3.06Å; S92-D195 WeakPolarHBondContact CB-OD2 2.85Å; S92-D195 PolarHBondContact OG-OD1 2.73Å; S92-D195 PolarHBondContact OG-OD2 2.97Å
93	Q	58.1	Low	69.9	Low	160 Å²	160	79 Å²	79	75%	0.748	43%	0.426	S	S	*	.			trans	-68.9	133.4	176	-75.1	-177.8	-6.7	0	0	109.4	I91 G95	I91-Q93 PolarHBondContact O-N 3.17Å; I91-Q93 VanDerWaalsContact O-N 3.1Å; Q93-G95 PolarHBondContact O-N 2.68Å
94	C	58.1	Low	68.6	Low	33 Å²	33	78 Å²	78	22%	0.223	43%	0.426	C	S	.	.			trans	-63.9	105.1	172	-173.5	0	0	0	0	109	S92 R96 C99 G393 C394	S92-C94 PolarHBondContact O-N 3.06Å; C94-R96 PolarHBondContact O-N 3.42Å; C94-C99 HydrophobicContact CB-CB 4Å; C94-C99 VanDerWaalsContact CB-SG 3.51Å; C94-C99 VanDerWaalsContact SG-CB 3.53Å; C94-G393 PolarHBondContact N-O 3.04Å; C94-C394 HydrophobicContact CB-CB 3.98Å
95	G	54.3	Low	67.7	Low	87 Å²	87	78.5 Å²	78.5	90%	0.897	42%	0.419	S	S	*	.			trans	-69.6	6.4	-176.7	0	0	0	0	0	115.5	Q93	Q93-G95 PolarHBondContact O-N 2.68Å
96	R	63.1	Low	66.4	Low	88 Å²	88	82.3 Å²	82.3	33%	0.332	45%	0.446	S	S	.	.			trans	-95.3	130.3	178.7	-93.1	-169.9	145.8	166.2	-5.7	111.7	C94 D98 C99 Y188 E270	C94-R96 PolarHBondContact O-N 3.42Å; R96-D98 PolarHBondContact O-N 3.13Å; R96-D98 VanDerWaalsContact O-N 3.14Å; R96-C99 WeakPolarHBondContact O-CB 3.47Å; R96-C99 PolarHBondContact O-N 2.68Å; R96-Y188 VanDerWaalsContact NH1-CE1 3.33Å; R96-E270 IonicContact CZ-OE2 3.76Å; R96-E270 IonicContact NH2-OE2 2.63Å; R96-E270 PolarHBondContact NH2-OE2 3.39Å
97	R	60.5	Low	65.3	Low	231 Å²	231	84.2 Å²	84.2	87%	0.872	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-54.9	-32.1	173.8	-66.3	-175	-177	179.5	1	112.9	C99 A100	R97-C99 PolarHBondContact O-N 3.17Å; R97-C99 VanDerWaalsContact O-N 3.16Å; R97-A100 WeakPolarHBondContact O-CB 3.49Å; R97-A100 PolarHBondContact O-N 3.15Å; R97-A100 VanDerWaalsContact O-N 3.12Å
98	D	64.9	Low	64.3	Low	21 Å²	21	83 Å²	83	11%	0.112	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-68.9	-11.9	-178	-65.6	-47.9	0	0	0	114	R96 R187 K275 W277 K396	R96-D98 PolarHBondContact O-N 3.13Å; R96-D98 VanDerWaalsContact O-N 3.14Å; D98-R187 IonicContact OD1-NH2 3.08Å; D98-K275 VanDerWaalsContact CG-NZ 3.25Å; D98-K275 IonicContact OD1-NZ 3.51Å; D98-K275 PolarHBondContact OD1-NZ 3.44Å; D98-K275 IonicContact OD2-NZ 2.67Å; D98-K275 PolarHBondContact OD2-NZ 3.18Å; D98-W277 HydrophobicContact CB-CH2 4.49Å; D98-K396 VanDerWaalsContact O-CD 3.32Å; D98-K396 WeakPolarHBondContact O-CD 3.37Å; D98-K396 WeakPolarHBondContact O-CE 3.44Å; D98-K396 PolarHBondContact O-NZ 3.12Å
99	C	63.6	Low	63.4	Low	2 Å²	2	81.3 Å²	81.3	1%	0.014	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-90.9	-12.7	175.5	176.7	0	0	0	0	113.5	C94 R96 R97 C394 F395 K396	C94-C99 HydrophobicContact CB-CB 4Å; C94-C99 VanDerWaalsContact CB-SG 3.51Å; C94-C99 VanDerWaalsContact SG-CB 3.53Å; R96-C99 WeakPolarHBondContact O-CB 3.47Å; R96-C99 PolarHBondContact O-N 2.68Å; R97-C99 PolarHBondContact O-N 3.17Å; R97-C99 VanDerWaalsContact O-N 3.16Å; C99-C394 HydrophobicContact CB-CB 4.44Å; C99-C394 WeakPolarHBondContact CB-SG 3.36Å; C99-C394 WeakPolarHBondContact SG-CA 3.43Å; C99-C394 WeakPolarHBondContact SG-CB 3.47Å; C99-C394 CovalentContact SG-SG 2.04Å; C99-C394 PolarHBondContact SG-SG 3.11Å; C99-F395 PolarHBondContact SG-N 3.2Å; C99-K396 PolarHBondContact O-N 2.67Å; C99-K396 VanDerWaalsContact O-N 3.14Å
100	A	70.2	Confident	63	Low	58 Å²	58	75.2 Å²	75.2	48%	0.479	41%	0.411	S	S	.	.			trans	-68.3	137.3	177	0	0	0	0	0	111.3	R97 K396	R97-A100 WeakPolarHBondContact O-CB 3.49Å; R97-A100 PolarHBondContact O-N 3.15Å; R97-A100 VanDerWaalsContact O-N 3.12Å; A100-K396 WeakPolarHBondContact O-CE 3.09Å
101	V	66.8	Low	63	Low	26 Å²	26	74.4 Å²	74.4	16%	0.158	41%	0.406	C	S	.	.			trans	-96.6	130.2	173.1	175.1	0	0	0	0	108.2	L81 P103 V179 N184 F395 K396 L399	L81-V101 HydrophobicContact CD1-CB 3.88Å; L81-V101 HydrophobicContact CD1-CG1 3.8Å; L81-V101 HydrophobicContact CD1-CG2 3.9Å; V101-P103 WeakPolarHBondContact O-CD 3.4Å; V101-V179 HydrophobicContact CG1-CB 4.45Å; V101-V179 HydrophobicContact CG1-CG1 3.53Å; V101-V179 HydrophobicContact CG1-CG2 3.99Å; V101-N184 WeakPolarHBondContact CA-OD1 3.33Å; V101-F395 HydrophobicContact CB-CB 4.41Å; V101-F395 HydrophobicContact CG2-CB 3.79Å; V101-K396 HydrophobicContact CG2-CB 4.4Å; V101-K396 HydrophobicContact CG2-CG 3.69Å; V101-L399 HydrophobicContact CG1-CD2 4.39Å; V101-L399 HydrophobicContact CG2-CB 4.44Å; V101-L399 HydrophobicContact CG2-CD2 4.26Å
102	K	67.7	Low	62.7	Low	112 Å²	112	71.7 Å²	71.7	49%	0.487	39%	0.393	S	S	.	.			trans	-88.5	114.1	171.5	-170	-169.7	175.3	-154.7	0	108.1	N184	K102-N184 PolarHBondContact N-OD1 3.25Å; K102-N184 PolarHBondContact O-ND2 3.04Å
103	P	65.9	Low	62.8	Low	58 Å²	58	69.2 Å²	69.2	38%	0.377	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-68.4	153.1	171.9	29.7	-33.3	0	0	0	110.2	V101 E177	V101-P103 WeakPolarHBondContact O-CD 3.4Å; P103-E177 WeakPolarHBondContact CB-OE2 3.44Å
104	C	57.8	Low	62.6	Low	24 Å²	24	63.1 Å²	63.1	16%	0.162	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-69.1	144	174.2	-63.2	0	0	0	0	110.4	V109 Y178 D180	C104-V109 HydrophobicContact CB-CG2 3.7Å; C104-Y178 WeakPolarHBondContact CB-O 3.31Å; C104-Y178 PolarHBondContact N-O 2.68Å; C104-Y178 PolarHBondContact SG-O 2.65Å; C104-D180 PolarHBondContact SG-N 3.14Å
105	Q	65.5	Low	61.9	Low	115 Å²	115	64 Å²	64	54%	0.537	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-72.2	155.5	162.9	-61.6	-165.5	-1.9	0	0	109.7	D107 E108	Q105-D107 VanDerWaalsContact C-N 3.27Å; Q105-D107 WeakPolarHBondContact CB-OD1 2.95Å; Q105-D107 PolarHBondContact O-N 3.16Å; Q105-E108 HydrophobicContact CB-CG 4.17Å; Q105-E108 PolarHBondContact N-OE2 3.12Å; Q105-E108 PolarHBondContact O-N 2.99Å; Q105-E108 VanDerWaalsContact O-N 3.14Å
106	S	61	Low	61.2	Low	90 Å²	90	62.5 Å²	62.5	63%	0.629	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-58.3	-42.3	-177.5	-173.8	0	0	0	0	110.7	E108 V109 K114	S106-E108 VanDerWaalsContact C-N 3.3Å; S106-E108 PolarHBondContact O-N 2.04Å; S106-V109 PolarHBondContact O-N 3.14Å; S106-K114 WeakPolarHBondContact O-CE 3.43Å; S106-K114 PolarHBondContact O-NZ 2.96Å
107	D	65.4	Low	59.8	Low	122 Å²	122	60.2 Å²	60.2	65%	0.652	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-65.9	-21.1	178.4	61.2	-36.8	0	0	0	115.5	Q105	Q105-D107 VanDerWaalsContact C-N 3.27Å; Q105-D107 WeakPolarHBondContact CB-OD1 2.95Å; Q105-D107 PolarHBondContact O-N 3.16Å
108	E	65.2	Low	58.5	Low	73 Å²	73	55.5 Å²	55.5	34%	0.341	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-78.8	-22.9	-178.6	-67	175.1	155.5	0	0	113.3	Y76 Q105 S106	Y76-E108 PolarHBondContact OH-O 3.25Å; Y76-E108 VanDerWaalsContact OH-O 3.12Å; Q105-E108 HydrophobicContact CB-CG 4.17Å; Q105-E108 PolarHBondContact N-OE2 3.12Å; Q105-E108 PolarHBondContact O-N 2.99Å; Q105-E108 VanDerWaalsContact O-N 3.14Å; S106-E108 VanDerWaalsContact C-N 3.3Å; S106-E108 PolarHBondContact O-N 2.04Å
109	V	64.9	Low	56.9	Low	8 Å²	8	63.1 Å²	63.1	5%	0.048	35%	0.345	C	S	.	.	S	Bend	trans	-87.4	128.9	-179	-177.3	0	0	0	0	109.9	Y76 C104 S106 I113 K114 Y178	Y76-V109 HydrophobicContact CD1-CG2 4.47Å; C104-V109 HydrophobicContact CB-CG2 3.7Å; S106-V109 PolarHBondContact O-N 3.14Å; V109-I113 HydrophobicContact CG1-CB 3.94Å; V109-I113 HydrophobicContact CG1-CG2 3.75Å; V109-K114 HydrophobicContact CB-CG 4.2Å; V109-K114 HydrophobicContact CG1-CG 3.99Å; V109-K114 WeakPolarHBondContact O-CE 3.49Å; V109-K114 PolarHBondContact O-NZ 3.28Å; V109-Y178 HydrophobicContact CG1-CG 4.5Å; V109-Y178 HydrophobicContact CG2-CG 4.5Å
110	P	69.2	Low	55.7	Low	29 Å²	29	71 Å²	71	19%	0.188	38%	0.376	C	S	.	.			trans	-55.4	139.5	176	-28.7	34.3	0	0	0	113.4	D72 Y76 G112 I113 K114 T331	D72-P110 HydrophobicContact CB-CG 4.15Å; Y76-P110 VanDerWaalsContact CE2-CD 3.41Å; Y76-P110 HydrophobicContact CE2-CG 4.07Å; P110-G112 PolarHBondContact O-N 2.67Å; P110-I113 HydrophobicContact CB-CD1 4.01Å; P110-I113 HydrophobicContact CB-CG1 4.28Å; P110-I113 HydrophobicContact CG-CD1 3.89Å; P110-I113 WeakPolarHBondContact O-CA 3.39Å; P110-I113 WeakPolarHBondContact O-CB 3.16Å; P110-I113 PolarHBondContact O-N 3.07Å; P110-K114 PolarHBondContact O-N 2.95Å; P110-K114 VanDerWaalsContact O-N 3.12Å; P110-T331 WeakPolarHBondContact CB-O 3.03Å
111	D	63.6	Low	54.2	Low	114 Å²	114	72.2 Å²	72.2	61%	0.61	38%	0.381	S	S	*	.	H	α-helix	trans	-63.9	-27.1	-173.6	-65.7	-28.7	0	0	0	113.3	I113 K114 S115	D111-I113 VanDerWaalsContact C-N 3.26Å; D111-I113 PolarHBondContact O-N 2.84Å; D111-K114 PolarHBondContact O-N 3.27Å; D111-K114 IonicContact OD1-NZ 2.88Å; D111-K114 PolarHBondContact OD1-NZ 2.53Å; D111-S115 VanDerWaalsContact O-CB 3.25Å; D111-S115 WeakPolarHBondContact O-CB 3.12Å; D111-S115 PolarHBondContact O-N 3.37Å; D111-S115 PolarHBondContact O-OG 3.42Å
112	G	54.6	Low	52.8	Low	3 Å²	3	76.2 Å²	76.2	3%	0.031	40%	0.398	C	S	.	.	H	α-helix	trans	-67.7	-28.1	172.8	0	0	0	0	0	113.2	P110 S115 A116 F330 T331	P110-G112 PolarHBondContact O-N 2.67Å; G112-S115 WeakPolarHBondContact CA-OG 3.45Å; G112-S115 PolarHBondContact O-OG 3.45Å; G112-A116 PolarHBondContact O-N 3.34Å; G112-F330 WeakPolarHBondContact O-CD1 3.35Å; G112-F330 WeakPolarHBondContact O-CE1 3.32Å; G112-T331 WeakPolarHBondContact CA-O 3.46Å; G112-T331 PolarHBondContact N-O 3.01Å; G112-T331 VanDerWaalsContact N-O 3.09Å
113	I	58.2	Low	51.1	Low	0 Å²	0	79.7 Å²	79.7	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-79.5	-37.8	176.4	-62.1	171.8	0	0	0	110.5	D72 Y76 V109 P110 D111 Y178 T331 R437	D72-I113 VanDerWaalsContact O-CD1 3.26Å; D72-I113 WeakPolarHBondContact O-CD1 3.41Å; Y76-I113 HydrophobicContact CD2-CD1 3.86Å; V109-I113 HydrophobicContact CG1-CB 3.94Å; V109-I113 HydrophobicContact CG1-CG2 3.75Å; P110-I113 HydrophobicContact CB-CD1 4.01Å; P110-I113 HydrophobicContact CB-CG1 4.28Å; P110-I113 HydrophobicContact CG-CD1 3.89Å; P110-I113 WeakPolarHBondContact O-CA 3.39Å; P110-I113 WeakPolarHBondContact O-CB 3.16Å; P110-I113 PolarHBondContact O-N 3.07Å; D111-I113 VanDerWaalsContact C-N 3.26Å; D111-I113 PolarHBondContact O-N 2.84Å; I113-Y178 HydrophobicContact CG2-CD1 4.3Å; I113-Y178 HydrophobicContact CG2-CE1 3.64Å; I113-Y178 PolarHBondContact O-OH 3.11Å; I113-T331 HydrophobicContact CD1-CG2 4.17Å; I113-T331 HydrophobicContact CG1-CG2 4.35Å; I113-R437 VanDerWaalsContact CG1-NH2 3.32Å; I113-R437 VanDerWaalsContact CG2-CZ 3.46Å
114	K	54.2	Low	49.7	Very low	32 Å²	32	81 Å²	81	14%	0.139	43%	0.432	C	S	.	.	H	α-helix	trans	-65.9	-49.8	172.1	-64.4	177.3	-173.6	145.5	0	112.1	S106 V109 P110 D111 A116 S117 Y118	S106-K114 WeakPolarHBondContact O-CE 3.43Å; S106-K114 PolarHBondContact O-NZ 2.96Å; V109-K114 HydrophobicContact CB-CG 4.2Å; V109-K114 HydrophobicContact CG1-CG 3.99Å; V109-K114 WeakPolarHBondContact O-CE 3.49Å; V109-K114 PolarHBondContact O-NZ 3.28Å; P110-K114 PolarHBondContact O-N 2.95Å; P110-K114 VanDerWaalsContact O-N 3.12Å; D111-K114 PolarHBondContact O-N 3.27Å; D111-K114 IonicContact OD1-NZ 2.88Å; D111-K114 PolarHBondContact OD1-NZ 2.53Å; K114-A116 PolarHBondContact O-N 3.44Å; K114-S117 WeakPolarHBondContact O-CA 3.47Å; K114-S117 WeakPolarHBondContact O-CB 3.41Å; K114-S117 PolarHBondContact O-N 3.4Å; K114-S117 PolarHBondContact O-OG 3.42Å; K114-Y118 HydrophobicContact CB-CD2 4.24Å; K114-Y118 HydrophobicContact CB-CE2 4.08Å; K114-Y118 WeakPolarHBondContact O-CD2 3.47Å; K114-Y118 PolarHBondContact O-N 2.94Å; K114-Y118 VanDerWaalsContact O-N 3.13Å
115	S	42.6	Very low	48.5	Very low	51 Å²	51	84.9 Å²	84.9	36%	0.357	45%	0.451	S	S	.	.	H	α-helix	trans	-65.9	-24.3	-176.9	53.9	0	0	0	0	113	D111 G112 S117 Y118 K119	D111-S115 VanDerWaalsContact O-CB 3.25Å; D111-S115 WeakPolarHBondContact O-CB 3.12Å; D111-S115 PolarHBondContact O-N 3.37Å; D111-S115 PolarHBondContact O-OG 3.42Å; G112-S115 WeakPolarHBondContact CA-OG 3.45Å; G112-S115 PolarHBondContact O-OG 3.45Å; S115-S117 PolarHBondContact O-N 3.12Å; S115-Y118 CarbonylContact O-C 3.53Å; S115-Y118 PolarHBondContact O-N 3.3Å; S115-Y118 VanDerWaalsContact O-N 3.11Å; S115-K119 PolarHBondContact O-N 2.85Å
116	A	40.8	Very low	46.8	Very low	55 Å²	55	86.3 Å²	86.3	46%	0.455	46%	0.462	S	S	.	.	H	α-helix	trans	-62.9	-24.8	167.2	0	0	0	0	0	113	G112 K114	G112-A116 PolarHBondContact O-N 3.34Å; K114-A116 PolarHBondContact O-N 3.44Å
117	S	33.5	Very low	45.2	Very low	40 Å²	40	90.1 Å²	90.1	28%	0.28	47%	0.474	S	S	.	.	H	α-helix	trans	-84.5	-31.7	167.4	85.9	0	0	0	0	112.9	K114 S115 K119 Y120	K114-S117 WeakPolarHBondContact O-CA 3.47Å; K114-S117 WeakPolarHBondContact O-CB 3.41Å; K114-S117 PolarHBondContact O-N 3.4Å; K114-S117 PolarHBondContact O-OG 3.42Å; S115-S117 PolarHBondContact O-N 3.12Å; S117-K119 VanDerWaalsContact C-N 3.34Å; S117-Y120 PolarHBondContact O-N 2.81Å
118	Y	33.8	Very low	43.6	Very low	132 Å²	132	92.3 Å²	92.3	52%	0.518	49%	0.485	S	S	.	.	H	α-helix	trans	-82.8	-1.4	177.6	-63.9	-73.1	0	0	0	115.1	K114 S115 Y120	K114-Y118 HydrophobicContact CB-CD2 4.24Å; K114-Y118 HydrophobicContact CB-CE2 4.08Å; K114-Y118 WeakPolarHBondContact O-CD2 3.47Å; K114-Y118 PolarHBondContact O-N 2.94Å; K114-Y118 VanDerWaalsContact O-N 3.13Å; S115-Y118 CarbonylContact O-C 3.53Å; S115-Y118 PolarHBondContact O-N 3.3Å; S115-Y118 VanDerWaalsContact O-N 3.11Å; Y118-Y120 PolarHBondContact O-N 3.3Å; Y118-Y120 VanDerWaalsContact O-N 3.07Å
119	K	31.2	Very low	41.8	Very low	182 Å²	182	96.7 Å²	96.7	79%	0.791	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-10.2	163.1	-131.9	178.9	-175.9	-178.6	0	111.8	S115 S117	S115-K119 PolarHBondContact O-N 2.85Å; S117-K119 VanDerWaalsContact C-N 3.34Å
120	Y	37.1	Very low	39.8	Very low	166 Å²	166	105.1 Å²	105.1	65%	0.651	54%	0.544	S	S	*	.	S	Bend	trans	-127.1	93.2	163.9	-70	-83.6	0	0	0	110.3	S117 Y118	S117-Y120 PolarHBondContact O-N 2.81Å; Y118-Y120 PolarHBondContact O-N 3.3Å; Y118-Y120 VanDerWaalsContact O-N 3.07Å
121	S	39.7	Very low	38	Very low	85 Å²	85	109.7 Å²	109.7	59%	0.594	58%	0.575	S	S	*	*			trans	63	125.3	162.5	67.5	0	0	0	0	120.7
122	E	36.5	Very low	36.3	Very low	110 Å²	110	112.3 Å²	112.3	51%	0.514	58%	0.584	S	S	.	*				-169.7	40.8	119.5	-115.1	-174.9	-152.7	0	0	115.4	A124 N125	E122-A124 PolarHBondContact O-N 3.48Å; E122-N125 HydrophobicContact CG-CB 4Å; E122-N125 PolarHBondContact OE1-ND2 2.84Å; E122-N125 PolarHBondContact OE2-ND2 3Å
123	E	32.2	Very low	34.9	Very low	185 Å²	185	120.6 Å²	120.6	86%	0.864	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-0.5	150.6	-66.2	82.2	-172.1	0	0	112.4
124	A	36.4	Very low	33.4	Very low	85 Å²	85	124.9 Å²	124.9	70%	0.702	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-3.8	178.7	0	0	0	0	0	114.9	E122	E122-A124 PolarHBondContact O-N 3.48Å
125	N	32.5	Very low	32.2	Very low	105 Å²	105	132 Å²	132	56%	0.561	69%	0.691	S	S	*	*	S	Bend	trans	-102.3	4.8	-174.6	-100.1	2.6	0	0	0	116.2	E122	E122-N125 HydrophobicContact CG-CB 4Å; E122-N125 PolarHBondContact OE1-ND2 2.84Å; E122-N125 PolarHBondContact OE2-ND2 3Å
126	N	30.9	Very low	32	Very low	146 Å²	146	139.8 Å²	139.8	78%	0.781	71%	0.712	S	S	*	*	S	Bend	trans	-130.9	94.1	168.2	-75.5	-40.2	0	0	0	108.9
127	L	26.7	Very low	31.3	Very low	169 Å²	169	146 Å²	146	89%	0.885	74%	0.737	S	S	*	*			trans	167.7	89.5	142.6	-86	157.6	0	0	0	109.1	E129	L127-E129 PolarHBondContact O-N 2.91Å
128	I	31.9	Very low	30.9	Very low	169 Å²	169	147.3 Å²	147.3	87%	0.867	76%	0.757	S	S	*	*			trans	-78.3	98.9	153.9	-65.3	170.6	0	0	0	105.5
129	E	27	Very low	30.5	Very low	165 Å²	165	146.3 Å²	146.3	77%	0.771	78%	0.776	S	S	*	*	S	Bend	trans	166.4	138.5	135.8	-97.5	173	174.2	0	0	110.8	L127	L127-E129 PolarHBondContact O-N 2.91Å
130	E	24.4	Very low	30.3	Very low	184 Å²	184	143.4 Å²	143.4	86%	0.86	77%	0.773	S	S	*	*			trans	72.3	101.2	162	-64.8	-178.3	165.3	0	0	119.1	E132	E130-E132 PolarHBondContact O-N 3.21Å
131	C	30.3	Very low	29.8	Very low	125 Å²	125	142.2 Å²	142.2	85%	0.845	78%	0.778	S	S	*	*			trans	-63.8	111.6	150.7	-178.1	0	0	0	0	109.4
132	E	28.8	Very low	29.3	Very low	169 Å²	169	146.5 Å²	146.5	79%	0.79	79%	0.789	S	S	*	*			trans	173.5	142.4	133.9	-99.6	180	-179.6	0	0	111	E130	E130-E132 PolarHBondContact O-N 3.21Å
133	Q	25.2	Very low	29.1	Very low	177 Å²	177	145.8 Å²	145.8	83%	0.827	80%	0.796	S	S	*	*			trans	75.4	104.4	162.8	-68.6	176.3	-12.9	0	0	120
134	A	26.5	Very low	29.2	Very low	90 Å²	90	142.2 Å²	142.2	74%	0.744	78%	0.782	S	S	*	*				76.7	134.4	126.9	0	0	0	0	0	121.4
135	E	28.8	Very low	29.4	Very low	181 Å²	181	140.6 Å²	140.6	85%	0.846	77%	0.766	S	S	*	*			trans	77.2	96.8	143.7	-74.6	-176.7	152.5	0	0	120.9
136	R	37.2	Very low	29.6	Very low	215 Å²	215	142.9 Å²	142.9	81%	0.811	77%	0.773	S	S	*	*				55.6	83.6	118.5	-158.3	-175.5	-163.1	-175.7	3.4	116.6
137	L	27.1	Very low	29.9	Very low	185 Å²	185	142.8 Å²	142.8	97%	0.969	77%	0.768	S	S	*	*			trans	-144.6	98.5	147.4	-75	178.8	0	0	0	110.6
138	G	25.1	Very low	30.3	Very low	68 Å²	68	136.9 Å²	136.9	70%	0.701	74%	0.739	S	S	*	*			trans	-163.5	64	172.3	0	0	0	0	0	108.1	V140	G138-V140 VanDerWaalsContact C-N 3.32Å; G138-V140 PolarHBondContact O-N 3.45Å
139	A	25.5	Very low	30.4	Very low	112 Å²	112	134.4 Å²	134.4	93%	0.926	72%	0.724	S	S	*	*			trans	-71.2	90.6	178.2	0	0	0	0	0	109.4
140	V	27.6	Very low	30.8	Very low	121 Å²	121	133.4 Å²	133.4	73%	0.733	72%	0.717	S	S	*	*			trans	-93.4	137.1	157.1	178.7	0	0	0	0	106.8	G138 E142	G138-V140 VanDerWaalsContact C-N 3.32Å; G138-V140 PolarHBondContact O-N 3.45Å; V140-E142 PolarHBondContact O-N 3.14Å
141	D	26.3	Very low	31.3	Very low	140 Å²	140	125.7 Å²	125.7	75%	0.749	68%	0.684	S	S	*	*			trans	-45.3	124.4	175.7	-161.9	-7.3	0	0	0	112	S143	D141-S143 VanDerWaalsContact C-N 3.3Å; D141-S143 PolarHBondContact O-N 2.54Å
142	E	29.3	Very low	31.4	Very low	176 Å²	176	122.9 Å²	122.9	82%	0.822	66%	0.663	S	S	*	*	S	Bend	trans	-82.9	52	-168.1	-70.2	-176.8	160.2	0	0	113.1	V140	V140-E142 PolarHBondContact O-N 3.14Å
143	S	31.2	Very low	31.7	Very low	95 Å²	95	120.7 Å²	120.7	66%	0.664	66%	0.656	S	S	*	*			trans	-115.5	12	-179.7	84.7	0	0	0	0	115.9	D141	D141-S143 VanDerWaalsContact C-N 3.3Å; D141-S143 PolarHBondContact O-N 2.54Å
144	L	35.4	Very low	32	Very low	110 Å²	110	118.9 Å²	118.9	58%	0.576	65%	0.648	S	S	*	*	S	Bend	trans	-109.1	130.3	178.6	-66.8	174.2	0	0	0	111.3	T148	L144-T148 HydrophobicContact CD2-CG2 4.26Å
145	S	39.8	Very low	32.4	Very low	51 Å²	51	119 Å²	119	36%	0.357	63%	0.629	S	S	.	*			trans	-66.9	154.5	-178.4	79	0	0	0	0	112.3	E147 T148 Q149	S145-E147 WeakPolarHBondContact CB-OE2 3.47Å; S145-E147 PolarHBondContact O-N 3.44Å; S145-E147 PolarHBondContact OG-OE2 3.18Å; S145-T148 WeakPolarHBondContact O-CA 3.42Å; S145-T148 WeakPolarHBondContact O-CB 3.5Å; S145-T148 PolarHBondContact O-N 2.89Å; S145-T148 PolarHBondContact OG-N 3.13Å; S145-T148 PolarHBondContact OG-OG1 3.48Å; S145-Q149 PolarHBondContact O-N 3.32Å
146	E	36.6	Very low	32.6	Very low	153 Å²	153	112.5 Å²	112.5	72%	0.715	60%	0.602	S	S	*	*	H	α-helix	trans	-57.8	-28.7	177.7	-115	-175.3	154.7	0	0	112.7	T148 K150	E146-T148 VanDerWaalsContact C-N 3.34Å; E146-K150 PolarHBondContact O-N 3.4Å
147	E	37.7	Very low	32.4	Very low	143 Å²	143	110.6 Å²	110.6	67%	0.668	60%	0.599	S	S	*	*	H	α-helix	trans	-69	-35.4	173.6	-51.6	98.3	-174.4	0	0	111.8	S145 K150 A151	S145-E147 WeakPolarHBondContact CB-OE2 3.47Å; S145-E147 PolarHBondContact O-N 3.44Å; S145-E147 PolarHBondContact OG-OE2 3.18Å; E147-K150 PolarHBondContact O-N 3.02Å; E147-A151 WeakPolarHBondContact O-CB 3.37Å; E147-A151 PolarHBondContact O-N 3.44Å
148	T	34.2	Very low	32.6	Very low	45 Å²	45	107.4 Å²	107.4	28%	0.276	58%	0.579	S	S	.	*	H	α-helix	trans	-71.8	-37.2	-178.4	-48.2	0	0	0	0	111.3	L144 S145 E146 A151 V152	L144-T148 HydrophobicContact CD2-CG2 4.26Å; S145-T148 WeakPolarHBondContact O-CA 3.42Å; S145-T148 WeakPolarHBondContact O-CB 3.5Å; S145-T148 PolarHBondContact O-N 2.89Å; S145-T148 PolarHBondContact OG-N 3.13Å; S145-T148 PolarHBondContact OG-OG1 3.48Å; E146-T148 VanDerWaalsContact C-N 3.34Å; T148-A151 WeakPolarHBondContact O-CB 3.47Å; T148-A151 PolarHBondContact O-N 3.22Å; T148-V152 VanDerWaalsContact O-CG2 3.22Å; T148-V152 WeakPolarHBondContact O-CG2 3.46Å; T148-V152 PolarHBondContact O-N 3Å
149	Q	34.9	Very low	33.1	Very low	118 Å²	118	108.5 Å²	108.5	55%	0.551	57%	0.569	S	S	*	*	H	α-helix	trans	-66.1	-39.6	175	-73.4	-179.1	-9.5	0	0	112.7	S145 A151 V152 L153	S145-Q149 PolarHBondContact O-N 3.32Å; Q149-A151 VanDerWaalsContact C-N 3.33Å; Q149-V152 PolarHBondContact O-N 3.03Å; Q149-L153 PolarHBondContact O-N 3.48Å
150	K	35.3	Very low	33.8	Very low	144 Å²	144	109.1 Å²	109.1	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-68.3	-34.1	173.4	-77.7	178.5	179.9	166.4	0	112.2	E146 E147 Q154	E146-K150 PolarHBondContact O-N 3.4Å; E147-K150 PolarHBondContact O-N 3.02Å; K150-Q154 WeakPolarHBondContact O-CG 3.27Å; K150-Q154 PolarHBondContact O-N 3.22Å
151	A	34	Very low	34.2	Very low	21 Å²	21	107.1 Å²	107.1	17%	0.174	55%	0.549	C	S	.	.	H	α-helix	trans	-65.7	-46	175	0	0	0	0	0	111.2	E147 T148 Q149 L153 Q154 W155	E147-A151 WeakPolarHBondContact O-CB 3.37Å; E147-A151 PolarHBondContact O-N 3.44Å; T148-A151 WeakPolarHBondContact O-CB 3.47Å; T148-A151 PolarHBondContact O-N 3.22Å; Q149-A151 VanDerWaalsContact C-N 3.33Å; A151-L153 VanDerWaalsContact C-N 3.34Å; A151-L153 PolarHBondContact O-N 2.88Å; A151-Q154 CarbonylContact O-C 3.57Å; A151-Q154 WeakPolarHBondContact O-CA 3.46Å; A151-Q154 WeakPolarHBondContact O-CB 3.41Å; A151-Q154 PolarHBondContact O-N 3.11Å; A151-W155 VanDerWaalsContact C-CD2 3.46Å; A151-W155 HydrophobicContact CB-CD2 4.39Å; A151-W155 HydrophobicContact CB-CH2 3.96Å; A151-W155 HydrophobicContact CB-CZ2 3.32Å; A151-W155 PolarHBondContact O-N 2.94Å; A151-W155 PolarHBondContact O-NE1 2.88Å
152	V	33.6	Very low	34.7	Very low	66 Å²	66	103 Å²	103	40%	0.4	53%	0.531	S	S	.	.	H	α-helix	trans	-59	-40.7	176.6	177.7	0	0	0	0	112.7	T148 Q149 W155 T156	T148-V152 VanDerWaalsContact O-CG2 3.22Å; T148-V152 WeakPolarHBondContact O-CG2 3.46Å; T148-V152 PolarHBondContact O-N 3Å; Q149-V152 PolarHBondContact O-N 3.03Å; V152-W155 HydrophobicContact CB-CE3 3.96Å; V152-W155 HydrophobicContact CB-CZ3 4.23Å; V152-W155 HydrophobicContact CG2-CE3 3.53Å; V152-W155 HydrophobicContact CG2-CH2 4.16Å; V152-W155 HydrophobicContact CG2-CZ3 3.3Å; V152-W155 WeakPolarHBondContact O-CB 3.39Å; V152-W155 PolarHBondContact O-N 3.26Å; V152-T156 PolarHBondContact O-N 2.98Å; V152-T156 PolarHBondContact O-OG1 3.4Å; V152-T156 VanDerWaalsContact O-OG1 3.14Å
153	L	33.5	Very low	35.6	Very low	123 Å²	123	98.7 Å²	98.7	64%	0.644	51%	0.513	S	S	*	.	H	α-helix	trans	-70.2	-30.9	175.4	-75.5	162.6	0	0	0	113.4	Q149 A151	Q149-L153 PolarHBondContact O-N 3.48Å; A151-L153 VanDerWaalsContact C-N 3.34Å; A151-L153 PolarHBondContact O-N 2.88Å
154	Q	32.5	Very low	36.5	Very low	140 Å²	140	96.5 Å²	96.5	65%	0.654	49%	0.494	S	S	*	.	H	α-helix	trans	-72.5	-30.5	169.3	-76.8	-177.7	-27.5	0	0	111.7	K150 A151 K157 H158	K150-Q154 WeakPolarHBondContact O-CG 3.27Å; K150-Q154 PolarHBondContact O-N 3.22Å; A151-Q154 CarbonylContact O-C 3.57Å; A151-Q154 WeakPolarHBondContact O-CA 3.46Å; A151-Q154 WeakPolarHBondContact O-CB 3.41Å; A151-Q154 PolarHBondContact O-N 3.11Å; Q154-K157 PolarHBondContact O-N 3.27Å; Q154-H158 WeakPolarHBondContact O-CB 3.38Å; Q154-H158 PolarHBondContact O-N 3.18Å
155	W	35.1	Very low	37.3	Very low	91 Å²	91	91.4 Å²	91.4	35%	0.345	47%	0.467	S	S	.	.	H	α-helix	trans	-70	-42.9	177.6	-57.4	-23.5	0	0	0	111.9	A151 V152 K157 H158 D159 Y431	A151-W155 VanDerWaalsContact C-CD2 3.46Å; A151-W155 HydrophobicContact CB-CD2 4.39Å; A151-W155 HydrophobicContact CB-CH2 3.96Å; A151-W155 HydrophobicContact CB-CZ2 3.32Å; A151-W155 PolarHBondContact O-N 2.94Å; A151-W155 PolarHBondContact O-NE1 2.88Å; V152-W155 HydrophobicContact CB-CE3 3.96Å; V152-W155 HydrophobicContact CB-CZ3 4.23Å; V152-W155 HydrophobicContact CG2-CE3 3.53Å; V152-W155 HydrophobicContact CG2-CH2 4.16Å; V152-W155 HydrophobicContact CG2-CZ3 3.3Å; V152-W155 WeakPolarHBondContact O-CB 3.39Å; V152-W155 PolarHBondContact O-N 3.26Å; W155-K157 VanDerWaalsContact C-N 3.28Å; W155-K157 PolarHBondContact O-N 2.62Å; W155-H158 CarbonylContact O-C 3.46Å; W155-H158 PolarHBondContact O-N 2.89Å; W155-D159 WeakPolarHBondContact O-CB 3.47Å; W155-D159 PolarHBondContact O-N 3.15Å; W155-Y431 HydrophobicContact CD2-CE1 4.48Å; W155-Y431 HydrophobicContact CH2-CE1 4.07Å; W155-Y431 AromaticContact CZ2-CE1 3.87Å; W155-Y431 HydrophobicContact CZ2-CE1 3.87Å; W155-Y431 HydrophobicContact CZ3-CE1 4.4Å
156	T	32.2	Very low	37.9	Very low	45 Å²	45	89.8 Å²	89.8	28%	0.276	46%	0.456	S	S	.	.	H	α-helix	trans	-59.7	-40.2	174.3	-44	0	0	0	0	111.8	V152 H158 D160	V152-T156 PolarHBondContact O-N 2.98Å; V152-T156 PolarHBondContact O-OG1 3.4Å; V152-T156 VanDerWaalsContact O-OG1 3.14Å; T156-H158 VanDerWaalsContact C-N 3.32Å; T156-H158 PolarHBondContact O-N 3.46Å; T156-D160 WeakPolarHBondContact O-CB 3.47Å; T156-D160 PolarHBondContact O-N 3.21Å; T156-D160 VanDerWaalsContact O-N 3.1Å
157	K	33.4	Very low	38.7	Very low	175 Å²	175	83.5 Å²	83.5	76%	0.761	43%	0.426	S	S	*	.	H	α-helix	trans	-70.6	-24.1	175	-81.3	-178.5	175.4	175.9	0	114	Q154 W155	Q154-K157 PolarHBondContact O-N 3.27Å; W155-K157 VanDerWaalsContact C-N 3.28Å; W155-K157 PolarHBondContact O-N 2.62Å
158	H	31.9	Very low	39.3	Very low	118 Å²	118	78.2 Å²	78.2	55%	0.546	41%	0.407	S	S	.	.	H	α-helix	trans	-86.5	-36.3	176.6	-176.5	-84.9	0	0	0	111.9	Q154 W155 T156 S161 S162	Q154-H158 WeakPolarHBondContact O-CB 3.38Å; Q154-H158 PolarHBondContact O-N 3.18Å; W155-H158 CarbonylContact O-C 3.46Å; W155-H158 PolarHBondContact O-N 2.89Å; T156-H158 VanDerWaalsContact C-N 3.32Å; T156-H158 PolarHBondContact O-N 3.46Å; H158-S161 VanDerWaalsContact C-OG 3.32Å; H158-S161 WeakPolarHBondContact CA-OG 3.35Å; H158-S161 CarbonylContact O-C 3.56Å; H158-S161 WeakPolarHBondContact O-CA 3.44Å; H158-S161 WeakPolarHBondContact O-CB 3.38Å; H158-S161 PolarHBondContact O-N 3.25Å; H158-S161 PolarHBondContact O-OG 3.2Å; H158-S162 PolarHBondContact O-N 3.39Å
159	D	34.9	Very low	40	Very low	92 Å²	92	80 Å²	80	49%	0.492	42%	0.415	S	S	.	.	H	α-helix	trans	-72.3	-36.8	178.9	-68.7	-19.3	0	0	0	111.6	W155 S161 S162	W155-D159 WeakPolarHBondContact O-CB 3.47Å; W155-D159 PolarHBondContact O-N 3.15Å; D159-S161 PolarHBondContact O-N 2.89Å; D159-S162 WeakPolarHBondContact O-CB 3.26Å; D159-S162 PolarHBondContact O-N 2.95Å; D159-S162 VanDerWaalsContact O-N 3.11Å; D159-S162 PolarHBondContact O-OG 3.4Å
160	D	39.4	Very low	40.8	Very low	124 Å²	124	74.8 Å²	74.8	66%	0.663	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-13.8	167.3	-76.8	-24.6	0	0	0	112.8	T156	T156-D160 WeakPolarHBondContact O-CB 3.47Å; T156-D160 PolarHBondContact O-N 3.21Å; T156-D160 VanDerWaalsContact O-N 3.1Å
161	S	36.2	Very low	41.7	Very low	80 Å²	80	70.8 Å²	70.8	56%	0.559	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	7.2	173.3	76.9	0	0	0	0	113.9	H158 D159	H158-S161 VanDerWaalsContact C-OG 3.32Å; H158-S161 WeakPolarHBondContact CA-OG 3.35Å; H158-S161 CarbonylContact O-C 3.56Å; H158-S161 WeakPolarHBondContact O-CA 3.44Å; H158-S161 WeakPolarHBondContact O-CB 3.38Å; H158-S161 PolarHBondContact O-N 3.25Å; H158-S161 PolarHBondContact O-OG 3.2Å; D159-S161 PolarHBondContact O-N 2.89Å
162	S	38.6	Very low	42.8	Very low	53 Å²	53	76.3 Å²	76.3	37%	0.371	40%	0.398	S	S	.	.	S	Bend	trans	-92.8	143.8	-174.8	72.6	0	0	0	0	114.3	H158 D159 N164	H158-S162 PolarHBondContact O-N 3.39Å; D159-S162 WeakPolarHBondContact O-CB 3.26Å; D159-S162 PolarHBondContact O-N 2.95Å; D159-S162 VanDerWaalsContact O-N 3.11Å; D159-S162 PolarHBondContact O-OG 3.4Å; S162-N164 PolarHBondContact O-N 3.32Å
163	D	47.4	Very low	44.2	Very low	86 Å²	86	74.2 Å²	74.2	46%	0.46	39%	0.386	S	S	.	.			trans	-69.5	79.5	-168.9	-65.1	-45.9	0	0	0	114.8
164	N	50.8	Low	45.7	Very low	48 Å²	48	74.5 Å²	74.5	26%	0.257	40%	0.395	S	S	.	.			trans	-72.2	134.9	174.5	-67.7	-40.5	0	0	0	112.3	S162 C166 R379	S162-N164 PolarHBondContact O-N 3.32Å; N164-C166 VanDerWaalsContact C-N 3.34Å; N164-C166 WeakPolarHBondContact CB-O 3.27Å; N164-R379 WeakPolarHBondContact O-CD 3.48Å; N164-R379 PolarHBondContact O-NH1 2.89Å
165	F	51.9	Low	47.7	Very low	4 Å²	4	71.5 Å²	71.5	2%	0.018	38%	0.384	C	S	.	.	S	Bend	trans	-79.4	-15.7	178.2	-78.9	-107.2	0	0	0	114	K375 R379 R383 K413	F165-K375 HydrophobicContact CE1-CG 4.5Å; F165-K375 HydrophobicContact CZ-CD 4.47Å; F165-K375 HydrophobicContact CZ-CG 3.78Å; F165-R379 HydrophobicContact CB-CG 4.14Å; F165-R379 HydrophobicContact CD1-CB 3.76Å; F165-R379 HydrophobicContact CD1-CG 3.75Å; F165-R379 HydrophobicContact CD2-CG 3.99Å; F165-R379 HydrophobicContact CE1-CB 3.79Å; F165-R379 HydrophobicContact CE1-CG 4.1Å; F165-R379 HydrophobicContact CE2-CG 4.32Å; F165-R379 HydrophobicContact CG-CB 4.25Å; F165-R379 HydrophobicContact CG-CG 3.69Å; F165-R379 HydrophobicContact CZ-CB 4.31Å; F165-R379 HydrophobicContact CZ-CG 4.38Å; F165-R383 PolarHBondContact O-N 3.26Å; F165-K413 HydrophobicContact CD2-CB 3.63Å; F165-K413 HydrophobicContact CD2-CD 3.82Å; F165-K413 HydrophobicContact CD2-CG 3.83Å; F165-K413 HydrophobicContact CE1-CB 4.41Å; F165-K413 HydrophobicContact CE2-CB 3.44Å; F165-K413 VanDerWaalsContact CE2-CB 3.44Å; F165-K413 HydrophobicContact CE2-CD 4.03Å; F165-K413 HydrophobicContact CE2-CG 3.54Å; F165-K413 HydrophobicContact CG-CB 4.19Å; F165-K413 HydrophobicContact CZ-CB 3.86Å; F165-K413 HydrophobicContact CZ-CG 4.34Å
166	C	51.7	Low	49.7	Very low	17 Å²	17	67.8 Å²	67.8	12%	0.115	37%	0.373	C	S	.	.	S	Bend	trans	-129.2	162.6	172.9	-68.1	0	0	0	0	108.2	N164 A168 Q406	N164-C166 VanDerWaalsContact C-N 3.34Å; N164-C166 WeakPolarHBondContact CB-O 3.27Å; C166-A168 PolarHBondContact O-N 3.41Å; C166-A168 VanDerWaalsContact O-N 3.13Å; C166-Q406 HydrophobicContact CB-CG 4.26Å
167	E	54.1	Low	51.8	Low	20 Å²	20	69.3 Å²	69.3	9%	0.093	38%	0.377	C	S	.	.			trans	-63.3	118.2	176	-68.4	-168	163.8	0	0	110.3	R83 D169 D170 R383 R387	R83-E167 IonicContact CZ-OE2 2.66Å; R83-E167 IonicContact NH1-OE2 3.72Å; R83-E167 PolarHBondContact NH1-OE2 3.06Å; E167-D169 HydrophobicContact CB-CB 4.18Å; E167-D169 PolarHBondContact O-N 3.11Å; E167-D169 VanDerWaalsContact O-N 3.15Å; E167-D170 PolarHBondContact O-N 3.17Å; E167-R383 HydrophobicContact CG-CG 3.95Å; E167-R387 IonicContact OE1-CZ 2.81Å; E167-R387 IonicContact OE1-NE 2.97Å; E167-R387 PolarHBondContact OE1-NE 2.81Å; E167-R387 IonicContact OE1-NH2 2.73Å; E167-R387 PolarHBondContact OE1-NH2 3.34Å
168	A	49.3	Very low	54	Low	32 Å²	32	62.7 Å²	62.7	26%	0.264	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-19.7	168.7	0	0	0	0	0	112	C166 D170 I171	C166-A168 PolarHBondContact O-N 3.41Å; C166-A168 VanDerWaalsContact O-N 3.13Å; A168-D170 PolarHBondContact O-N 3.35Å; A168-D170 VanDerWaalsContact O-N 3.17Å; A168-I171 PolarHBondContact O-N 2.84Å
169	D	49.7	Very low	56.3	Low	84 Å²	84	57.2 Å²	57.2	45%	0.449	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-20.5	-178.8	-56.3	-13.5	0	0	0	113.4	R83 E167 I171 S173	R83-D169 PolarHBondContact NH2-O 2.95Å; E167-D169 HydrophobicContact CB-CB 4.18Å; E167-D169 PolarHBondContact O-N 3.11Å; E167-D169 VanDerWaalsContact O-N 3.15Å; D169-I171 VanDerWaalsContact C-N 3.33Å; D169-S173 WeakPolarHBondContact O-CB 3.32Å; D169-S173 PolarHBondContact O-N 3.2Å
170	D	51.6	Low	58.6	Low	8 Å²	8	53.2 Å²	53.2	4%	0.043	30%	0.3	C	S	.	.	H	α-helix	trans	-74.4	-21.7	175.3	-88.8	-15.4	0	0	0	112.6	N80 R83 E167 A168 A176 K402	N80-D170 WeakPolarHBondContact CB-OD1 3.4Å; R83-D170 WeakPolarHBondContact CD-OD1 3.3Å; R83-D170 IonicContact CZ-OD1 2.76Å; R83-D170 IonicContact NE-OD1 3.53Å; R83-D170 PolarHBondContact NE-OD1 3.19Å; R83-D170 IonicContact NH1-OD1 3.27Å; R83-D170 IonicContact NH2-OD1 3.62Å; R83-D170 PolarHBondContact NH2-OD1 3.3Å; R83-D170 VanDerWaalsContact NH2-OD1 3.17Å; E167-D170 PolarHBondContact O-N 3.17Å; A168-D170 PolarHBondContact O-N 3.35Å; A168-D170 VanDerWaalsContact O-N 3.17Å; D170-A176 WeakPolarHBondContact O-CB 3.4Å; D170-K402 IonicContact OD2-NZ 3.89Å; D170-K402 PolarHBondContact OD2-NZ 3.11Å
171	I	53.4	Low	60.9	Low	60 Å²	60	47.5 Å²	47.5	31%	0.308	27%	0.27	S	S	.	.	H	α-helix	trans	-85.1	-38.7	175.2	-60.6	171.1	0	0	0	110.5	K78 A168 D169 Q438	K78-I171 HydrophobicContact CD-CG2 4.37Å; K78-I171 VanDerWaalsContact CE-O 3.27Å; K78-I171 WeakPolarHBondContact CE-O 3.25Å; K78-I171 PolarHBondContact NZ-O 3.41Å; A168-I171 PolarHBondContact O-N 2.84Å; D169-I171 VanDerWaalsContact C-N 3.33Å; I171-Q438 HydrophobicContact CD1-CB 3.88Å; I171-Q438 HydrophobicContact CD1-CG 4.48Å; I171-Q438 VanDerWaalsContact CD1-OE1 3.29Å; I171-Q438 HydrophobicContact CG1-CB 4.38Å; I171-Q438 VanDerWaalsContact CG1-OE1 3.27Å
172	Q	56.9	Low	63.2	Low	137 Å²	137	47.5 Å²	47.5	64%	0.64	26%	0.263	S	S	*	.	H	α-helix	trans	-85.4	-13	-176.2	-61.8	-175.8	5.9	0	0	113.1
173	S	64	Low	65.3	Low	22 Å²	22	49.4 Å²	49.4	15%	0.154	27%	0.269	C	S	.	.			trans	-64.2	132.7	177.2	177.1	0	0	0	0	111.1	N80 D169 D175 A176	N80-S173 PolarHBondContact ND2-OG 2.96Å; D169-S173 WeakPolarHBondContact O-CB 3.32Å; D169-S173 PolarHBondContact O-N 3.2Å; S173-D175 PolarHBondContact O-N 3.29Å; S173-D175 PolarHBondContact OG-N 3.11Å; S173-A176 VanDerWaalsContact O-CB 3.25Å; S173-A176 WeakPolarHBondContact O-CB 3.33Å; S173-A176 PolarHBondContact O-N 2.98Å; S173-A176 VanDerWaalsContact O-N 3.1Å
174	P	64.8	Low	67.1	Low	128 Å²	128	45.4 Å²	45.4	83%	0.831	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.6	176.8	27	-35.3	0	0	0	112.8	A176	P174-A176 VanDerWaalsContact C-N 3.33Å
175	D	74.4	Confident	69	Low	77 Å²	77	44.9 Å²	44.9	41%	0.412	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	1.8	178.8	-65.7	-49.9	0	0	0	113.6	K82 S173	K82-D175 HydrophobicContact CD-CB 4.42Å; S173-D175 PolarHBondContact O-N 3.29Å; S173-D175 PolarHBondContact OG-N 3.11Å
176	A	78	Confident	71	Confident	14 Å²	14	45.4 Å²	45.4	12%	0.116	25%	0.249	C	C	.	.			trans	-80.7	119.3	-179.5	0	0	0	0	0	111.5	K78 N80 D170 S173 P174	K78-A176 HydrophobicContact CG-CB 4.24Å; N80-A176 HydrophobicContact CB-CB 4.27Å; D170-A176 WeakPolarHBondContact O-CB 3.4Å; S173-A176 VanDerWaalsContact O-CB 3.25Å; S173-A176 WeakPolarHBondContact O-CB 3.33Å; S173-A176 PolarHBondContact O-N 2.98Å; S173-A176 VanDerWaalsContact O-N 3.1Å; P174-A176 VanDerWaalsContact C-N 3.33Å
177	E	76.4	Confident	72.8	Confident	76 Å²	76	47.7 Å²	47.7	36%	0.355	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	151.2	-175	-67.2	169.7	177.9	0	0	110.3	K78 V79 K82 P103	K78-E177 WeakPolarHBondContact CA-O 3.33Å; V79-E177 PolarHBondContact N-O 3.49Å; V79-E177 PolarHBondContact O-N 2.87Å; V79-E177 VanDerWaalsContact O-N 3.07Å; K82-E177 IonicContact NZ-OE1 2.67Å; K82-E177 PolarHBondContact NZ-OE1 2.96Å; P103-E177 WeakPolarHBondContact CB-OE2 3.44Å
178	Y	78.3	Confident	74.5	Confident	37 Å²	37	48.2 Å²	48.2	15%	0.145	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	134.1	168.1	-79.3	-84.2	0	0	0	110.1	K78 C104 V109 I113	K78-Y178 HydrophobicContact CB-CD1 3.97Å; K78-Y178 HydrophobicContact CB-CE1 3.76Å; K78-Y178 HydrophobicContact CB-CE2 4.41Å; K78-Y178 HydrophobicContact CB-CG 4.41Å; K78-Y178 HydrophobicContact CD-CE2 4.07Å; K78-Y178 HydrophobicContact CG-CE2 4.39Å; C104-Y178 WeakPolarHBondContact CB-O 3.31Å; C104-Y178 PolarHBondContact N-O 2.68Å; C104-Y178 PolarHBondContact SG-O 2.65Å; V109-Y178 HydrophobicContact CG1-CG 4.5Å; V109-Y178 HydrophobicContact CG2-CG 4.5Å; I113-Y178 HydrophobicContact CG2-CD1 4.3Å; I113-Y178 HydrophobicContact CG2-CE1 3.64Å; I113-Y178 PolarHBondContact O-OH 3.11Å
179	V	80.1	Confident	76.2	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.1	176.8	-179.1	0	0	0	0	109	Y77 V79 V101 L181 N184 L399	Y77-V179 PolarHBondContact N-O 2.94Å; Y77-V179 PolarHBondContact O-N 2.93Å; V79-V179 HydrophobicContact CG1-CB 4.5Å; V79-V179 HydrophobicContact CG1-CG2 3.78Å; V101-V179 HydrophobicContact CG1-CB 4.45Å; V101-V179 HydrophobicContact CG1-CG1 3.53Å; V101-V179 HydrophobicContact CG1-CG2 3.99Å; V179-L181 PolarHBondContact O-N 2.77Å; V179-N184 HydrophobicContact CG1-CB 4.4Å; V179-N184 WeakPolarHBondContact CG1-ND2 3.2Å; V179-L399 HydrophobicContact CB-CD1 4.35Å; V179-L399 HydrophobicContact CG1-CD1 4.32Å; V179-L399 HydrophobicContact CG1-CD2 3.88Å
180	D	83.2	Confident	77.8	Confident	7 Å²	7	44.1 Å²	44.1	4%	0.037	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	114	171	-176.4	3	0	0	0	110.2	R75 Y76 C104 L182 L183 N184	R75-D180 IonicContact CZ-OD1 3.37Å; R75-D180 IonicContact CZ-OD2 3.44Å; R75-D180 IonicContact NE-OD1 2.73Å; R75-D180 PolarHBondContact NE-OD1 3.43Å; R75-D180 VanDerWaalsContact NE-OD1 3.11Å; R75-D180 IonicContact NE-OD2 3.64Å; R75-D180 IonicContact NH2-OD1 3.18Å; R75-D180 IonicContact NH2-OD2 3.28Å; R75-D180 PolarHBondContact NH2-OD2 2.72Å; Y76-D180 HydrophobicContact CD1-CB 4.14Å; Y76-D180 HydrophobicContact CE1-CB 3.92Å; C104-D180 PolarHBondContact SG-N 3.14Å; D180-L182 VanDerWaalsContact C-N 3.27Å; D180-L182 PolarHBondContact O-N 2.73Å; D180-L182 WeakPolarHBondContact OD1-CB 3.49Å; D180-L182 PolarHBondContact OD1-N 3.05Å; D180-L183 HydrophobicContact CB-CB 4.5Å; D180-L183 HydrophobicContact CB-CD1 4.29Å; D180-L183 HydrophobicContact CB-CG 4.37Å; D180-L183 PolarHBondContact O-N 3.47Å; D180-L183 WeakPolarHBondContact OD2-CG 3.47Å; D180-N184 PolarHBondContact O-N 3.42Å; D180-N184 PolarHBondContact O-ND2 2.95Å
181	L	88	Confident	79.4	Confident	5 Å²	5	46.2 Å²	46.2	3%	0.026	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.6	-178.2	-61.7	178.3	0	0	0	112.5	R75 V179 N184 L399 W400 L403 N445	R75-L181 WeakPolarHBondContact O-CB 3.41Å; R75-L181 VanDerWaalsContact O-CG 3.27Å; R75-L181 WeakPolarHBondContact O-CG 3.48Å; R75-L181 PolarHBondContact O-N 3.32Å; V179-L181 PolarHBondContact O-N 2.77Å; L181-N184 CarbonylContact O-C 3.1Å; L181-N184 PolarHBondContact O-N 3.18Å; L181-L399 HydrophobicContact CD2-CD1 4.32Å; L181-L399 HydrophobicContact CD2-CD2 4.28Å; L181-L399 HydrophobicContact CD2-CG 4.48Å; L181-W400 HydrophobicContact CB-CH2 4.12Å; L181-W400 HydrophobicContact CB-CZ2 4.39Å; L181-W400 HydrophobicContact CD1-CH2 4.34Å; L181-W400 HydrophobicContact CD2-CH2 3.99Å; L181-W400 HydrophobicContact CD2-CZ2 4.17Å; L181-W400 HydrophobicContact CG-CH2 4.38Å; L181-L403 HydrophobicContact CD1-CD1 3.7Å; L181-L403 HydrophobicContact CD2-CD1 3.92Å; L181-L403 HydrophobicContact CG-CD1 4.49Å; L181-N445 HydrophobicContact CD1-CB 4.41Å; L181-N445 WeakPolarHBondContact CD1-OD1 3.5Å
182	L	84	Confident	80.9	Confident	79 Å²	79	50.7 Å²	50.7	41%	0.414	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-34.3	178.8	-60.2	-173.3	0	0	0	111.9	E70 R75 D180 N184	E70-L182 HydrophobicContact CG-CD2 4.03Å; R75-L182 HydrophobicContact CB-CD1 4.35Å; R75-L182 HydrophobicContact CB-CG 4.1Å; D180-L182 VanDerWaalsContact C-N 3.27Å; D180-L182 PolarHBondContact O-N 2.73Å; D180-L182 WeakPolarHBondContact OD1-CB 3.49Å; D180-L182 PolarHBondContact OD1-N 3.05Å; L182-N184 VanDerWaalsContact C-N 3.31Å
183	L	82.6	Confident	82.3	Confident	93 Å²	93	45 Å²	45	49%	0.487	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-16.9	174.5	-63	179.7	0	0	0	112.8	D180 P185	D180-L183 HydrophobicContact CB-CB 4.5Å; D180-L183 HydrophobicContact CB-CD1 4.29Å; D180-L183 HydrophobicContact CB-CG 4.37Å; D180-L183 PolarHBondContact O-N 3.47Å; D180-L183 WeakPolarHBondContact OD2-CG 3.47Å; L183-P185 VanDerWaalsContact O-CD 3.31Å; L183-P185 WeakPolarHBondContact O-CD 3.39Å
184	N	86.4	Confident	83.3	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.016	26%	0.258	C	S	.	.	S	Bend	trans	-120.8	53.9	-175.3	-64.7	-76.6	0	0	0	112.3	V101 K102 V179 D180 L181 L182 L399 W400	V101-N184 WeakPolarHBondContact CA-OD1 3.33Å; K102-N184 PolarHBondContact N-OD1 3.25Å; K102-N184 PolarHBondContact O-ND2 3.04Å; V179-N184 HydrophobicContact CG1-CB 4.4Å; V179-N184 WeakPolarHBondContact CG1-ND2 3.2Å; D180-N184 PolarHBondContact O-N 3.42Å; D180-N184 PolarHBondContact O-ND2 2.95Å; L181-N184 CarbonylContact O-C 3.1Å; L181-N184 PolarHBondContact O-N 3.18Å; L182-N184 VanDerWaalsContact C-N 3.31Å; N184-L399 HydrophobicContact CB-CD2 3.94Å; N184-W400 VanDerWaalsContact O-CE2 3.31Å; N184-W400 VanDerWaalsContact O-CZ2 3.26Å; N184-W400 WeakPolarHBondContact O-CZ2 3.08Å; N184-W400 PolarHBondContact O-NE1 2.95Å
185	P	90.5	Very high	84.3	Confident	37 Å²	37	45.2 Å²	45.2	24%	0.24	24%	0.235	C	C	.	.			trans	-64.4	144.8	-175.7	28.9	-36.3	0	0	0	111.8	L183 R187	L183-P185 VanDerWaalsContact O-CD 3.31Å; L183-P185 WeakPolarHBondContact O-CD 3.39Å; P185-R187 PolarHBondContact O-N 3Å
186	E	92.7	Very high	84.9	Confident	15 Å²	15	42.1 Å²	42.1	7%	0.07	22%	0.22	C	C	.	.			trans	-67	120	169.3	-171.2	172.9	-129.6	0	0	109.4	H261 R265 W400 Q404	E186-H261 HydrophobicContact CG-CB 4.08Å; E186-H261 IonicContact OE2-CD2 3.03Å; E186-H261 IonicContact OE2-CE1 3.45Å; E186-H261 PolarHBondContact OE2-CE1 2.74Å; E186-H261 IonicContact OE2-CG 3.58Å; E186-H261 IonicContact OE2-ND1 3.76Å; E186-H261 PolarHBondContact OE2-ND1 3.41Å; E186-H261 IonicContact OE2-NE2 3.72Å; E186-R265 VanDerWaalsContact O-CD 3.27Å; E186-R265 WeakPolarHBondContact O-CD 3.38Å; E186-R265 PolarHBondContact O-NH1 3.45Å; E186-W400 HydrophobicContact CB-CD2 3.79Å; E186-W400 HydrophobicContact CB-CE3 4.46Å; E186-W400 HydrophobicContact CB-CG 3.83Å; E186-W400 HydrophobicContact CB-CZ2 4.44Å; E186-W400 HydrophobicContact CG-CB 4.49Å; E186-W400 HydrophobicContact CG-CD2 4.5Å; E186-W400 HydrophobicContact CG-CG 4.11Å; E186-W400 VanDerWaalsContact N-NE1 3.17Å; E186-Q404 PolarHBondContact OE1-OE1 2.89Å
187	R	90.5	Very high	85.3	Confident	64 Å²	64	47 Å²	47	24%	0.242	24%	0.235	C	C	.	.			trans	-161.6	179.2	-178.1	67.8	-178.1	-172.2	-174.1	0.3	110.3	D98 P185 T189 R265 W277	D98-R187 IonicContact OD1-NH2 3.08Å; P185-R187 PolarHBondContact O-N 3Å; R187-T189 PolarHBondContact O-N 3.02Å; R187-R265 HydrophobicContact CB-CB 3.55Å; R187-W277 HydrophobicContact CB-CZ3 4.33Å; R187-W277 HydrophobicContact CG-CE3 4.37Å; R187-W277 HydrophobicContact CG-CH2 4.27Å; R187-W277 HydrophobicContact CG-CZ3 3.88Å; R187-W277 VanDerWaalsContact CZ-CZ2 3.42Å
188	Y	89.3	Confident	85.9	Confident	32 Å²	32	47.3 Å²	47.3	13%	0.125	24%	0.236	C	C	.	.			trans	-58.6	126	176.4	173.9	-98.5	0	0	0	112.5	R96 L262 R265 Y266 L267 W277	R96-Y188 VanDerWaalsContact NH1-CE1 3.33Å; Y188-L262 HydrophobicContact CD2-CD1 4.48Å; Y188-R265 WeakPolarHBondContact CB-O 3.27Å; Y188-R265 PolarHBondContact N-O 2.92Å; Y188-Y266 AromaticContact CD2-CD2 3.82Å; Y188-Y266 HydrophobicContact CD2-CD2 3.82Å; Y188-Y266 AromaticContact CD2-CE2 3.46Å; Y188-Y266 HydrophobicContact CD2-CE2 3.46Å; Y188-Y266 VanDerWaalsContact CD2-CE2 3.46Å; Y188-Y266 AromaticContact CD2-CZ 3.94Å; Y188-Y266 HydrophobicContact CE1-CE1 4.35Å; Y188-Y266 HydrophobicContact CE2-CD2 4.36Å; Y188-Y266 HydrophobicContact CE2-CE1 4.45Å; Y188-Y266 AromaticContact CE2-CE2 3.57Å; Y188-Y266 HydrophobicContact CE2-CE2 3.57Å; Y188-Y266 AromaticContact CE2-CZ 3.63Å; Y188-Y266 AromaticContact CG-CD2 3.99Å; Y188-Y266 HydrophobicContact CG-CD2 3.99Å; Y188-Y266 HydrophobicContact CG-CE2 4.02Å; Y188-Y266 HydrophobicContact CG-CG 4.35Å; Y188-Y266 AromaticContact CZ-CZ 3.82Å; Y188-L267 HydrophobicContact CD1-CB 4.01Å; Y188-L267 HydrophobicContact CE1-CB 4.36Å; Y188-W277 HydrophobicContact CD1-CZ3 4.47Å; Y188-W277 VanDerWaalsContact O-CH2 3.28Å; Y188-W277 WeakPolarHBondContact O-CH2 3.43Å; Y188-W277 VanDerWaalsContact O-CZ3 3.27Å; Y188-W277 WeakPolarHBondContact O-CZ3 3.42Å
189	T	85.8	Confident	86.5	Confident	12 Å²	12	46 Å²	46	7%	0.074	23%	0.231	C	C	.	.			trans	-113	-11	178.4	60.6	0	0	0	0	113.2	R187 Y191 K396 C397	R187-T189 PolarHBondContact O-N 3.02Å; T189-Y191 VanDerWaalsContact C-N 3.27Å; T189-Y191 WeakPolarHBondContact OG1-CB 3.39Å; T189-Y191 PolarHBondContact OG1-N 3.37Å; T189-K396 HydrophobicContact CG2-CB 4.25Å; T189-C397 PolarHBondContact OG1-SG 3.33Å; T189-C397 VanDerWaalsContact OG1-SG 3.37Å
190	G	83.2	Confident	87.1	Confident	17 Å²	17	47.9 Å²	47.9	18%	0.175	24%	0.238	C	C	.	.			trans	77.8	3.7	-170.6	0	0	0	0	0	114.9	K192	G190-K192 WeakPolarHBondContact O-CG 3.47Å; G190-K192 PolarHBondContact O-N 3.28Å
191	Y	84.3	Confident	87.2	Confident	52 Å²	52	49.8 Å²	49.8	20%	0.204	25%	0.248	C	C	.	.			trans	-65.7	117.1	173.2	-172.3	-117.5	0	0	0	110.4	T189 D195 A196 V392 C394	T189-Y191 VanDerWaalsContact C-N 3.27Å; T189-Y191 WeakPolarHBondContact OG1-CB 3.39Å; T189-Y191 PolarHBondContact OG1-N 3.37Å; Y191-D195 HydrophobicContact CE2-CB 4.21Å; Y191-D195 PolarHBondContact OH-O 3.45Å; Y191-A196 HydrophobicContact CD1-CB 3.85Å; Y191-A196 HydrophobicContact CE1-CB 3.56Å; Y191-V392 HydrophobicContact CE1-CG1 4.12Å; Y191-C394 HydrophobicContact CD2-CB 3.89Å; Y191-C394 HydrophobicContact CG-CB 3.89Å
192	K	85.1	Confident	87.3	Confident	155 Å²	155	51 Å²	51	67%	0.674	26%	0.256	S	S	*	.			trans	-160.2	176.9	-171.5	68.2	-175	178.6	176	0	111.3	G190	G190-K192 WeakPolarHBondContact O-CG 3.47Å; G190-K192 PolarHBondContact O-N 3.28Å
193	G	86.6	Confident	87.5	Confident	16 Å²	16	47.4 Å²	47.4	17%	0.165	24%	0.237	C	C	.	.	S	Bend	trans	80.5	-162.4	172.9	0	0	0	0	0	113.3	D195 A196 W197	G193-D195 PolarHBondContact O-N 3.07Å; G193-D195 VanDerWaalsContact O-N 3.13Å; G193-A196 PolarHBondContact O-N 3.13Å; G193-A196 VanDerWaalsContact O-N 3.12Å; G193-W197 VanDerWaalsContact O-CG 3.22Å; G193-W197 PolarHBondContact O-N 3.35Å
194	P	85.2	Confident	87.6	Confident	92 Å²	92	44 Å²	44	60%	0.597	22%	0.218	S	C	*	.	H	α-helix	trans	-53.9	-35.1	-172	-29	36.5	0	0	0	114.5	W197 K198	P194-W197 HydrophobicContact CG-CE3 4.39Å; P194-W197 HydrophobicContact CG-CZ3 4.36Å; P194-W197 PolarHBondContact O-N 3.3Å; P194-K198 VanDerWaalsContact O-CB 3.25Å; P194-K198 WeakPolarHBondContact O-CB 3.31Å; P194-K198 PolarHBondContact O-N 2.82Å
195	D	85.2	Confident	87.5	Confident	64 Å²	64	49.6 Å²	49.6	34%	0.342	24%	0.244	S	C	.	.	H	α-helix	trans	-67	-43.7	-179.1	-54.9	-41.1	0	0	0	111.9	S92 Y191 G193 I199	S92-D195 WeakPolarHBondContact CB-OD2 2.85Å; S92-D195 PolarHBondContact OG-OD1 2.73Å; S92-D195 PolarHBondContact OG-OD2 2.97Å; Y191-D195 HydrophobicContact CE2-CB 4.21Å; Y191-D195 PolarHBondContact OH-O 3.45Å; G193-D195 PolarHBondContact O-N 3.07Å; G193-D195 VanDerWaalsContact O-N 3.13Å; D195-I199 WeakPolarHBondContact O-CG1 3.28Å; D195-I199 PolarHBondContact O-N 3.36Å
196	A	87.1	Confident	87	Confident	11 Å²	11	49.7 Å²	49.7	9%	0.091	24%	0.241	C	C	.	.	H	α-helix	trans	-68.5	-41	175.1	0	0	0	0	0	111.6	Y191 G193 I199 W200	Y191-A196 HydrophobicContact CD1-CB 3.85Å; Y191-A196 HydrophobicContact CE1-CB 3.56Å; G193-A196 PolarHBondContact O-N 3.13Å; G193-A196 VanDerWaalsContact O-N 3.12Å; A196-I199 PolarHBondContact O-N 3.46Å; A196-W200 VanDerWaalsContact O-CD1 3.32Å; A196-W200 PolarHBondContact O-N 3.02Å; A196-W200 VanDerWaalsContact O-N 3.15Å
197	W	87.9	Confident	85.7	Confident	116 Å²	116	49.9 Å²	49.9	44%	0.439	24%	0.242	S	C	.	.	H	α-helix	trans	-64.5	-42.2	179.2	-58.1	-23.5	0	0	0	111.9	G193 P194 I199 W200 N201	G193-W197 VanDerWaalsContact O-CG 3.22Å; G193-W197 PolarHBondContact O-N 3.35Å; P194-W197 HydrophobicContact CG-CE3 4.39Å; P194-W197 HydrophobicContact CG-CZ3 4.36Å; P194-W197 PolarHBondContact O-N 3.3Å; W197-I199 PolarHBondContact O-N 2.85Å; W197-W200 PolarHBondContact O-N 3.48Å; W197-N201 WeakPolarHBondContact O-CB 3.48Å; W197-N201 PolarHBondContact O-N 2.92Å; W197-N201 PolarHBondContact O-ND2 2.84Å; W197-N201 PolarHBondContact O-OD1 3.32Å
198	K	88.8	Confident	84.2	Confident	84 Å²	84	50 Å²	50	37%	0.365	25%	0.252	S	S	.	.	H	α-helix	trans	-58.3	-47.9	176.3	-176.3	-179	-179.8	-174.7	0	111.2	W88 P194 W200 N201 V202	W88-K198 HydrophobicContact CH2-CD 4.38Å; W88-K198 HydrophobicContact CH2-CG 4.35Å; W88-K198 HydrophobicContact CZ2-CD 4.08Å; W88-K198 HydrophobicContact CZ2-CG 4.34Å; P194-K198 VanDerWaalsContact O-CB 3.25Å; P194-K198 WeakPolarHBondContact O-CB 3.31Å; P194-K198 PolarHBondContact O-N 2.82Å; K198-W200 PolarHBondContact O-N 3.05Å; K198-N201 PolarHBondContact O-N 2.65Å; K198-V202 WeakPolarHBondContact O-CG2 3.45Å; K198-V202 PolarHBondContact O-N 2.94Å
199	I	90.7	Very high	82.7	Confident	9 Å²	9	50.6 Å²	50.6	5%	0.046	26%	0.256	C	S	.	.	H	α-helix	trans	-57.3	-52.1	177.9	-67	-70.7	0	0	0	110.9	W88 D195 A196 W197 N201 V202 I203 I388 C391 V392	W88-I199 HydrophobicContact CH2-CD1 4.27Å; W88-I199 HydrophobicContact CZ2-CD1 3.71Å; D195-I199 WeakPolarHBondContact O-CG1 3.28Å; D195-I199 PolarHBondContact O-N 3.36Å; A196-I199 PolarHBondContact O-N 3.46Å; W197-I199 PolarHBondContact O-N 2.85Å; I199-N201 VanDerWaalsContact C-N 3.35Å; I199-N201 PolarHBondContact O-N 3.42Å; I199-V202 PolarHBondContact O-N 3.42Å; I199-I203 HydrophobicContact CG2-CD1 3.77Å; I199-I203 HydrophobicContact CG2-CG1 4.49Å; I199-I203 VanDerWaalsContact O-CG1 3.32Å; I199-I203 WeakPolarHBondContact O-CG1 3.26Å; I199-I203 PolarHBondContact O-N 3.03Å; I199-I388 HydrophobicContact CD1-CG2 4.12Å; I199-I388 HydrophobicContact CG2-CG2 4.13Å; I199-C391 HydrophobicContact CD1-CB 3.67Å; I199-V392 HydrophobicContact CD1-CG2 4.03Å; I199-V392 HydrophobicContact CG1-CG2 4.17Å; I199-V392 HydrophobicContact CG2-CG2 3.94Å
200	W	91.4	Very high	80.5	Confident	42 Å²	42	58 Å²	58	16%	0.159	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-43.4	180	-79.3	115.8	0	0	0	112.1	A196 W197 K198 V202 I203 Y204 I251 H255 I258	A196-W200 VanDerWaalsContact O-CD1 3.32Å; A196-W200 PolarHBondContact O-N 3.02Å; A196-W200 VanDerWaalsContact O-N 3.15Å; W197-W200 PolarHBondContact O-N 3.48Å; K198-W200 PolarHBondContact O-N 3.05Å; W200-V202 VanDerWaalsContact C-N 3.33Å; W200-V202 PolarHBondContact O-N 3.39Å; W200-I203 HydrophobicContact CE3-CB 4.49Å; W200-I203 HydrophobicContact CE3-CD1 4.07Å; W200-I203 HydrophobicContact CZ3-CD1 4.25Å; W200-I203 PolarHBondContact O-N 3.12Å; W200-I203 VanDerWaalsContact O-N 3.15Å; W200-Y204 HydrophobicContact CB-CD2 4.48Å; W200-Y204 HydrophobicContact CB-CE2 4.47Å; W200-Y204 HydrophobicContact CD2-CE2 4.47Å; W200-Y204 HydrophobicContact CE3-CD2 4.39Å; W200-Y204 AromaticContact CE3-CE2 3.76Å; W200-Y204 HydrophobicContact CE3-CE2 3.76Å; W200-Y204 HydrophobicContact CZ3-CE2 4.46Å; W200-Y204 WeakPolarHBondContact O-CD2 3.37Å; W200-Y204 PolarHBondContact O-N 3.13Å; W200-I251 HydrophobicContact CE3-CG2 4.43Å; W200-I251 HydrophobicContact CZ3-CG2 4Å; W200-H255 AromaticContact CD1-CE1 3.79Å; W200-H255 AromaticContact CD1-NE2 3.83Å; W200-H255 AromaticContact CD2-CE1 3.79Å; W200-H255 AromaticContact CD2-CG 3.89Å; W200-H255 AromaticContact CD2-ND1 3.67Å; W200-H255 AromaticContact CE2-CD2 3.47Å; W200-H255 VanDerWaalsContact CE2-CD2 3.47Å; W200-H255 AromaticContact CE2-CE1 3.84Å; W200-H255 AromaticContact CE2-CG 3.66Å; W200-H255 AromaticContact CE2-ND1 3.86Å; W200-H255 AromaticContact CE2-NE2 3.66Å; W200-H255 HydrophobicContact CE3-CB 4.2Å; W200-H255 AromaticContact CE3-ND1 3.89Å; W200-H255 AromaticContact CG-CE1 3.77Å; W200-H255 HydrophobicContact CH2-CB 3.52Å; W200-H255 AromaticContact CH2-CG 3.79Å; W200-H255 HydrophobicContact CZ2-CB 3.85Å; W200-H255 AromaticContact CZ2-CD2 3.49Å; W200-H255 VanDerWaalsContact CZ2-CD2 3.49Å; W200-H255 WeakPolarHBondContact CZ2-CD2 3.44Å; W200-H255 AromaticContact CZ2-CG 3.62Å; W200-H255 HydrophobicContact CZ3-CB 3.71Å; W200-H255 AromaticContact CZ3-CG 3.99Å; W200-H255 AromaticContact NE1-CD2 3.71Å; W200-H255 AromaticContact NE1-CE1 3.8Å; W200-H255 AromaticContact NE1-NE2 3.46Å; W200-H255 PolarHBondContact NE1-NE2 3.39Å; W200-I258 HydrophobicContact CH2-CD1 3.87Å; W200-I258 HydrophobicContact CZ2-CD1 3.75Å
201	N	86.9	Confident	78.6	Confident	47 Å²	47	63 Å²	63	25%	0.251	32%	0.316	S	S	.	.	H	α-helix	trans	-55.9	-48.9	178	-71	-14.1	0	0	0	111.2	W197 K198 I199 I203 Y204 E205	W197-N201 WeakPolarHBondContact O-CB 3.48Å; W197-N201 PolarHBondContact O-N 2.92Å; W197-N201 PolarHBondContact O-ND2 2.84Å; W197-N201 PolarHBondContact O-OD1 3.32Å; K198-N201 PolarHBondContact O-N 2.65Å; I199-N201 VanDerWaalsContact C-N 3.35Å; I199-N201 PolarHBondContact O-N 3.42Å; N201-I203 VanDerWaalsContact C-N 3.34Å; N201-I203 PolarHBondContact O-N 2.81Å; N201-Y204 PolarHBondContact O-N 3.5Å; N201-E205 WeakPolarHBondContact O-CB 3.28Å; N201-E205 WeakPolarHBondContact O-CG 3.28Å; N201-E205 PolarHBondContact O-N 3.07Å
202	V	89.1	Confident	76.6	Confident	32 Å²	32	68.5 Å²	68.5	19%	0.194	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-40.8	178.3	-179.2	0	0	0	0	111.3	W88 K198 I199 W200 Y204 E205 E206 I388	W88-V202 HydrophobicContact CH2-CG2 4.12Å; W88-V202 HydrophobicContact CZ3-CG2 4.26Å; K198-V202 WeakPolarHBondContact O-CG2 3.45Å; K198-V202 PolarHBondContact O-N 2.94Å; I199-V202 PolarHBondContact O-N 3.42Å; W200-V202 VanDerWaalsContact C-N 3.33Å; W200-V202 PolarHBondContact O-N 3.39Å; V202-Y204 PolarHBondContact O-N 3.37Å; V202-E205 PolarHBondContact O-N 2.93Å; V202-E206 PolarHBondContact O-N 3.29Å; V202-I388 HydrophobicContact CB-CD1 4.45Å; V202-I388 HydrophobicContact CG1-CD1 3.57Å; V202-I388 HydrophobicContact CG1-CG1 3.95Å
203	I	88.9	Confident	74.7	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.015	34%	0.343	C	S	.	.	H	α-helix	trans	-61.8	-41.6	176.2	-66	168.8	0	0	0	111.6	I199 W200 N201 E206 I251 I385 I388 M389	I199-I203 HydrophobicContact CG2-CD1 3.77Å; I199-I203 HydrophobicContact CG2-CG1 4.49Å; I199-I203 VanDerWaalsContact O-CG1 3.32Å; I199-I203 WeakPolarHBondContact O-CG1 3.26Å; I199-I203 PolarHBondContact O-N 3.03Å; W200-I203 HydrophobicContact CE3-CB 4.49Å; W200-I203 HydrophobicContact CE3-CD1 4.07Å; W200-I203 HydrophobicContact CZ3-CD1 4.25Å; W200-I203 PolarHBondContact O-N 3.12Å; W200-I203 VanDerWaalsContact O-N 3.15Å; N201-I203 VanDerWaalsContact C-N 3.34Å; N201-I203 PolarHBondContact O-N 2.81Å; I203-E206 WeakPolarHBondContact O-CB 3.46Å; I203-E206 PolarHBondContact O-N 2.83Å; I203-I251 HydrophobicContact CG2-CD1 4.28Å; I203-I251 HydrophobicContact CG2-CG1 4.42Å; I203-I251 HydrophobicContact CG2-CG2 3.63Å; I203-I385 HydrophobicContact CG1-CG2 4.4Å; I203-I385 HydrophobicContact CG2-CD1 4.27Å; I203-I385 HydrophobicContact CG2-CG1 4.21Å; I203-I385 HydrophobicContact CG2-CG2 4.43Å; I203-I388 HydrophobicContact CD1-CG2 4.35Å; I203-I388 HydrophobicContact CG1-CB 4.47Å; I203-I388 HydrophobicContact CG1-CD1 4.3Å; I203-I388 HydrophobicContact CG1-CG2 3.87Å; I203-M389 HydrophobicContact CD1-CE 3.8Å
204	Y	84.9	Confident	72.9	Confident	21 Å²	21	68.9 Å²	68.9	8%	0.082	35%	0.353	C	S	.	.	H	α-helix	trans	-74.2	-30	177.4	-76.9	-77.2	0	0	0	112.5	W200 N201 V202 E206 N207 Y248 I251 S252 H255	W200-Y204 HydrophobicContact CB-CD2 4.48Å; W200-Y204 HydrophobicContact CB-CE2 4.47Å; W200-Y204 HydrophobicContact CD2-CE2 4.47Å; W200-Y204 HydrophobicContact CE3-CD2 4.39Å; W200-Y204 AromaticContact CE3-CE2 3.76Å; W200-Y204 HydrophobicContact CE3-CE2 3.76Å; W200-Y204 HydrophobicContact CZ3-CE2 4.46Å; W200-Y204 WeakPolarHBondContact O-CD2 3.37Å; W200-Y204 PolarHBondContact O-N 3.13Å; N201-Y204 PolarHBondContact O-N 3.5Å; V202-Y204 PolarHBondContact O-N 3.37Å; Y204-E206 PolarHBondContact O-N 3.03Å; Y204-N207 WeakPolarHBondContact O-CB 3.25Å; Y204-N207 PolarHBondContact O-N 3.29Å; Y204-N207 VanDerWaalsContact O-N 3.15Å; Y204-Y248 AromaticContact CD1-CD2 3.85Å; Y204-Y248 HydrophobicContact CD1-CD2 3.85Å; Y204-Y248 HydrophobicContact CD1-CE2 4.08Å; Y204-Y248 AromaticContact CE1-CD2 3.83Å; Y204-Y248 HydrophobicContact CE1-CD2 3.83Å; Y204-Y248 AromaticContact CE1-CE2 3.84Å; Y204-Y248 HydrophobicContact CE1-CE2 3.84Å; Y204-I251 HydrophobicContact CD1-CB 4.4Å; Y204-I251 HydrophobicContact CD1-CG2 3.96Å; Y204-I251 HydrophobicContact CD2-CG2 4.38Å; Y204-I251 HydrophobicContact CE1-CB 3.9Å; Y204-I251 HydrophobicContact CE1-CG2 3.52Å; Y204-I251 HydrophobicContact CE2-CG2 3.93Å; Y204-I251 HydrophobicContact CG-CG2 4.39Å; Y204-I251 PolarHBondContact OH-O 2.86Å; Y204-S252 VanDerWaalsContact OH-CA 3.25Å; Y204-S252 WeakPolarHBondContact OH-CA 3.24Å; Y204-S252 PolarHBondContact OH-N 3.35Å; Y204-H255 AromaticContact CE2-ND1 3.93Å
205	E	83.2	Confident	71.2	Confident	121 Å²	121	73.2 Å²	73.2	57%	0.565	36%	0.362	S	S	*	.	H	α-helix	trans	-69.7	-20.1	174.5	-74.3	167.1	-171.1	0	0	112.4	N201 V202 N207 C208	N201-E205 WeakPolarHBondContact O-CB 3.28Å; N201-E205 WeakPolarHBondContact O-CG 3.28Å; N201-E205 PolarHBondContact O-N 3.07Å; V202-E205 PolarHBondContact O-N 2.93Å; E205-N207 PolarHBondContact O-N 3.2Å; E205-N207 VanDerWaalsContact O-N 3.09Å; E205-C208 WeakPolarHBondContact O-CB 3.4Å; E205-C208 PolarHBondContact O-N 2.9Å; E205-C208 PolarHBondContact O-SG 3.43Å
206	E	79.8	Confident	69.6	Low	38 Å²	38	73 Å²	73	18%	0.178	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.9	167.6	-74.5	-65.7	138.5	0	0	112.6	V202 I203 Y204 C208 F247 H381 N384 I388	V202-E206 PolarHBondContact O-N 3.29Å; I203-E206 WeakPolarHBondContact O-CB 3.46Å; I203-E206 PolarHBondContact O-N 2.83Å; Y204-E206 PolarHBondContact O-N 3.03Å; E206-C208 PolarHBondContact O-N 3.32Å; E206-F247 HydrophobicContact CB-CZ 4.25Å; E206-H381 PolarHBondContact O-CE1 3.47Å; E206-H381 PolarHBondContact O-ND1 2.93Å; E206-H381 IonicContact OE2-ND1 2.72Å; E206-H381 PolarHBondContact OE2-ND1 3.32Å; E206-N384 HydrophobicContact CG-CB 4.37Å; E206-N384 WeakPolarHBondContact OE2-CB 3.46Å; E206-N384 PolarHBondContact OE2-ND2 3.03Å; E206-I388 HydrophobicContact CG-CD1 3.9Å
207	N	67	Low	68	Low	19 Å²	19	75.1 Å²	75.1	10%	0.102	37%	0.369	C	S	.	.			trans	-70.8	31.6	173.8	-160.2	-0.3	0	0	0	113.7	Y204 E205 F209 K244 F247	Y204-N207 WeakPolarHBondContact O-CB 3.25Å; Y204-N207 PolarHBondContact O-N 3.29Å; Y204-N207 VanDerWaalsContact O-N 3.15Å; E205-N207 PolarHBondContact O-N 3.2Å; E205-N207 VanDerWaalsContact O-N 3.09Å; N207-F209 PolarHBondContact O-N 2.7Å; N207-F209 VanDerWaalsContact OD1-CE2 3.29Å; N207-F209 WeakPolarHBondContact OD1-CE2 3.25Å; N207-K244 PolarHBondContact ND2-O 3.48Å; N207-F247 HydrophobicContact CB-CD1 3.64Å; N207-F247 HydrophobicContact CB-CE1 3.82Å
208	C	59	Low	66.3	Low	67 Å²	67	75.2 Å²	75.2	45%	0.453	38%	0.378	S	S	.	.			trans	-97.2	70.2	-174.7	-82.7	0	0	0	0	112.9	E205 E206 K210	E205-C208 WeakPolarHBondContact O-CB 3.4Å; E205-C208 PolarHBondContact O-N 2.9Å; E205-C208 PolarHBondContact O-SG 3.43Å; E206-C208 PolarHBondContact O-N 3.32Å; C208-K210 VanDerWaalsContact C-N 3.27Å; C208-K210 PolarHBondContact O-N 3.05Å
209	F	57.2	Low	64.2	Low	45 Å²	45	74 Å²	74	20%	0.197	38%	0.375	C	S	.	.	S	Bend	trans	-84.3	17.1	171	-39.6	-104	0	0	0	114.4	N207 K244 D377 H381	N207-F209 PolarHBondContact O-N 2.7Å; N207-F209 VanDerWaalsContact OD1-CE2 3.29Å; N207-F209 WeakPolarHBondContact OD1-CE2 3.25Å; F209-K244 VanDerWaalsContact CB-CE 3.46Å; F209-K244 HydrophobicContact CD2-CD 4.27Å; F209-K244 HydrophobicContact CD2-CG 3.75Å; F209-K244 HydrophobicContact CE2-CG 4.24Å; F209-D377 HydrophobicContact CD1-CB 4.24Å; F209-D377 HydrophobicContact CE1-CB 3.8Å; F209-H381 AromaticContact CD1-NE2 3.53Å; F209-H381 AromaticContact CE1-CD2 3.26Å; F209-H381 WeakPolarHBondContact CE1-CD2 3.28Å; F209-H381 AromaticContact CE1-NE2 2.92Å; F209-H381 WeakPolarHBondContact CE1-NE2 3.34Å; F209-H381 AromaticContact CE2-NE2 3.96Å; F209-H381 AromaticContact CZ-CD2 3.24Å; F209-H381 WeakPolarHBondContact CZ-CD2 3.44Å; F209-H381 AromaticContact CZ-NE2 3.22Å; F209-H381 WeakPolarHBondContact CZ-NE2 3.4Å
210	K	39.8	Very low	62	Low	168 Å²	168	76.2 Å²	76.2	73%	0.73	39%	0.39	S	S	*	.	S	Bend	trans	176.4	163	166.6	-103.4	176.3	-165.4	-174.8	0	112.3	C208 Q212	C208-K210 VanDerWaalsContact C-N 3.27Å; C208-K210 PolarHBondContact O-N 3.05Å; K210-Q212 PolarHBondContact O-N 3.11Å
211	P	42.3	Very low	59.5	Low	121 Å²	121	79.7 Å²	79.7	79%	0.786	41%	0.411	S	S	*	.	S	Bend	trans	-86.6	12.1	-147.2	34.4	-38.5	0	0	0	118.9
212	Q	42.9	Very low	57.6	Low	167 Å²	167	80.6 Å²	80.6	78%	0.78	43%	0.425	S	S	*	.			trans	-104.3	97.9	176.9	-69.7	-164.9	2.5	0	0	110.9	K210	K210-Q212 PolarHBondContact O-N 3.11Å
213	T	44.3	Very low	55.5	Low	107 Å²	107	84.4 Å²	84.4	66%	0.656	45%	0.454	S	S	*	.			trans	-86.4	105.8	178	52.8	0	0	0	0	110.2
214	I	49.6	Very low	53.5	Low	73 Å²	73	87.7 Å²	87.7	37%	0.374	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-82.6	131.7	164	-59.8	-176.5	0	0	0	107.6	R216 W236	I214-R216 PolarHBondContact O-N 3.07Å; I214-W236 HydrophobicContact CD1-CB 3.91Å; I214-W236 HydrophobicContact CD1-CD2 4.09Å; I214-W236 HydrophobicContact CD1-CG 3.53Å; I214-W236 HydrophobicContact CG1-CG 4.46Å
215	K	48.8	Very low	51.3	Low	182 Å²	182	96.1 Å²	96.1	79%	0.791	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-68.1	129.4	179.3	-68.1	-176.3	178.9	-179.4	0	109.9
216	R	51.6	Low	49.5	Very low	61 Å²	61	92 Å²	92	23%	0.23	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-67.2	145.8	173.4	-170.9	-177.9	-176.2	-173.2	6.9	110.2	I214 L218 F233	I214-R216 PolarHBondContact O-N 3.07Å; R216-L218 WeakPolarHBondContact O-CG 3.32Å; R216-L218 PolarHBondContact O-N 3.46Å; R216-L218 VanDerWaalsContact O-N 3.11Å; R216-F233 HydrophobicContact CB-CE2 4.49Å; R216-F233 HydrophobicContact CG-CE2 4.44Å; R216-F233 HydrophobicContact CG-CZ 4.34Å
217	P	54.4	Low	47.9	Very low	54 Å²	54	98.4 Å²	98.4	35%	0.351	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-54.9	118.5	168.4	-20.7	29.6	0	0	0	110.1	N219 E230	P217-N219 PolarHBondContact O-N 2.95Å; P217-E230 HydrophobicContact CB-CG 4.27Å; P217-E230 HydrophobicContact CG-CG 3.8Å
218	L	50.7	Low	47	Very low	119 Å²	119	101.6 Å²	101.6	62%	0.623	57%	0.569	S	S	*	*			trans	-86	6.8	-153	-100.9	156.1	0	0	0	115.8	R216	R216-L218 WeakPolarHBondContact O-CG 3.32Å; R216-L218 PolarHBondContact O-N 3.46Å; R216-L218 VanDerWaalsContact O-N 3.11Å
219	N	46.6	Very low	46.5	Very low	57 Å²	57	105.2 Å²	105.2	31%	0.305	58%	0.579	S	S	.	*			trans	-160.3	125.9	-176.2	-154.1	-12.3	0	0	0	113.4	P217 L221 A222	P217-N219 PolarHBondContact O-N 2.95Å; N219-L221 PolarHBondContact O-N 3.31Å; N219-L221 VanDerWaalsContact O-N 3.13Å; N219-L221 PolarHBondContact OD1-N 2.92Å; N219-A222 HydrophobicContact CB-CB 3.52Å
220	P	42.9	Very low	46.3	Very low	57 Å²	57	106 Å²	106	37%	0.37	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.4	-11.5	169.7	-19	30.3	0	0	0	114.4
221	L	39.8	Very low	47	Very low	114 Å²	114	103.6 Å²	103.6	60%	0.597	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	1	-173.6	-67.9	167.9	0	0	0	114.1	N219 S223	N219-L221 PolarHBondContact O-N 3.31Å; N219-L221 VanDerWaalsContact O-N 3.13Å; N219-L221 PolarHBondContact OD1-N 2.92Å; L221-S223 PolarHBondContact O-N 2.84Å
222	A	46.3	Very low	47.7	Very low	67 Å²	67	101.6 Å²	101.6	55%	0.554	57%	0.565	S	S	*	*			trans	-91.5	89.8	177.3	0	0	0	0	0	110.2	N219 G224	N219-A222 HydrophobicContact CB-CB 3.52Å; A222-G224 PolarHBondContact O-N 3.41Å
223	S	46.4	Very low	48.9	Very low	112 Å²	112	94.3 Å²	94.3	78%	0.783	53%	0.53	S	S	*	.			trans	-64.8	113.8	160	-32.3	0	0	0	0	107.8	L221	L221-S223 PolarHBondContact O-N 2.84Å
224	G	45.3	Very low	49.8	Very low	72 Å²	72	90.8 Å²	90.8	74%	0.742	51%	0.505	S	S	*	.			trans	140	9.2	153.6	0	0	0	0	0	121.7	A222	A222-G224 PolarHBondContact O-N 3.41Å
225	Q	40.2	Very low	50.2	Low	197 Å²	197	91.2 Å²	91.2	92%	0.921	51%	0.514	S	S	*	.	S	Bend	trans	-134.2	103	173.4	-101.8	175.2	-19.4	0	0	113.7
226	G	43.9	Very low	51	Low	34 Å²	34	86.1 Å²	86.1	35%	0.351	49%	0.49	S	S	.	.			trans	100.7	71	151.1	0	0	0	0	0	117.9	S228 E229	G226-S228 PolarHBondContact O-N 2.82Å; G226-E229 PolarHBondContact O-N 3.37Å
227	K	46.2	Very low	51.3	Low	174 Å²	174	83.8 Å²	83.8	76%	0.757	48%	0.482	S	S	*	.	H	α-helix	trans	-51.6	-21.3	168.4	-70.8	-174.6	175.6	-176.2	0	114.5
228	S	48.3	Very low	51.5	Low	86 Å²	86	87.5 Å²	87.5	60%	0.601	50%	0.495	S	S	*	.	H	α-helix	trans	-78.3	-31	176.2	55.6	0	0	0	0	113.4	G226 T232	G226-S228 PolarHBondContact O-N 2.82Å; S228-T232 WeakPolarHBondContact O-CB 3.42Å; S228-T232 PolarHBondContact O-OG1 3.41Å
229	E	49.5	Very low	51.5	Low	142 Å²	142	85.1 Å²	85.1	66%	0.664	50%	0.499	S	S	*	.	H	α-helix	trans	-81.6	-32.7	-174.8	-67.6	-175	171.4	0	0	112.3	G226 T232 F233	G226-E229 PolarHBondContact O-N 3.37Å; E229-T232 WeakPolarHBondContact O-CB 3.33Å; E229-T232 PolarHBondContact O-N 3.33Å; E229-F233 PolarHBondContact O-N 3.47Å
230	E	52	Low	52.1	Low	63 Å²	63	83.5 Å²	83.5	29%	0.294	49%	0.49	S	S	.	.	H	α-helix	trans	-68.7	-47	179.7	-72.7	-177.6	158.2	0	0	113.5	P217 T232 F233 Y234	P217-E230 HydrophobicContact CB-CG 4.27Å; P217-E230 HydrophobicContact CG-CG 3.8Å; E230-T232 PolarHBondContact O-N 3.22Å; E230-F233 PolarHBondContact O-N 2.74Å; E230-Y234 WeakPolarHBondContact O-CD2 3.34Å; E230-Y234 PolarHBondContact O-N 3.09Å; E230-Y234 VanDerWaalsContact O-N 3.17Å
231	N	54.8	Low	52.8	Low	116 Å²	116	84.4 Å²	84.4	62%	0.62	50%	0.497	S	S	*	.	H	α-helix	trans	-62.3	-30.9	173.3	-79.2	-17.7	0	0	0	111.5	S235	N231-S235 WeakPolarHBondContact O-CB 3.26Å; N231-S235 PolarHBondContact O-N 2.91Å
232	T	58.1	Low	53.9	Low	80 Å²	80	82 Å²	82	49%	0.491	49%	0.487	S	S	.	.	H	α-helix	trans	-70.7	-37.9	176	-52.5	0	0	0	0	111.5	S228 E229 E230 W236	S228-T232 WeakPolarHBondContact O-CB 3.42Å; S228-T232 PolarHBondContact O-OG1 3.41Å; E229-T232 WeakPolarHBondContact O-CB 3.33Å; E229-T232 PolarHBondContact O-N 3.33Å; E230-T232 PolarHBondContact O-N 3.22Å; T232-W236 WeakPolarHBondContact O-CB 3.37Å; T232-W236 PolarHBondContact O-N 2.95Å
233	F	66.2	Low	54.5	Low	13 Å²	13	81.7 Å²	81.7	6%	0.057	47%	0.474	C	S	.	.	H	α-helix	trans	-65.2	-45.9	176.2	176.8	-99.3	0	0	0	112.4	R216 E229 E230 W236 L237 Y248	R216-F233 HydrophobicContact CB-CE2 4.49Å; R216-F233 HydrophobicContact CG-CE2 4.44Å; R216-F233 HydrophobicContact CG-CZ 4.34Å; E229-F233 PolarHBondContact O-N 3.47Å; E230-F233 PolarHBondContact O-N 2.74Å; F233-W236 HydrophobicContact CD2-CE3 4.13Å; F233-W236 HydrophobicContact CD2-CZ3 4.35Å; F233-W236 HydrophobicContact CE2-CE3 4.05Å; F233-W236 AromaticContact CE2-CZ3 3.84Å; F233-W236 HydrophobicContact CE2-CZ3 3.84Å; F233-W236 WeakPolarHBondContact O-CB 3.43Å; F233-W236 PolarHBondContact O-N 3.09Å; F233-L237 HydrophobicContact CZ-CD1 4.43Å; F233-L237 WeakPolarHBondContact O-CB 3.15Å; F233-L237 PolarHBondContact O-N 3.14Å; F233-Y248 HydrophobicContact CE1-CE2 4.4Å; F233-Y248 HydrophobicContact CZ-CE2 4.22Å
234	Y	63.8	Low	55.5	Low	34 Å²	34	77.8 Å²	77.8	13%	0.133	44%	0.443	C	S	.	.	H	α-helix	trans	-72	-38.9	179.9	-75.8	-70	0	0	0	112.6	E230 W236 L237 E238 E296 R299	E230-Y234 WeakPolarHBondContact O-CD2 3.34Å; E230-Y234 PolarHBondContact O-N 3.09Å; E230-Y234 VanDerWaalsContact O-N 3.17Å; Y234-W236 VanDerWaalsContact C-N 3.29Å; Y234-W236 PolarHBondContact O-N 2.81Å; Y234-L237 HydrophobicContact CD1-CD2 4.23Å; Y234-L237 HydrophobicContact CE1-CD2 4.47Å; Y234-L237 WeakPolarHBondContact O-CB 3.33Å; Y234-L237 PolarHBondContact O-N 2.83Å; Y234-E238 WeakPolarHBondContact O-CB 3.32Å; Y234-E238 WeakPolarHBondContact O-CG 3.33Å; Y234-E238 PolarHBondContact O-N 2.84Å; Y234-E296 WeakPolarHBondContact CE2-OE1 3.37Å; Y234-E296 PolarHBondContact OH-OE1 3.47Å; Y234-E296 PolarHBondContact OH-OE2 3.39Å; Y234-R299 VanDerWaalsContact CE2-NH1 3.34Å
235	S	58.9	Low	56.7	Low	81 Å²	81	77.1 Å²	77.1	57%	0.566	42%	0.418	S	S	*	.	H	α-helix	trans	-61.5	-38.1	170.4	179.7	0	0	0	0	111.9	N231 E238 G239	N231-S235 WeakPolarHBondContact O-CB 3.26Å; N231-S235 PolarHBondContact O-N 2.91Å; S235-E238 PolarHBondContact O-N 3.39Å; S235-G239 PolarHBondContact O-N 2.76Å
236	W	64.4	Low	58.5	Low	75 Å²	75	68.1 Å²	68.1	28%	0.284	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-45.4	171.5	172.4	84.7	0	0	0	112.1	I214 T232 F233 Y234 E238 G239 L240	I214-W236 HydrophobicContact CD1-CB 3.91Å; I214-W236 HydrophobicContact CD1-CD2 4.09Å; I214-W236 HydrophobicContact CD1-CG 3.53Å; I214-W236 HydrophobicContact CG1-CG 4.46Å; T232-W236 WeakPolarHBondContact O-CB 3.37Å; T232-W236 PolarHBondContact O-N 2.95Å; F233-W236 HydrophobicContact CD2-CE3 4.13Å; F233-W236 HydrophobicContact CD2-CZ3 4.35Å; F233-W236 HydrophobicContact CE2-CE3 4.05Å; F233-W236 AromaticContact CE2-CZ3 3.84Å; F233-W236 HydrophobicContact CE2-CZ3 3.84Å; F233-W236 WeakPolarHBondContact O-CB 3.43Å; F233-W236 PolarHBondContact O-N 3.09Å; Y234-W236 VanDerWaalsContact C-N 3.29Å; Y234-W236 PolarHBondContact O-N 2.81Å; W236-E238 VanDerWaalsContact C-N 3.27Å; W236-E238 PolarHBondContact O-N 3.34Å; W236-G239 CarbonylContact O-C 3.59Å; W236-G239 WeakPolarHBondContact O-CA 3.41Å; W236-G239 PolarHBondContact O-N 3.32Å; W236-L240 HydrophobicContact CD2-CD1 4.39Å; W236-L240 HydrophobicContact CD2-CD2 4.27Å; W236-L240 HydrophobicContact CD2-CG 4.32Å; W236-L240 HydrophobicContact CE3-CD1 4.06Å; W236-L240 HydrophobicContact CE3-CG 4.42Å; W236-L240 HydrophobicContact CH2-CD1 3.69Å; W236-L240 HydrophobicContact CH2-CD2 4.3Å; W236-L240 HydrophobicContact CH2-CG 4.44Å; W236-L240 HydrophobicContact CZ2-CD1 4.04Å; W236-L240 HydrophobicContact CZ2-CD2 3.77Å; W236-L240 HydrophobicContact CZ2-CG 4.34Å; W236-L240 HydrophobicContact CZ3-CD1 3.69Å; W236-L240 HydrophobicContact CZ3-CG 4.48Å; W236-L240 WeakPolarHBondContact O-CG 3.29Å; W236-L240 PolarHBondContact O-N 3.45Å; W236-L240 VanDerWaalsContact O-N 3.09Å
237	L	59.3	Low	60.3	Low	13 Å²	13	66.5 Å²	66.5	7%	0.068	36%	0.361	C	S	.	.	H	α-helix	trans	-60.7	-37	177.4	-168	83.6	0	0	0	111.6	F233 Y234 G239 L240 R245 Y248	F233-L237 HydrophobicContact CZ-CD1 4.43Å; F233-L237 WeakPolarHBondContact O-CB 3.15Å; F233-L237 PolarHBondContact O-N 3.14Å; Y234-L237 HydrophobicContact CD1-CD2 4.23Å; Y234-L237 HydrophobicContact CE1-CD2 4.47Å; Y234-L237 WeakPolarHBondContact O-CB 3.33Å; Y234-L237 PolarHBondContact O-N 2.83Å; L237-G239 VanDerWaalsContact C-N 3.35Å; L237-L240 HydrophobicContact CD1-CD1 4.13Å; L237-L240 PolarHBondContact O-N 3.27Å; L237-R245 HydrophobicContact CD2-CG 4.43Å; L237-R245 HydrophobicContact CG-CG 4.38Å; L237-R245 PolarHBondContact O-NE 2.72Å; L237-Y248 HydrophobicContact CD1-CD1 4.05Å; L237-Y248 HydrophobicContact CD1-CD2 4.5Å; L237-Y248 HydrophobicContact CD1-CG 3.94Å; L237-Y248 HydrophobicContact CD2-CD1 3.68Å; L237-Y248 HydrophobicContact CD2-CE1 3.85Å; L237-Y248 HydrophobicContact CD2-CG 4.41Å
238	E	58.3	Low	62.2	Low	132 Å²	132	58.7 Å²	58.7	62%	0.617	33%	0.326	S	S	*	.	H	α-helix	trans	-68.8	-33.4	172.2	-76	175.2	-170.6	0	0	112.1	Y234 S235 W236 L240 R245	Y234-E238 WeakPolarHBondContact O-CB 3.32Å; Y234-E238 WeakPolarHBondContact O-CG 3.33Å; Y234-E238 PolarHBondContact O-N 2.84Å; S235-E238 PolarHBondContact O-N 3.39Å; W236-E238 VanDerWaalsContact C-N 3.27Å; W236-E238 PolarHBondContact O-N 3.34Å; E238-L240 VanDerWaalsContact C-N 3.28Å; E238-L240 PolarHBondContact O-N 3.07Å; E238-R245 VanDerWaalsContact CA-NH2 3.33Å; E238-R245 PolarHBondContact O-NH2 3.49Å
239	G	50.2	Low	64.1	Low	68 Å²	68	55.5 Å²	55.5	70%	0.701	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-4.4	173.5	0	0	0	0	0	115.4	S235 W236 L237	S235-G239 PolarHBondContact O-N 2.76Å; W236-G239 CarbonylContact O-C 3.59Å; W236-G239 WeakPolarHBondContact O-CA 3.41Å; W236-G239 PolarHBondContact O-N 3.32Å; L237-G239 VanDerWaalsContact C-N 3.35Å
240	L	58.6	Low	66	Low	24 Å²	24	48.9 Å²	48.9	13%	0.126	27%	0.271	C	S	.	.	S	Bend	trans	-80.7	156.9	174	-63.5	-178.2	0	0	0	112.2	W236 L237 E238 K244	W236-L240 HydrophobicContact CD2-CD1 4.39Å; W236-L240 HydrophobicContact CD2-CD2 4.27Å; W236-L240 HydrophobicContact CD2-CG 4.32Å; W236-L240 HydrophobicContact CE3-CD1 4.06Å; W236-L240 HydrophobicContact CE3-CG 4.42Å; W236-L240 HydrophobicContact CH2-CD1 3.69Å; W236-L240 HydrophobicContact CH2-CD2 4.3Å; W236-L240 HydrophobicContact CH2-CG 4.44Å; W236-L240 HydrophobicContact CZ2-CD1 4.04Å; W236-L240 HydrophobicContact CZ2-CD2 3.77Å; W236-L240 HydrophobicContact CZ2-CG 4.34Å; W236-L240 HydrophobicContact CZ3-CD1 3.69Å; W236-L240 HydrophobicContact CZ3-CG 4.48Å; W236-L240 WeakPolarHBondContact O-CG 3.29Å; W236-L240 PolarHBondContact O-N 3.45Å; W236-L240 VanDerWaalsContact O-N 3.09Å; L237-L240 HydrophobicContact CD1-CD1 4.13Å; L237-L240 PolarHBondContact O-N 3.27Å; E238-L240 VanDerWaalsContact C-N 3.28Å; E238-L240 PolarHBondContact O-N 3.07Å; L240-K244 HydrophobicContact CB-CB 3.96Å; L240-K244 HydrophobicContact CB-CD 4.04Å; L240-K244 HydrophobicContact CD1-CB 3.87Å; L240-K244 HydrophobicContact CD1-CD 4.09Å; L240-K244 HydrophobicContact CD2-CD 3.95Å; L240-K244 HydrophobicContact CG-CB 4.49Å; L240-K244 HydrophobicContact CG-CD 4.25Å
241	C	59.1	Low	68	Low	76 Å²	76	46 Å²	46	51%	0.514	26%	0.257	S	S	.	.			trans	-55.3	146.4	168.3	-47.4	0	0	0	0	110.7	E243 K244 R245	C241-E243 WeakPolarHBondContact CB-OE2 3.46Å; C241-E243 PolarHBondContact O-N 3.48Å; C241-K244 WeakPolarHBondContact O-CB 3.1Å; C241-K244 PolarHBondContact O-N 3.2Å; C241-R245 PolarHBondContact O-N 3.09Å
242	V	61.9	Low	69.9	Low	64 Å²	64	40.5 Å²	40.5	39%	0.388	23%	0.228	S	C	.	.	H	α-helix	trans	-53	-33.4	-173.5	-68	0	0	0	0	113.1	R245 A246	V242-R245 PolarHBondContact O-N 3.35Å; V242-A246 PolarHBondContact O-N 3.29Å
243	E	60.2	Low	71.7	Confident	60 Å²	60	36.7 Å²	36.7	28%	0.28	21%	0.205	S	C	.	.	H	α-helix	trans	-70.9	-35.3	-177.7	-50	88	165.7	0	0	112.9	C241 R245 A246 F247 L374	C241-E243 WeakPolarHBondContact CB-OE2 3.46Å; C241-E243 PolarHBondContact O-N 3.48Å; E243-R245 VanDerWaalsContact C-N 3.35Å; E243-A246 WeakPolarHBondContact O-CB 3.44Å; E243-A246 PolarHBondContact O-N 2.94Å; E243-F247 PolarHBondContact O-N 3.31Å; E243-L374 HydrophobicContact CB-CD1 3.57Å; E243-L374 HydrophobicContact CB-CD2 4.16Å; E243-L374 HydrophobicContact CB-CG 4.46Å; E243-L374 HydrophobicContact CG-CD1 3.56Å; E243-L374 HydrophobicContact CG-CD2 3.39Å; E243-L374 HydrophobicContact CG-CG 4.06Å
244	K	65.9	Low	73.2	Confident	30 Å²	30	36.3 Å²	36.3	13%	0.13	20%	0.203	C	C	.	.	H	α-helix	trans	-69.7	-37.6	177	-62.6	-172.3	167.3	-174.8	0	111.7	N207 F209 L240 C241 A246 Y248	N207-K244 PolarHBondContact ND2-O 3.48Å; F209-K244 VanDerWaalsContact CB-CE 3.46Å; F209-K244 HydrophobicContact CD2-CD 4.27Å; F209-K244 HydrophobicContact CD2-CG 3.75Å; F209-K244 HydrophobicContact CE2-CG 4.24Å; L240-K244 HydrophobicContact CB-CB 3.96Å; L240-K244 HydrophobicContact CB-CD 4.04Å; L240-K244 HydrophobicContact CD1-CB 3.87Å; L240-K244 HydrophobicContact CD1-CD 4.09Å; L240-K244 HydrophobicContact CD2-CD 3.95Å; L240-K244 HydrophobicContact CG-CB 4.49Å; L240-K244 HydrophobicContact CG-CD 4.25Å; C241-K244 WeakPolarHBondContact O-CB 3.1Å; C241-K244 PolarHBondContact O-N 3.2Å; K244-A246 VanDerWaalsContact C-N 3.33Å; K244-Y248 PolarHBondContact O-N 3.31Å; K244-Y248 VanDerWaalsContact O-N 3.15Å
245	R	71.4	Confident	74.8	Confident	58 Å²	58	36.2 Å²	36.2	22%	0.219	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-42	173.6	-165.2	-174.6	-57.8	167.8	6.6	109.7	L237 E238 C241 V242 E243 Y248 R249	L237-R245 HydrophobicContact CD2-CG 4.43Å; L237-R245 HydrophobicContact CG-CG 4.38Å; L237-R245 PolarHBondContact O-NE 2.72Å; E238-R245 VanDerWaalsContact CA-NH2 3.33Å; E238-R245 PolarHBondContact O-NH2 3.49Å; C241-R245 PolarHBondContact O-N 3.09Å; V242-R245 PolarHBondContact O-N 3.35Å; E243-R245 VanDerWaalsContact C-N 3.35Å; R245-Y248 PolarHBondContact O-N 2.95Å; R245-R249 VanDerWaalsContact O-CG 3.29Å; R245-R249 WeakPolarHBondContact O-CG 3.37Å; R245-R249 PolarHBondContact O-N 2.89Å
246	A	77.6	Confident	76.6	Confident	8 Å²	8	32.5 Å²	32.5	7%	0.066	18%	0.178	C	C	.	.	H	α-helix	trans	-57.1	-53	175.1	0	0	0	0	0	111.5	V242 E243 K244 Y248 R249 L250 F363	V242-A246 PolarHBondContact O-N 3.29Å; E243-A246 WeakPolarHBondContact O-CB 3.44Å; E243-A246 PolarHBondContact O-N 2.94Å; K244-A246 VanDerWaalsContact C-N 3.33Å; A246-Y248 VanDerWaalsContact C-N 3.34Å; A246-Y248 PolarHBondContact O-N 3.45Å; A246-R249 PolarHBondContact O-N 2.94Å; A246-R249 VanDerWaalsContact O-N 3.11Å; A246-L250 VanDerWaalsContact O-CG 3.28Å; A246-L250 WeakPolarHBondContact O-CG 3.41Å; A246-L250 PolarHBondContact O-N 3.29Å; A246-F363 HydrophobicContact CB-CD1 3.97Å; A246-F363 HydrophobicContact CB-CE1 3.82Å
247	F	82.3	Confident	78.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.3	-48	178.2	-177.8	-90	0	0	0	112.1	E206 N207 E243 R249 L250 I251 F378 H381 F382 I385	E206-F247 HydrophobicContact CB-CZ 4.25Å; N207-F247 HydrophobicContact CB-CD1 3.64Å; N207-F247 HydrophobicContact CB-CE1 3.82Å; E243-F247 PolarHBondContact O-N 3.31Å; F247-R249 VanDerWaalsContact C-N 3.34Å; F247-R249 PolarHBondContact O-N 2.92Å; F247-L250 PolarHBondContact O-N 2.98Å; F247-I251 HydrophobicContact CD1-CG1 4.13Å; F247-I251 HydrophobicContact CE1-CG1 3.75Å; F247-I251 HydrophobicContact CE2-CD1 4.42Å; F247-I251 HydrophobicContact CE2-CG1 4.28Å; F247-I251 HydrophobicContact CZ-CD1 4.23Å; F247-I251 HydrophobicContact CZ-CG1 3.85Å; F247-I251 WeakPolarHBondContact O-CG1 3.43Å; F247-I251 PolarHBondContact O-N 3.14Å; F247-F378 HydrophobicContact CB-CE1 3.88Å; F247-F378 HydrophobicContact CB-CZ 4.41Å; F247-F378 HydrophobicContact CD2-CD1 4.04Å; F247-F378 AromaticContact CD2-CE1 3.83Å; F247-F378 HydrophobicContact CD2-CE1 3.83Å; F247-F378 HydrophobicContact CG-CE1 4.36Å; F247-H381 HydrophobicContact CE2-CB 3.84Å; F247-H381 HydrophobicContact CZ-CB 4.31Å; F247-F382 HydrophobicContact CD2-CE2 4.44Å; F247-F382 HydrophobicContact CE2-CE2 4.31Å; F247-I385 HydrophobicContact CE2-CD1 4.01Å; F247-I385 HydrophobicContact CZ-CD1 3.8Å
248	Y	85.8	Confident	80.1	Confident	9 Å²	9	30 Å²	30	4%	0.035	17%	0.17	C	C	.	.	H	α-helix	trans	-56.7	-47.3	176.6	171.8	-100.6	0	0	0	112	Y204 F233 L237 K244 R245 A246 L250 I251 S252	Y204-Y248 AromaticContact CD1-CD2 3.85Å; Y204-Y248 HydrophobicContact CD1-CD2 3.85Å; Y204-Y248 HydrophobicContact CD1-CE2 4.08Å; Y204-Y248 AromaticContact CE1-CD2 3.83Å; Y204-Y248 HydrophobicContact CE1-CD2 3.83Å; Y204-Y248 AromaticContact CE1-CE2 3.84Å; Y204-Y248 HydrophobicContact CE1-CE2 3.84Å; F233-Y248 HydrophobicContact CE1-CE2 4.4Å; F233-Y248 HydrophobicContact CZ-CE2 4.22Å; L237-Y248 HydrophobicContact CD1-CD1 4.05Å; L237-Y248 HydrophobicContact CD1-CD2 4.5Å; L237-Y248 HydrophobicContact CD1-CG 3.94Å; L237-Y248 HydrophobicContact CD2-CD1 3.68Å; L237-Y248 HydrophobicContact CD2-CE1 3.85Å; L237-Y248 HydrophobicContact CD2-CG 4.41Å; K244-Y248 PolarHBondContact O-N 3.31Å; K244-Y248 VanDerWaalsContact O-N 3.15Å; R245-Y248 PolarHBondContact O-N 2.95Å; A246-Y248 VanDerWaalsContact C-N 3.34Å; A246-Y248 PolarHBondContact O-N 3.45Å; Y248-L250 PolarHBondContact O-N 2.66Å; Y248-I251 PolarHBondContact O-N 3.4Å; Y248-S252 WeakPolarHBondContact O-CB 3.48Å; Y248-S252 PolarHBondContact O-N 3.21Å
249	R	87.5	Confident	82	Confident	20 Å²	20	24.6 Å²	24.6	8%	0.075	15%	0.145	C	C	.	.	H	α-helix	trans	-65.5	-38.4	-178.7	-67.6	-174.8	74.8	-165.8	-4.4	111.7	D45 R245 A246 F247 S252 G253 N303 F306	D45-R249 IonicContact OD2-CZ 3.32Å; D45-R249 IonicContact OD2-NH1 2.77Å; D45-R249 PolarHBondContact OD2-NH1 3.07Å; R245-R249 VanDerWaalsContact O-CG 3.29Å; R245-R249 WeakPolarHBondContact O-CG 3.37Å; R245-R249 PolarHBondContact O-N 2.89Å; A246-R249 PolarHBondContact O-N 2.94Å; A246-R249 VanDerWaalsContact O-N 3.11Å; F247-R249 VanDerWaalsContact C-N 3.34Å; F247-R249 PolarHBondContact O-N 2.92Å; R249-S252 PolarHBondContact O-N 3.28Å; R249-G253 PolarHBondContact O-N 3.32Å; R249-N303 WeakPolarHBondContact CG-OD1 3.26Å; R249-N303 PolarHBondContact NE-OD1 2.88Å; R249-F306 HydrophobicContact CB-CD1 3.57Å; R249-F306 HydrophobicContact CB-CE1 3.74Å; R249-F306 HydrophobicContact CB-CG 4.29Å; R249-F306 VanDerWaalsContact CZ-CD2 3.47Å
250	L	90.4	Very high	84.3	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-52.3	175	-66.1	174.4	0	0	0	111.5	A246 F247 Y248 S252 G253 L254 F306 L307 I310 L408 L412	A246-L250 VanDerWaalsContact O-CG 3.28Å; A246-L250 WeakPolarHBondContact O-CG 3.41Å; A246-L250 PolarHBondContact O-N 3.29Å; F247-L250 PolarHBondContact O-N 2.98Å; Y248-L250 PolarHBondContact O-N 2.66Å; L250-S252 VanDerWaalsContact C-N 3.33Å; L250-S252 PolarHBondContact O-N 3.43Å; L250-G253 PolarHBondContact O-N 2.9Å; L250-L254 PolarHBondContact O-N 3.44Å; L250-F306 HydrophobicContact CD2-CD1 4.2Å; L250-F306 HydrophobicContact CD2-CE1 3.87Å; L250-F306 HydrophobicContact CG-CE1 4.18Å; L250-L307 HydrophobicContact CD2-CD1 3.79Å; L250-I310 HydrophobicContact CD2-CB 4.09Å; L250-I310 HydrophobicContact CD2-CG1 4.01Å; L250-I310 HydrophobicContact CD2-CG2 3.96Å; L250-L408 HydrophobicContact CB-CD2 4.12Å; L250-L408 HydrophobicContact CD1-CD1 4.36Å; L250-L408 HydrophobicContact CD2-CD1 4.15Å; L250-L412 HydrophobicContact CD1-CD1 4.15Å; L250-L412 HydrophobicContact CD1-CD2 4.13Å
251	I	93.1	Very high	86.1	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-65.4	-38.3	178.6	-58.8	-54.7	0	0	0	111.2	W200 I203 Y204 F247 Y248 L254 H255 F382 I385	W200-I251 HydrophobicContact CE3-CG2 4.43Å; W200-I251 HydrophobicContact CZ3-CG2 4Å; I203-I251 HydrophobicContact CG2-CD1 4.28Å; I203-I251 HydrophobicContact CG2-CG1 4.42Å; I203-I251 HydrophobicContact CG2-CG2 3.63Å; Y204-I251 HydrophobicContact CD1-CB 4.4Å; Y204-I251 HydrophobicContact CD1-CG2 3.96Å; Y204-I251 HydrophobicContact CD2-CG2 4.38Å; Y204-I251 HydrophobicContact CE1-CB 3.9Å; Y204-I251 HydrophobicContact CE1-CG2 3.52Å; Y204-I251 HydrophobicContact CE2-CG2 3.93Å; Y204-I251 HydrophobicContact CG-CG2 4.39Å; Y204-I251 PolarHBondContact OH-O 2.86Å; F247-I251 HydrophobicContact CD1-CG1 4.13Å; F247-I251 HydrophobicContact CE1-CG1 3.75Å; F247-I251 HydrophobicContact CE2-CD1 4.42Å; F247-I251 HydrophobicContact CE2-CG1 4.28Å; F247-I251 HydrophobicContact CZ-CD1 4.23Å; F247-I251 HydrophobicContact CZ-CG1 3.85Å; F247-I251 WeakPolarHBondContact O-CG1 3.43Å; F247-I251 PolarHBondContact O-N 3.14Å; Y248-I251 PolarHBondContact O-N 3.4Å; I251-L254 PolarHBondContact O-N 3.28Å; I251-H255 WeakPolarHBondContact O-CB 3.34Å; I251-H255 PolarHBondContact O-N 3.01Å; I251-F382 HydrophobicContact CD1-CE1 4.47Å; I251-F382 HydrophobicContact CD1-CZ 4.49Å; I251-I385 HydrophobicContact CD1-CD1 3.87Å
252	S	94.4	Very high	87.8	Confident	2 Å²	2	17.9 Å²	17.9	1%	0.014	9%	0.088	C	C	.	.	H	α-helix	trans	-62.2	-42.2	174.4	-166.8	0	0	0	0	112.6	Y204 Y248 R249 L250 H255 A256 N303	Y204-S252 VanDerWaalsContact OH-CA 3.25Å; Y204-S252 WeakPolarHBondContact OH-CA 3.24Å; Y204-S252 PolarHBondContact OH-N 3.35Å; Y248-S252 WeakPolarHBondContact O-CB 3.48Å; Y248-S252 PolarHBondContact O-N 3.21Å; R249-S252 PolarHBondContact O-N 3.28Å; L250-S252 VanDerWaalsContact C-N 3.33Å; L250-S252 PolarHBondContact O-N 3.43Å; S252-H255 PolarHBondContact O-N 3.16Å; S252-A256 VanDerWaalsContact O-CB 3.29Å; S252-A256 WeakPolarHBondContact O-CB 3.48Å; S252-A256 PolarHBondContact O-N 2.96Å; S252-N303 WeakPolarHBondContact CB-ND2 3.24Å; S252-N303 PolarHBondContact OG-ND2 3.2Å
253	G	96.4	Very high	89.5	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64.6	-41.2	174	0	0	0	0	0	112.6	R249 L250 A256 S257 N303	R249-G253 PolarHBondContact O-N 3.32Å; L250-G253 PolarHBondContact O-N 2.9Å; G253-A256 WeakPolarHBondContact O-CB 3.43Å; G253-A256 PolarHBondContact O-N 3.41Å; G253-S257 WeakPolarHBondContact O-CB 3.29Å; G253-S257 PolarHBondContact O-N 3.03Å; G253-N303 VanDerWaalsContact CA-C 3.49Å; G253-N303 WeakPolarHBondContact CA-O 3.4Å
254	L	97.2	Very high	91.3	Very high	5 Å²	5	12 Å²	12	3%	0.026	6%	0.057	C	C	.	.	H	α-helix	trans	-64.6	-47	176.7	177.1	58.3	0	0	0	111.2	L250 I251 A256 S257 I258 L307 Q404 T405	L250-L254 PolarHBondContact O-N 3.44Å; I251-L254 PolarHBondContact O-N 3.28Å; L254-A256 VanDerWaalsContact C-N 3.31Å; L254-A256 PolarHBondContact O-N 3.47Å; L254-S257 WeakPolarHBondContact O-CB 3.48Å; L254-S257 PolarHBondContact O-N 3.15Å; L254-I258 HydrophobicContact CD1-CD1 4.33Å; L254-I258 HydrophobicContact CG-CD1 4.3Å; L254-I258 WeakPolarHBondContact O-CG1 3.48Å; L254-I258 PolarHBondContact O-N 3.46Å; L254-L307 HydrophobicContact CB-CD2 3.93Å; L254-L307 VanDerWaalsContact N-CD2 3.32Å; L254-Q404 HydrophobicContact CD1-CB 3.63Å; L254-Q404 HydrophobicContact CD1-CG 4.12Å; L254-Q404 HydrophobicContact CD2-CB 4.43Å; L254-T405 HydrophobicContact CD2-CG2 4.01Å
255	H	97.6	Very high	92.6	Very high	31 Å²	31	13.8 Å²	13.8	14%	0.144	6%	0.062	C	C	.	.	H	α-helix	trans	-61.5	-40.3	175.4	-170.9	179.3	0	0	0	111.6	W200 Y204 I251 S252 I258 N259	W200-H255 AromaticContact CD1-CE1 3.79Å; W200-H255 AromaticContact CD1-NE2 3.83Å; W200-H255 AromaticContact CD2-CE1 3.79Å; W200-H255 AromaticContact CD2-CG 3.89Å; W200-H255 AromaticContact CD2-ND1 3.67Å; W200-H255 AromaticContact CE2-CD2 3.47Å; W200-H255 VanDerWaalsContact CE2-CD2 3.47Å; W200-H255 AromaticContact CE2-CE1 3.84Å; W200-H255 AromaticContact CE2-CG 3.66Å; W200-H255 AromaticContact CE2-ND1 3.86Å; W200-H255 AromaticContact CE2-NE2 3.66Å; W200-H255 HydrophobicContact CE3-CB 4.2Å; W200-H255 AromaticContact CE3-ND1 3.89Å; W200-H255 AromaticContact CG-CE1 3.77Å; W200-H255 HydrophobicContact CH2-CB 3.52Å; W200-H255 AromaticContact CH2-CG 3.79Å; W200-H255 HydrophobicContact CZ2-CB 3.85Å; W200-H255 AromaticContact CZ2-CD2 3.49Å; W200-H255 VanDerWaalsContact CZ2-CD2 3.49Å; W200-H255 WeakPolarHBondContact CZ2-CD2 3.44Å; W200-H255 AromaticContact CZ2-CG 3.62Å; W200-H255 HydrophobicContact CZ3-CB 3.71Å; W200-H255 AromaticContact CZ3-CG 3.99Å; W200-H255 AromaticContact NE1-CD2 3.71Å; W200-H255 AromaticContact NE1-CE1 3.8Å; W200-H255 AromaticContact NE1-NE2 3.46Å; W200-H255 PolarHBondContact NE1-NE2 3.39Å; Y204-H255 AromaticContact CE2-ND1 3.93Å; I251-H255 WeakPolarHBondContact O-CB 3.34Å; I251-H255 PolarHBondContact O-N 3.01Å; S252-H255 PolarHBondContact O-N 3.16Å; H255-I258 PolarHBondContact O-N 3.01Å; H255-N259 PolarHBondContact CD2-ND2 2.83Å; H255-N259 PolarHBondContact NE2-ND2 3.39Å; H255-N259 VanDerWaalsContact NE2-ND2 3.18Å; H255-N259 WeakPolarHBondContact O-CB 3.34Å; H255-N259 PolarHBondContact O-N 2.99Å; H255-N259 VanDerWaalsContact O-N 3.08Å; H255-N259 PolarHBondContact O-ND2 3.23Å
256	A	97.8	Very high	93.6	Very high	3 Å²	3	12.8 Å²	12.8	3%	0.025	6%	0.059	C	C	.	.	H	α-helix	trans	-61.3	-45.7	173.6	0	0	0	0	0	111.3	S252 G253 L254 I258 N259 V260 F288 R300 L304	S252-A256 VanDerWaalsContact O-CB 3.29Å; S252-A256 WeakPolarHBondContact O-CB 3.48Å; S252-A256 PolarHBondContact O-N 2.96Å; G253-A256 WeakPolarHBondContact O-CB 3.43Å; G253-A256 PolarHBondContact O-N 3.41Å; L254-A256 VanDerWaalsContact C-N 3.31Å; L254-A256 PolarHBondContact O-N 3.47Å; A256-I258 PolarHBondContact O-N 2.98Å; A256-N259 CarbonylContact O-C 3.57Å; A256-N259 PolarHBondContact O-N 3.38Å; A256-N259 VanDerWaalsContact O-N 3.17Å; A256-V260 WeakPolarHBondContact O-CG2 3.35Å; A256-V260 PolarHBondContact O-N 3.12Å; A256-F288 HydrophobicContact CB-CE1 4.17Å; A256-R300 HydrophobicContact CB-CB 4.2Å; A256-L304 HydrophobicContact CB-CB 4.18Å; A256-L304 HydrophobicContact CB-CD1 4.25Å
257	S	98.6	Very high	94.2	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-57.6	-46	177.6	176.2	0	0	0	0	112.5	G253 L254 N259 V260 H261 I450 S453	G253-S257 WeakPolarHBondContact O-CB 3.29Å; G253-S257 PolarHBondContact O-N 3.03Å; L254-S257 WeakPolarHBondContact O-CB 3.48Å; L254-S257 PolarHBondContact O-N 3.15Å; S257-N259 VanDerWaalsContact C-N 3.33Å; S257-N259 PolarHBondContact O-N 3.28Å; S257-V260 PolarHBondContact O-N 3.13Å; S257-H261 PolarHBondContact O-N 3.5Å; S257-H261 PolarHBondContact O-ND1 3.42Å; S257-I450 WeakPolarHBondContact OG-CD1 3.36Å; S257-S453 WeakPolarHBondContact CB-OG 3.41Å; S257-S453 PolarHBondContact OG-OG 3.33Å
258	I	97.9	Very high	94.5	Very high	37 Å²	37	16.5 Å²	16.5	19%	0.19	8%	0.077	C	C	.	.	H	α-helix	trans	-61.1	-44.1	177	-66.1	165.6	0	0	0	110.7	W200 L254 H255 A256 V260 H261 L262	W200-I258 HydrophobicContact CH2-CD1 3.87Å; W200-I258 HydrophobicContact CZ2-CD1 3.75Å; L254-I258 HydrophobicContact CD1-CD1 4.33Å; L254-I258 HydrophobicContact CG-CD1 4.3Å; L254-I258 WeakPolarHBondContact O-CG1 3.48Å; L254-I258 PolarHBondContact O-N 3.46Å; H255-I258 PolarHBondContact O-N 3.01Å; A256-I258 PolarHBondContact O-N 2.98Å; I258-V260 VanDerWaalsContact C-N 3.32Å; I258-V260 PolarHBondContact O-N 2.82Å; I258-H261 PolarHBondContact O-N 3.18Å; I258-L262 PolarHBondContact O-N 2.94Å
259	N	97.7	Very high	94.4	Very high	17 Å²	17	21.6 Å²	21.6	9%	0.091	10%	0.101	C	C	.	.	H	α-helix	trans	-66.9	-31	178	-76.2	-28	0	0	0	112.8	H255 A256 S257 L262 S263 R287 F288	H255-N259 PolarHBondContact CD2-ND2 2.83Å; H255-N259 PolarHBondContact NE2-ND2 3.39Å; H255-N259 VanDerWaalsContact NE2-ND2 3.18Å; H255-N259 WeakPolarHBondContact O-CB 3.34Å; H255-N259 PolarHBondContact O-N 2.99Å; H255-N259 VanDerWaalsContact O-N 3.08Å; H255-N259 PolarHBondContact O-ND2 3.23Å; A256-N259 CarbonylContact O-C 3.57Å; A256-N259 PolarHBondContact O-N 3.38Å; A256-N259 VanDerWaalsContact O-N 3.17Å; S257-N259 VanDerWaalsContact C-N 3.33Å; S257-N259 PolarHBondContact O-N 3.28Å; N259-L262 WeakPolarHBondContact O-CG 3.43Å; N259-S263 WeakPolarHBondContact O-CB 3.25Å; N259-S263 PolarHBondContact O-N 3.48Å; N259-S263 PolarHBondContact O-OG 3.36Å; N259-R287 PolarHBondContact OD1-NH1 3.28Å; N259-F288 HydrophobicContact CB-CE2 4.1Å; N259-F288 HydrophobicContact CB-CZ 3.69Å
260	V	98.3	Very high	94.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68	-47.3	171.3	171.6	0	0	0	0	110.2	A256 S257 I258 L262 S263 A264 F284 F288 L301 L304 E456 L457	A256-V260 WeakPolarHBondContact O-CG2 3.35Å; A256-V260 PolarHBondContact O-N 3.12Å; S257-V260 PolarHBondContact O-N 3.13Å; I258-V260 VanDerWaalsContact C-N 3.32Å; I258-V260 PolarHBondContact O-N 2.82Å; V260-L262 PolarHBondContact O-N 3.26Å; V260-S263 PolarHBondContact O-N 2.94Å; V260-S263 VanDerWaalsContact O-N 3.13Å; V260-A264 WeakPolarHBondContact O-CB 3.27Å; V260-A264 PolarHBondContact O-N 2.89Å; V260-F284 HydrophobicContact CG2-CE2 4.35Å; V260-F288 HydrophobicContact CG2-CE1 4.49Å; V260-F288 HydrophobicContact CG2-CE2 3.77Å; V260-F288 HydrophobicContact CG2-CZ 3.71Å; V260-L301 HydrophobicContact CG2-CD2 4.38Å; V260-L304 HydrophobicContact CG2-CD1 4.11Å; V260-E456 HydrophobicContact CG1-CB 3.81Å; V260-L457 HydrophobicContact CG1-CD2 4.43Å; V260-L457 HydrophobicContact CG2-CD2 4.02Å
261	H	98.2	Very high	93.8	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-59.9	-46.8	179.3	-78.8	89.2	0	0	0	113	E186 S257 I258 S263 A264 R265 R449 S453	E186-H261 HydrophobicContact CG-CB 4.08Å; E186-H261 IonicContact OE2-CD2 3.03Å; E186-H261 IonicContact OE2-CE1 3.45Å; E186-H261 PolarHBondContact OE2-CE1 2.74Å; E186-H261 IonicContact OE2-CG 3.58Å; E186-H261 IonicContact OE2-ND1 3.76Å; E186-H261 PolarHBondContact OE2-ND1 3.41Å; E186-H261 IonicContact OE2-NE2 3.72Å; S257-H261 PolarHBondContact O-N 3.5Å; S257-H261 PolarHBondContact O-ND1 3.42Å; I258-H261 PolarHBondContact O-N 3.18Å; H261-S263 PolarHBondContact O-N 3.35Å; H261-A264 PolarHBondContact O-N 3.05Å; H261-R265 WeakPolarHBondContact O-CB 3.38Å; H261-R265 PolarHBondContact O-N 3.48Å; H261-R449 PolarHBondContact CE1-O 3.45Å; H261-S453 PolarHBondContact CE1-OG 3.26Å; H261-S453 PolarHBondContact ND1-OG 3Å
262	L	94.7	Very high	92.9	Very high	26 Å²	26	42.1 Å²	42.1	14%	0.136	19%	0.192	C	C	.	.	H	α-helix	trans	-64.7	-31.7	178.5	71.9	85.6	0	0	0	111.7	Y188 I258 N259 V260 R265 Y266 E283	Y188-L262 HydrophobicContact CD2-CD1 4.48Å; I258-L262 PolarHBondContact O-N 2.94Å; N259-L262 WeakPolarHBondContact O-CG 3.43Å; V260-L262 PolarHBondContact O-N 3.26Å; L262-R265 CarbonylContact O-C 3.46Å; L262-Y266 WeakPolarHBondContact O-CA 3.39Å; L262-Y266 VanDerWaalsContact O-CD2 3.29Å; L262-Y266 WeakPolarHBondContact O-CD2 3.46Å; L262-Y266 PolarHBondContact O-N 3.39Å; L262-E283 HydrophobicContact CD1-CG 4Å
263	S	96.6	Very high	92.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-73.3	-42	177	-55.9	0	0	0	0	111.5	N259 V260 H261 N280	N259-S263 WeakPolarHBondContact O-CB 3.25Å; N259-S263 PolarHBondContact O-N 3.48Å; N259-S263 PolarHBondContact O-OG 3.36Å; V260-S263 PolarHBondContact O-N 2.94Å; V260-S263 VanDerWaalsContact O-N 3.13Å; H261-S263 PolarHBondContact O-N 3.35Å; S263-N280 PolarHBondContact O-N 3.05Å
264	A	97.3	Very high	91.5	Very high	2 Å²	2	57 Å²	57	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-72.2	-30.3	179.7	0	0	0	0	0	112.6	V260 H261 G278 H279 E456 F460	V260-A264 WeakPolarHBondContact O-CB 3.27Å; V260-A264 PolarHBondContact O-N 2.89Å; H261-A264 PolarHBondContact O-N 3.05Å; A264-G278 CarbonylContact O-C 3.42Å; A264-H279 WeakPolarHBondContact O-CA 3.45Å; A264-H279 PolarHBondContact O-N 3.47Å; A264-E456 HydrophobicContact CB-CB 4.06Å; A264-E456 HydrophobicContact CB-CG 3.68Å; A264-F460 HydrophobicContact CB-CE2 3.85Å; A264-F460 HydrophobicContact CB-CZ 4.1Å
265	R	94.7	Very high	91	Very high	66 Å²	66	60.9 Å²	60.9	25%	0.249	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	58.8	-177.5	-57.5	171.5	-179.2	172.3	-1.2	109.5	E186 R187 Y188 H261 L262	E186-R265 VanDerWaalsContact O-CD 3.27Å; E186-R265 WeakPolarHBondContact O-CD 3.38Å; E186-R265 PolarHBondContact O-NH1 3.45Å; R187-R265 HydrophobicContact CB-CB 3.55Å; Y188-R265 WeakPolarHBondContact CB-O 3.27Å; Y188-R265 PolarHBondContact N-O 2.92Å; H261-R265 WeakPolarHBondContact O-CB 3.38Å; H261-R265 PolarHBondContact O-N 3.48Å; L262-R265 CarbonylContact O-C 3.46Å
266	Y	92.8	Very high	90.7	Very high	38 Å²	38	65.2 Å²	65.2	15%	0.149	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	149.7	-179.7	-152.8	-87.8	0	0	0	111	Y188 L262 L268 W277 G278 N280 E283	Y188-Y266 AromaticContact CD2-CD2 3.82Å; Y188-Y266 HydrophobicContact CD2-CD2 3.82Å; Y188-Y266 AromaticContact CD2-CE2 3.46Å; Y188-Y266 HydrophobicContact CD2-CE2 3.46Å; Y188-Y266 VanDerWaalsContact CD2-CE2 3.46Å; Y188-Y266 AromaticContact CD2-CZ 3.94Å; Y188-Y266 HydrophobicContact CE1-CE1 4.35Å; Y188-Y266 HydrophobicContact CE2-CD2 4.36Å; Y188-Y266 HydrophobicContact CE2-CE1 4.45Å; Y188-Y266 AromaticContact CE2-CE2 3.57Å; Y188-Y266 HydrophobicContact CE2-CE2 3.57Å; Y188-Y266 AromaticContact CE2-CZ 3.63Å; Y188-Y266 AromaticContact CG-CD2 3.99Å; Y188-Y266 HydrophobicContact CG-CD2 3.99Å; Y188-Y266 HydrophobicContact CG-CE2 4.02Å; Y188-Y266 HydrophobicContact CG-CG 4.35Å; Y188-Y266 AromaticContact CZ-CZ 3.82Å; L262-Y266 WeakPolarHBondContact O-CA 3.39Å; L262-Y266 VanDerWaalsContact O-CD2 3.29Å; L262-Y266 WeakPolarHBondContact O-CD2 3.46Å; L262-Y266 PolarHBondContact O-N 3.39Å; Y266-L268 PolarHBondContact O-N 3.35Å; Y266-W277 CarbonylContact O-C 3.58Å; Y266-W277 VanDerWaalsContact O-CA 3.25Å; Y266-W277 WeakPolarHBondContact O-CA 3.49Å; Y266-G278 WeakPolarHBondContact CB-O 3.49Å; Y266-G278 PolarHBondContact N-O 3Å; Y266-G278 PolarHBondContact O-N 3.45Å; Y266-N280 HydrophobicContact CD1-CB 4.12Å; Y266-N280 WeakPolarHBondContact CD1-ND2 3.5Å; Y266-N280 HydrophobicContact CD2-CB 4.02Å; Y266-N280 HydrophobicContact CG-CB 3.63Å; Y266-E283 HydrophobicContact CD2-CB 4.32Å; Y266-E283 HydrophobicContact CD2-CG 4.03Å; Y266-E283 HydrophobicContact CE2-CB 4.18Å; Y266-E283 HydrophobicContact CE2-CG 3.71Å; Y266-E283 VanDerWaalsContact CE2-OE2 3.27Å; Y266-E283 WeakPolarHBondContact CE2-OE2 3.36Å; Y266-E283 PolarHBondContact OH-OE2 2.89Å
267	L	89.9	Confident	90.3	Very high	13 Å²	13	68.2 Å²	68.2	7%	0.068	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	93.9	170.1	-179.9	58.9	0	0	0	108.8	Y188 Q269 E270 K275 W277	Y188-L267 HydrophobicContact CD1-CB 4.01Å; Y188-L267 HydrophobicContact CE1-CB 4.36Å; L267-Q269 WeakPolarHBondContact CD1-O 3.32Å; L267-E270 HydrophobicContact CD2-CB 4.13Å; L267-E270 HydrophobicContact CD2-CG 4.45Å; L267-E270 HydrophobicContact CG-CB 4.38Å; L267-K275 HydrophobicContact CD1-CB 3.98Å; L267-K275 HydrophobicContact CD1-CD 4.39Å; L267-K275 HydrophobicContact CD1-CG 4.29Å; L267-W277 HydrophobicContact CB-CD2 4.41Å; L267-W277 HydrophobicContact CB-CE3 4.08Å; L267-W277 HydrophobicContact CB-CH2 3.89Å; L267-W277 HydrophobicContact CB-CZ2 4.22Å; L267-W277 HydrophobicContact CB-CZ3 3.83Å; L267-W277 HydrophobicContact CD1-CD2 4.24Å; L267-W277 HydrophobicContact CD1-CZ2 4.02Å; L267-W277 HydrophobicContact CD2-CZ2 4.43Å; L267-W277 HydrophobicContact CG-CZ2 4.46Å
268	L	88.7	Confident	90.1	Very high	73 Å²	73	69 Å²	69	38%	0.382	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-40.1	-174	-62.4	175.8	0	0	0	112	Y266 K276 N280	Y266-L268 PolarHBondContact O-N 3.35Å; L268-K276 PolarHBondContact N-O 3.4Å; L268-N280 HydrophobicContact CD2-CB 3.93Å
269	Q	83.8	Confident	90.1	Very high	115 Å²	115	70.3 Å²	70.3	54%	0.537	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	132.2	-179	-64.9	174.9	-11.9	0	0	109.5	L267 K275 K276	L267-Q269 WeakPolarHBondContact CD1-O 3.32Å; Q269-K275 WeakPolarHBondContact O-CA 3.46Å; Q269-K276 HydrophobicContact CB-CB 4.13Å; Q269-K276 PolarHBondContact N-O 3.06Å; Q269-K276 PolarHBondContact O-N 2.94Å
270	E	83.1	Confident	90	Very high	103 Å²	103	71 Å²	71	48%	0.481	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	101.7	173.1	-174.9	164.4	-148.2	0	0	107.1	R96 L267 K275	R96-E270 IonicContact CZ-OE2 3.76Å; R96-E270 IonicContact NH2-OE2 2.63Å; R96-E270 PolarHBondContact NH2-OE2 3.39Å; L267-E270 HydrophobicContact CD2-CB 4.13Å; L267-E270 HydrophobicContact CD2-CG 4.45Å; L267-E270 HydrophobicContact CG-CB 4.38Å; E270-K275 VanDerWaalsContact OE1-CE 3.31Å; E270-K275 WeakPolarHBondContact OE1-CE 3.45Å; E270-K275 IonicContact OE1-NZ 3.67Å; E270-K275 PolarHBondContact OE1-NZ 3.15Å
271	T	81.4	Confident	89.9	Confident	81 Å²	81	72.9 Å²	72.9	50%	0.497	34%	0.339	S	S	.	.			trans	-104.9	169.9	171.2	67.4	0	0	0	0	109.4	L273 E274	T271-L273 PolarHBondContact O-N 3.34Å; T271-L273 PolarHBondContact OG1-N 3.25Å; T271-E274 PolarHBondContact N-O 2.84Å; T271-E274 PolarHBondContact OG1-N 2.93Å; T271-E274 PolarHBondContact OG1-O 3.38Å
272	W	74.9	Confident	89.7	Confident	272 Å²	272	76.8 Å²	76.8	100%	1.03	36%	0.363	S	S	*	.	S	Bend	trans	-60.4	-22.5	174.2	-68.9	95.2	0	0	0	113.5
273	L	76.9	Confident	89.7	Confident	163 Å²	163	76.8 Å²	76.8	85%	0.853	36%	0.362	S	S	*	.	S	Bend	trans	-106.4	-38.5	-172.6	-63.5	166.7	0	0	0	112.5	T271	T271-L273 PolarHBondContact O-N 3.34Å; T271-L273 PolarHBondContact OG1-N 3.25Å
274	E	84.1	Confident	89.7	Confident	151 Å²	151	76.8 Å²	76.8	71%	0.706	36%	0.362	S	S	*	.			trans	-140.1	143.5	-170.2	-65.8	-177.7	176.2	0	0	112.6	T271	T271-E274 PolarHBondContact N-O 2.84Å; T271-E274 PolarHBondContact OG1-N 2.93Å; T271-E274 PolarHBondContact OG1-O 3.38Å
275	K	86.2	Confident	89.5	Confident	87 Å²	87	78.4 Å²	78.4	38%	0.378	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.1	169	-68.1	-170.4	176	-166.1	0	109.3	D98 L267 Q269 E270	D98-K275 VanDerWaalsContact CG-NZ 3.25Å; D98-K275 IonicContact OD1-NZ 3.51Å; D98-K275 PolarHBondContact OD1-NZ 3.44Å; D98-K275 IonicContact OD2-NZ 2.67Å; D98-K275 PolarHBondContact OD2-NZ 3.18Å; L267-K275 HydrophobicContact CD1-CB 3.98Å; L267-K275 HydrophobicContact CD1-CD 4.39Å; L267-K275 HydrophobicContact CD1-CG 4.29Å; Q269-K275 WeakPolarHBondContact O-CA 3.46Å; E270-K275 VanDerWaalsContact OE1-CE 3.31Å; E270-K275 WeakPolarHBondContact OE1-CE 3.45Å; E270-K275 IonicContact OE1-NZ 3.67Å; E270-K275 PolarHBondContact OE1-NZ 3.15Å
276	K	90.4	Very high	89.5	Confident	121 Å²	121	79.6 Å²	79.6	53%	0.526	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	117.3	175.5	-168.7	175.5	-179.9	177.3	0	110.2	L268 Q269	L268-K276 PolarHBondContact N-O 3.4Å; Q269-K276 HydrophobicContact CB-CB 4.13Å; Q269-K276 PolarHBondContact N-O 3.06Å; Q269-K276 PolarHBondContact O-N 2.94Å
277	W	90.9	Very high	89.5	Confident	66 Å²	66	80.5 Å²	80.5	25%	0.25	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.3	174.6	-63.6	84.9	0	0	0	110.3	D98 R187 Y188 Y266 L267	D98-W277 HydrophobicContact CB-CH2 4.49Å; R187-W277 HydrophobicContact CB-CZ3 4.33Å; R187-W277 HydrophobicContact CG-CE3 4.37Å; R187-W277 HydrophobicContact CG-CH2 4.27Å; R187-W277 HydrophobicContact CG-CZ3 3.88Å; R187-W277 VanDerWaalsContact CZ-CZ2 3.42Å; Y188-W277 HydrophobicContact CD1-CZ3 4.47Å; Y188-W277 VanDerWaalsContact O-CH2 3.28Å; Y188-W277 WeakPolarHBondContact O-CH2 3.43Å; Y188-W277 VanDerWaalsContact O-CZ3 3.27Å; Y188-W277 WeakPolarHBondContact O-CZ3 3.42Å; Y266-W277 CarbonylContact O-C 3.58Å; Y266-W277 VanDerWaalsContact O-CA 3.25Å; Y266-W277 WeakPolarHBondContact O-CA 3.49Å; L267-W277 HydrophobicContact CB-CD2 4.41Å; L267-W277 HydrophobicContact CB-CE3 4.08Å; L267-W277 HydrophobicContact CB-CH2 3.89Å; L267-W277 HydrophobicContact CB-CZ2 4.22Å; L267-W277 HydrophobicContact CB-CZ3 3.83Å; L267-W277 HydrophobicContact CD1-CD2 4.24Å; L267-W277 HydrophobicContact CD1-CZ2 4.02Å; L267-W277 HydrophobicContact CD2-CZ2 4.43Å; L267-W277 HydrophobicContact CG-CZ2 4.46Å
278	G	93.3	Very high	89.7	Confident	17 Å²	17	79.9 Å²	79.9	18%	0.175	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-170.8	175.7	0	0	0	0	0	113.7	A264 Y266 N280	A264-G278 CarbonylContact O-C 3.42Å; Y266-G278 WeakPolarHBondContact CB-O 3.49Å; Y266-G278 PolarHBondContact N-O 3Å; Y266-G278 PolarHBondContact O-N 3.45Å; G278-N280 PolarHBondContact O-N 3.23Å
279	H	97.5	Very high	89.7	Confident	64 Å²	64	76.4 Å²	76.4	30%	0.296	36%	0.359	S	S	.	.			trans	-70	120	-177	-61.1	75.1	0	0	0	112.2	A264 E456 F460 L463	A264-H279 WeakPolarHBondContact O-CA 3.45Å; A264-H279 PolarHBondContact O-N 3.47Å; H279-E456 IonicContact CD2-OE2 3.11Å; H279-E456 IonicContact CE1-OE2 3.41Å; H279-E456 IonicContact NE2-OE2 3.89Å; H279-E456 PolarHBondContact NE2-OE2 3.38Å; H279-F460 HydrophobicContact CB-CE1 4.08Å; H279-F460 HydrophobicContact CB-CZ 4.44Å; H279-F460 AromaticContact CD2-CZ 3.94Å; H279-L463 HydrophobicContact CB-CD1 3.66Å
280	N	96.4	Very high	89.7	Confident	32 Å²	32	71.4 Å²	71.4	17%	0.171	34%	0.339	C	S	.	.			trans	-99.6	97.8	169.5	-174.3	-18.8	0	0	0	109.6	S263 Y266 L268 G278 T282 E283 F284	S263-N280 PolarHBondContact O-N 3.05Å; Y266-N280 HydrophobicContact CD1-CB 4.12Å; Y266-N280 WeakPolarHBondContact CD1-ND2 3.5Å; Y266-N280 HydrophobicContact CD2-CB 4.02Å; Y266-N280 HydrophobicContact CG-CB 3.63Å; L268-N280 HydrophobicContact CD2-CB 3.93Å; G278-N280 PolarHBondContact O-N 3.23Å; N280-T282 VanDerWaalsContact C-N 3.33Å; N280-T282 PolarHBondContact O-N 2.98Å; N280-T282 PolarHBondContact OD1-N 2.96Å; N280-E283 HydrophobicContact CB-CB 3.96Å; N280-E283 PolarHBondContact O-N 3.29Å; N280-E283 PolarHBondContact OD1-N 3.27Å; N280-F284 PolarHBondContact O-N 2.85Å; N280-F284 VanDerWaalsContact O-N 3.1Å
281	I	95.6	Very high	89.8	Confident	40 Å²	40	71.3 Å²	71.3	21%	0.205	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-39.6	-178.3	-66.3	142	0	0	0	111.4	E283 F284 Q285 L463 L464 I467	I281-E283 PolarHBondContact O-N 3.12Å; I281-F284 PolarHBondContact O-N 3.09Å; I281-Q285 HydrophobicContact CG2-CG 4.26Å; I281-Q285 WeakPolarHBondContact O-CG 3.29Å; I281-Q285 PolarHBondContact O-N 3.15Å; I281-L463 HydrophobicContact CD1-CB 4.32Å; I281-L463 HydrophobicContact CG1-CB 4.33Å; I281-L463 HydrophobicContact CG1-CD1 4.48Å; I281-L464 HydrophobicContact CG2-CD2 3.47Å; I281-L464 VanDerWaalsContact CG2-CD2 3.47Å; I281-L464 HydrophobicContact CG2-CG 4.36Å; I281-I467 HydrophobicContact CD1-CD1 3.47Å; I281-I467 VanDerWaalsContact CD1-CD1 3.47Å; I281-I467 HydrophobicContact CG1-CD1 4.26Å; I281-I467 HydrophobicContact CG2-CD1 4.17Å
282	T	94.2	Very high	90.1	Very high	83 Å²	83	72.2 Å²	72.2	51%	0.509	34%	0.341	S	S	.	.	H	α-helix	trans	-63.7	-44.2	179.7	-53.3	0	0	0	0	111.4	N280 F284 Q285 Q286	N280-T282 VanDerWaalsContact C-N 3.33Å; N280-T282 PolarHBondContact O-N 2.98Å; N280-T282 PolarHBondContact OD1-N 2.96Å; T282-F284 VanDerWaalsContact C-N 3.34Å; T282-F284 PolarHBondContact O-N 3.06Å; T282-Q285 PolarHBondContact O-N 3.48Å; T282-Q286 WeakPolarHBondContact O-CB 3.29Å; T282-Q286 VanDerWaalsContact O-CG 3.28Å; T282-Q286 WeakPolarHBondContact O-CG 3.41Å; T282-Q286 PolarHBondContact O-N 2.97Å
283	E	94.5	Very high	90.7	Very high	25 Å²	25	59.8 Å²	59.8	12%	0.117	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-42.7	175.5	-174.4	80.4	-151.5	0	0	111.2	L262 Y266 N280 I281 R287	L262-E283 HydrophobicContact CD1-CG 4Å; Y266-E283 HydrophobicContact CD2-CB 4.32Å; Y266-E283 HydrophobicContact CD2-CG 4.03Å; Y266-E283 HydrophobicContact CE2-CB 4.18Å; Y266-E283 HydrophobicContact CE2-CG 3.71Å; Y266-E283 VanDerWaalsContact CE2-OE2 3.27Å; Y266-E283 WeakPolarHBondContact CE2-OE2 3.36Å; Y266-E283 PolarHBondContact OH-OE2 2.89Å; N280-E283 HydrophobicContact CB-CB 3.96Å; N280-E283 PolarHBondContact O-N 3.29Å; N280-E283 PolarHBondContact OD1-N 3.27Å; I281-E283 PolarHBondContact O-N 3.12Å; E283-R287 WeakPolarHBondContact O-CG 3.48Å; E283-R287 PolarHBondContact O-N 3.45Å; E283-R287 IonicContact OE1-CZ 2.62Å; E283-R287 IonicContact OE1-NE 2.71Å; E283-R287 PolarHBondContact OE1-NE 3.08Å; E283-R287 IonicContact OE1-NH2 2.64Å; E283-R287 PolarHBondContact OE1-NH2 3.46Å
284	F	96.4	Very high	91.2	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-49.7	176.8	-178.9	-99	0	0	0	111.7	C35 F36 V260 N280 I281 T282 Q286 R287 F288 L457 F460 L464	C35-F284 HydrophobicContact CB-CE1 4.48Å; F36-F284 HydrophobicContact CE1-CZ 4.44Å; F36-F284 HydrophobicContact CE2-CE1 4.31Å; F36-F284 AromaticContact CZ-CE1 3.92Å; F36-F284 HydrophobicContact CZ-CE1 3.92Å; F36-F284 AromaticContact CZ-CZ 3.85Å; F36-F284 HydrophobicContact CZ-CZ 3.85Å; V260-F284 HydrophobicContact CG2-CE2 4.35Å; N280-F284 PolarHBondContact O-N 2.85Å; N280-F284 VanDerWaalsContact O-N 3.1Å; I281-F284 PolarHBondContact O-N 3.09Å; T282-F284 VanDerWaalsContact C-N 3.34Å; T282-F284 PolarHBondContact O-N 3.06Å; F284-Q286 PolarHBondContact O-N 2.81Å; F284-R287 PolarHBondContact O-N 2.87Å; F284-R287 VanDerWaalsContact O-N 3.13Å; F284-F288 AromaticContact CD2-CD2 3.53Å; F284-F288 HydrophobicContact CD2-CD2 3.53Å; F284-F288 HydrophobicContact CD2-CE2 4.07Å; F284-F288 HydrophobicContact CD2-CG 4.46Å; F284-F288 HydrophobicContact CE1-CB 4.38Å; F284-F288 HydrophobicContact CE2-CB 4.3Å; F284-F288 AromaticContact CE2-CD2 3.52Å; F284-F288 HydrophobicContact CE2-CD2 3.52Å; F284-F288 HydrophobicContact CE2-CE2 4.12Å; F284-F288 HydrophobicContact CE2-CG 4.13Å; F284-F288 HydrophobicContact CG-CD2 4.23Å; F284-F288 HydrophobicContact CZ-CB 4.13Å; F284-F288 HydrophobicContact CZ-CD2 4.22Å; F284-F288 HydrophobicContact CZ-CG 4.42Å; F284-F288 WeakPolarHBondContact O-CB 3.14Å; F284-F288 WeakPolarHBondContact O-CD2 3.47Å; F284-F288 PolarHBondContact O-N 3.43Å; F284-L457 HydrophobicContact CE2-CD2 3.76Å; F284-L457 HydrophobicContact CZ-CD2 3.79Å; F284-F460 HydrophobicContact CB-CD1 3.89Å; F284-F460 HydrophobicContact CB-CE1 3.58Å; F284-F460 HydrophobicContact CB-CE2 4.26Å; F284-F460 HydrophobicContact CB-CG 4.37Å; F284-F460 HydrophobicContact CB-CZ 3.77Å; F284-F460 HydrophobicContact CD1-CB 4.02Å; F284-F460 AromaticContact CD1-CD1 3.93Å; F284-F460 HydrophobicContact CD1-CD1 3.93Å; F284-F460 HydrophobicContact CD1-CD2 4.3Å; F284-F460 HydrophobicContact CD1-CE1 4.48Å; F284-F460 AromaticContact CD1-CG 3.83Å; F284-F460 HydrophobicContact CD1-CG 3.83Å; F284-F460 HydrophobicContact CD2-CD1 4.22Å; F284-F460 AromaticContact CD2-CD2 3.45Å; F284-F460 HydrophobicContact CD2-CD2 3.45Å; F284-F460 VanDerWaalsContact CD2-CD2 3.45Å; F284-F460 HydrophobicContact CD2-CE1 4.26Å; F284-F460 AromaticContact CD2-CE2 3.48Å; F284-F460 HydrophobicContact CD2-CE2 3.48Å; F284-F460 VanDerWaalsContact CD2-CE2 3.48Å; F284-F460 AromaticContact CD2-CG 3.84Å; F284-F460 HydrophobicContact CD2-CG 3.84Å; F284-F460 AromaticContact CD2-CZ 3.91Å; F284-F460 HydrophobicContact CD2-CZ 3.91Å; F284-F460 HydrophobicContact CE1-CB 3.82Å; F284-F460 HydrophobicContact CE1-CD2 4.42Å; F284-F460 HydrophobicContact CE1-CG 4.05Å; F284-F460 HydrophobicContact CE2-CB 4.39Å; F284-F460 AromaticContact CE2-CD2 3.59Å; F284-F460 HydrophobicContact CE2-CD2 3.59Å; F284-F460 HydrophobicContact CE2-CE2 4.03Å; F284-F460 HydrophobicContact CE2-CG 4.05Å; F284-F460 HydrophobicContact CG-CB 4.39Å; F284-F460 AromaticContact CG-CD1 3.74Å; F284-F460 HydrophobicContact CG-CD1 3.74Å; F284-F460 AromaticContact CG-CD2 3.84Å; F284-F460 HydrophobicContact CG-CD2 3.84Å; F284-F460 AromaticContact CG-CE1 3.86Å; F284-F460 HydrophobicContact CG-CE1 3.86Å; F284-F460 AromaticContact CG-CE2 3.95Å; F284-F460 HydrophobicContact CG-CE2 3.95Å; F284-F460 AromaticContact CG-CG 3.73Å; F284-F460 HydrophobicContact CG-CG 3.73Å; F284-F460 AromaticContact CG-CZ 3.96Å; F284-F460 HydrophobicContact CG-CZ 3.96Å; F284-F460 HydrophobicContact CZ-CB 4.02Å; F284-F460 HydrophobicContact CZ-CD2 4.09Å; F284-F460 HydrophobicContact CZ-CG 4.15Å; F284-L464 HydrophobicContact CD1-CD1 4.45Å; F284-L464 HydrophobicContact CE1-CD1 4.36Å
285	Q	93.7	Very high	91.1	Very high	37 Å²	37	51.1 Å²	51.1	17%	0.173	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-44.2	179.8	-71.5	-176.8	-73.3	0	0	112.1	I281 T282 R287 F288 D289 L292 L464	I281-Q285 HydrophobicContact CG2-CG 4.26Å; I281-Q285 WeakPolarHBondContact O-CG 3.29Å; I281-Q285 PolarHBondContact O-N 3.15Å; T282-Q285 PolarHBondContact O-N 3.48Å; Q285-R287 PolarHBondContact O-N 2.91Å; Q285-R287 VanDerWaalsContact O-N 3.1Å; Q285-F288 PolarHBondContact O-N 3Å; Q285-D289 HydrophobicContact CB-CB 4.18Å; Q285-D289 WeakPolarHBondContact O-CB 3.3Å; Q285-D289 PolarHBondContact O-N 2.9Å; Q285-L292 HydrophobicContact CB-CD1 4.15Å; Q285-L464 HydrophobicContact CG-CD2 3.98Å
286	Q	93.9	Very high	91.1	Very high	90 Å²	90	48 Å²	48	42%	0.421	24%	0.24	S	C	.	.	H	α-helix	trans	-59	-26	177.7	-75.3	176.9	-6.3	0	0	113	T282 F284 T293	T282-Q286 WeakPolarHBondContact O-CB 3.29Å; T282-Q286 VanDerWaalsContact O-CG 3.28Å; T282-Q286 WeakPolarHBondContact O-CG 3.41Å; T282-Q286 PolarHBondContact O-N 2.97Å; F284-Q286 PolarHBondContact O-N 2.81Å; Q286-T293 WeakPolarHBondContact O-CG2 3.34Å
287	R	93.1	Very high	91.1	Very high	57 Å²	57	42.2 Å²	42.2	22%	0.215	22%	0.215	C	C	.	.	H	α-helix	trans	-95.4	-28.4	-178.9	-68.6	177.2	179.3	-81.3	-6.1	114.2	N259 E283 F284 Q285 R300	N259-R287 PolarHBondContact OD1-NH1 3.28Å; E283-R287 WeakPolarHBondContact O-CG 3.48Å; E283-R287 PolarHBondContact O-N 3.45Å; E283-R287 IonicContact OE1-CZ 2.62Å; E283-R287 IonicContact OE1-NE 2.71Å; E283-R287 PolarHBondContact OE1-NE 3.08Å; E283-R287 IonicContact OE1-NH2 2.64Å; E283-R287 PolarHBondContact OE1-NH2 3.46Å; F284-R287 PolarHBondContact O-N 2.87Å; F284-R287 VanDerWaalsContact O-N 3.13Å; Q285-R287 PolarHBondContact O-N 2.91Å; Q285-R287 VanDerWaalsContact O-N 3.1Å; R287-R300 PolarHBondContact O-NH1 3.12Å
288	F	94.3	Very high	91	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-131.9	-10.6	-166.3	-61.2	-69.1	0	0	0	115.7	A256 N259 V260 F284 Q285 G290 P298 R300 L301	A256-F288 HydrophobicContact CB-CE1 4.17Å; N259-F288 HydrophobicContact CB-CE2 4.1Å; N259-F288 HydrophobicContact CB-CZ 3.69Å; V260-F288 HydrophobicContact CG2-CE1 4.49Å; V260-F288 HydrophobicContact CG2-CE2 3.77Å; V260-F288 HydrophobicContact CG2-CZ 3.71Å; F284-F288 AromaticContact CD2-CD2 3.53Å; F284-F288 HydrophobicContact CD2-CD2 3.53Å; F284-F288 HydrophobicContact CD2-CE2 4.07Å; F284-F288 HydrophobicContact CD2-CG 4.46Å; F284-F288 HydrophobicContact CE1-CB 4.38Å; F284-F288 HydrophobicContact CE2-CB 4.3Å; F284-F288 AromaticContact CE2-CD2 3.52Å; F284-F288 HydrophobicContact CE2-CD2 3.52Å; F284-F288 HydrophobicContact CE2-CE2 4.12Å; F284-F288 HydrophobicContact CE2-CG 4.13Å; F284-F288 HydrophobicContact CG-CD2 4.23Å; F284-F288 HydrophobicContact CZ-CB 4.13Å; F284-F288 HydrophobicContact CZ-CD2 4.22Å; F284-F288 HydrophobicContact CZ-CG 4.42Å; F284-F288 WeakPolarHBondContact O-CB 3.14Å; F284-F288 WeakPolarHBondContact O-CD2 3.47Å; F284-F288 PolarHBondContact O-N 3.43Å; Q285-F288 PolarHBondContact O-N 3Å; F288-G290 PolarHBondContact O-N 2.95Å; F288-P298 WeakPolarHBondContact O-CD 3.29Å; F288-R300 HydrophobicContact CE1-CB 4.34Å; F288-L301 HydrophobicContact CB-CD1 4.25Å; F288-L301 HydrophobicContact CD1-CD1 4.44Å; F288-L301 HydrophobicContact CD1-CD2 3.58Å; F288-L301 HydrophobicContact CD1-CG 3.81Å; F288-L301 HydrophobicContact CE1-CD2 3.78Å; F288-L301 HydrophobicContact CE1-CG 4.4Å; F288-L301 HydrophobicContact CG-CD2 4.12Å; F288-L301 HydrophobicContact CG-CG 4.39Å; F288-L301 HydrophobicContact CZ-CD2 4.47Å
289	D	89.5	Confident	90.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.			trans	-67.7	127.4	176.6	-177.4	-86.7	0	0	0	110.6	R34 Q285 I291 L292 T293	R34-D289 VanDerWaalsContact CB-OD2 3.27Å; R34-D289 WeakPolarHBondContact CB-OD2 3.35Å; R34-D289 IonicContact CZ-OD2 3.13Å; R34-D289 IonicContact NE-OD2 2.88Å; R34-D289 IonicContact NH1-OD1 3.94Å; R34-D289 PolarHBondContact NH1-OD1 2.98Å; R34-D289 VanDerWaalsContact NH1-OD1 3.13Å; R34-D289 IonicContact NH1-OD2 3.43Å; R34-D289 PolarHBondContact NH1-OD2 2.65Å; Q285-D289 HydrophobicContact CB-CB 4.18Å; Q285-D289 WeakPolarHBondContact O-CB 3.3Å; Q285-D289 PolarHBondContact O-N 2.9Å; D289-I291 VanDerWaalsContact C-N 3.26Å; D289-I291 PolarHBondContact O-N 3.25Å; D289-I291 WeakPolarHBondContact OD1-CB 3.45Å; D289-I291 PolarHBondContact OD1-N 3.38Å; D289-L292 HydrophobicContact CB-CB 4.07Å; D289-L292 HydrophobicContact CB-CD1 4.01Å; D289-L292 HydrophobicContact CB-CG 4.04Å; D289-L292 PolarHBondContact O-N 3.42Å; D289-L292 PolarHBondContact OD1-N 3.35Å; D289-T293 WeakPolarHBondContact O-CB 3.21Å; D289-T293 WeakPolarHBondContact O-CG2 3.35Å; D289-T293 PolarHBondContact O-N 2.95Å; D289-T293 PolarHBondContact O-OG1 3.37Å
290	G	83.8	Confident	90.5	Very high	10 Å²	10	42 Å²	42	10%	0.103	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-31.1	-175.5	0	0	0	0	0	113.8	R34 F288 E294 G295	R34-G290 WeakPolarHBondContact O-CA 3.43Å; R34-G290 PolarHBondContact O-N 3.21Å; F288-G290 PolarHBondContact O-N 2.95Å; G290-E294 CarbonylContact O-C 3.38Å; G290-E294 PolarHBondContact O-N 3.28Å; G290-G295 PolarHBondContact O-N 2.92Å
291	I	85.3	Confident	90.4	Very high	101 Å²	101	40.5 Å²	40.5	52%	0.518	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-47.8	177.2	-62.7	-165.5	0	0	0	110.6	R34 D289 T293 E294	R34-I291 HydrophobicContact CB-CG1 4.37Å; R34-I291 VanDerWaalsContact CD-CG1 3.49Å; R34-I291 HydrophobicContact CG-CD1 3.85Å; R34-I291 HydrophobicContact CG-CG1 3.93Å; D289-I291 VanDerWaalsContact C-N 3.26Å; D289-I291 PolarHBondContact O-N 3.25Å; D289-I291 WeakPolarHBondContact OD1-CB 3.45Å; D289-I291 PolarHBondContact OD1-N 3.38Å; I291-T293 PolarHBondContact O-N 3.49Å; I291-E294 PolarHBondContact O-N 3.45Å
292	L	88.1	Confident	90.1	Very high	99 Å²	99	40.7 Å²	40.7	52%	0.518	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-24	-178.5	-62.1	179.3	0	0	0	113.2	Q285 D289	Q285-L292 HydrophobicContact CB-CD1 4.15Å; D289-L292 HydrophobicContact CB-CB 4.07Å; D289-L292 HydrophobicContact CB-CD1 4.01Å; D289-L292 HydrophobicContact CB-CG 4.04Å; D289-L292 PolarHBondContact O-N 3.42Å; D289-L292 PolarHBondContact OD1-N 3.35Å
293	T	86.7	Confident	90	Very high	12 Å²	12	37.5 Å²	37.5	7%	0.074	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	11.7	-177.3	64.9	0	0	0	0	113.4	Q286 D289 I291 G295 E296 G297	Q286-T293 WeakPolarHBondContact O-CG2 3.34Å; D289-T293 WeakPolarHBondContact O-CB 3.21Å; D289-T293 WeakPolarHBondContact O-CG2 3.35Å; D289-T293 PolarHBondContact O-N 2.95Å; D289-T293 PolarHBondContact O-OG1 3.37Å; I291-T293 PolarHBondContact O-N 3.49Å; T293-G295 PolarHBondContact O-N 2.9Å; T293-G295 VanDerWaalsContact O-N 3.14Å; T293-E296 VanDerWaalsContact O-CB 3.27Å; T293-E296 WeakPolarHBondContact O-CB 3.44Å; T293-E296 WeakPolarHBondContact O-CG 3.47Å; T293-E296 PolarHBondContact O-N 3.42Å; T293-G297 WeakPolarHBondContact OG1-CA 3.43Å; T293-G297 PolarHBondContact OG1-N 2.9Å
294	E	87.9	Confident	90.1	Very high	124 Å²	124	36.3 Å²	36.3	58%	0.579	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	36.5	179	-53.8	-172.7	-173.4	0	0	113.2	G290 I291	G290-E294 CarbonylContact O-C 3.38Å; G290-E294 PolarHBondContact O-N 3.28Å; I291-E294 PolarHBondContact O-N 3.45Å
295	G	82.4	Confident	89.9	Confident	8 Å²	8	36.3 Å²	36.3	8%	0.082	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-5.1	179.6	0	0	0	0	0	115.3	G290 T293 R299	G290-G295 PolarHBondContact O-N 2.92Å; T293-G295 PolarHBondContact O-N 2.9Å; T293-G295 VanDerWaalsContact O-N 3.14Å; G295-R299 WeakPolarHBondContact O-CG 3.4Å; G295-R299 PolarHBondContact O-N 3.25Å
296	E	85.7	Confident	89.8	Confident	20 Å²	20	34.6 Å²	34.6	9%	0.093	16%	0.163	C	C	.	.	H	α-helix	trans	-71.4	-35.8	-179.1	-71.2	-65	113.2	0	0	113.4	Y234 T293 R299 R300	Y234-E296 WeakPolarHBondContact CE2-OE1 3.37Å; Y234-E296 PolarHBondContact OH-OE1 3.47Å; Y234-E296 PolarHBondContact OH-OE2 3.39Å; T293-E296 VanDerWaalsContact O-CB 3.27Å; T293-E296 WeakPolarHBondContact O-CB 3.44Å; T293-E296 WeakPolarHBondContact O-CG 3.47Å; T293-E296 PolarHBondContact O-N 3.42Å; E296-R299 WeakPolarHBondContact O-CB 3.38Å; E296-R299 PolarHBondContact O-N 3.3Å; E296-R299 WeakPolarHBondContact OE1-CD 3.25Å; E296-R299 IonicContact OE1-CZ 3.21Å; E296-R299 IonicContact OE1-NH1 3.95Å; E296-R299 PolarHBondContact OE1-NH1 2.94Å; E296-R300 VanDerWaalsContact O-CG 3.26Å; E296-R300 WeakPolarHBondContact O-CG 3.18Å; E296-R300 PolarHBondContact O-N 3.13Å
297	G	89.7	Confident	89.8	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-55.4	-58.3	177.5	0	0	0	0	0	112.4	T293 R299 R300 L301	T293-G297 WeakPolarHBondContact OG1-CA 3.43Å; T293-G297 PolarHBondContact OG1-N 2.9Å; G297-R299 VanDerWaalsContact C-N 3.3Å; G297-R299 PolarHBondContact O-N 3.41Å; G297-R300 WeakPolarHBondContact O-CB 3.47Å; G297-R300 PolarHBondContact O-N 3.36Å; G297-R300 VanDerWaalsContact O-N 3.09Å; G297-L301 PolarHBondContact O-N 3.47Å
298	P	89.3	Confident	89.9	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-56.4	-38.2	174.9	-31.2	39.5	0	0	0	114.2	Q38 V39 F288 R300 L301 K302	Q38-P298 HydrophobicContact CB-CB 3.66Å; Q38-P298 HydrophobicContact CB-CG 3.95Å; Q38-P298 HydrophobicContact CG-CB 3.77Å; Q38-P298 HydrophobicContact CG-CG 4.35Å; V39-P298 HydrophobicContact CG2-CB 3.69Å; V39-P298 HydrophobicContact CG2-CG 4.49Å; F288-P298 WeakPolarHBondContact O-CD 3.29Å; P298-R300 PolarHBondContact O-N 2.93Å; P298-L301 PolarHBondContact O-N 2.83Å; P298-K302 PolarHBondContact O-N 3.47Å
299	R	87.5	Confident	89.8	Confident	96 Å²	96	27.6 Å²	27.6	36%	0.362	13%	0.133	S	C	.	.	H	α-helix	trans	-61.5	-42	174.6	-71.7	172.4	175.7	166.4	-1.4	112.1	Y234 G295 E296 G297 L301 K302 N303	Y234-R299 VanDerWaalsContact CE2-NH1 3.34Å; G295-R299 WeakPolarHBondContact O-CG 3.4Å; G295-R299 PolarHBondContact O-N 3.25Å; E296-R299 WeakPolarHBondContact O-CB 3.38Å; E296-R299 PolarHBondContact O-N 3.3Å; E296-R299 WeakPolarHBondContact OE1-CD 3.25Å; E296-R299 IonicContact OE1-CZ 3.21Å; E296-R299 IonicContact OE1-NH1 3.95Å; E296-R299 PolarHBondContact OE1-NH1 2.94Å; G297-R299 VanDerWaalsContact C-N 3.3Å; G297-R299 PolarHBondContact O-N 3.41Å; R299-L301 VanDerWaalsContact C-N 3.35Å; R299-K302 PolarHBondContact O-N 3.33Å; R299-N303 PolarHBondContact O-N 3.18Å; R299-N303 VanDerWaalsContact O-N 3.08Å; R299-N303 PolarHBondContact O-ND2 3.25Å
300	R	92.8	Very high	89.7	Confident	47 Å²	47	27.8 Å²	27.8	18%	0.177	13%	0.134	C	C	.	.	H	α-helix	trans	-64.9	-38.6	175.7	-66.5	162.5	-167.9	170.6	3.5	111.5	A256 R287 F288 E296 G297 P298 N303 L304	A256-R300 HydrophobicContact CB-CB 4.2Å; R287-R300 PolarHBondContact O-NH1 3.12Å; F288-R300 HydrophobicContact CE1-CB 4.34Å; E296-R300 VanDerWaalsContact O-CG 3.26Å; E296-R300 WeakPolarHBondContact O-CG 3.18Å; E296-R300 PolarHBondContact O-N 3.13Å; G297-R300 WeakPolarHBondContact O-CB 3.47Å; G297-R300 PolarHBondContact O-N 3.36Å; G297-R300 VanDerWaalsContact O-N 3.09Å; P298-R300 PolarHBondContact O-N 2.93Å; R300-N303 WeakPolarHBondContact O-CB 3.26Å; R300-N303 PolarHBondContact O-N 2.89Å; R300-L304 PolarHBondContact O-N 3.39Å
301	L	93.9	Very high	90.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.6	-41.8	174.4	-64.6	-178.1	0	0	0	112	F36 V39 V260 F288 G297 P298 R299 N303 L304 Y305 L457	F36-L301 HydrophobicContact CE1-CD1 4.4Å; V39-L301 HydrophobicContact CG1-CB 4.05Å; V39-L301 HydrophobicContact CG2-CB 4.02Å; V39-L301 HydrophobicContact CG2-CD1 4.07Å; V260-L301 HydrophobicContact CG2-CD2 4.38Å; F288-L301 HydrophobicContact CB-CD1 4.25Å; F288-L301 HydrophobicContact CD1-CD1 4.44Å; F288-L301 HydrophobicContact CD1-CD2 3.58Å; F288-L301 HydrophobicContact CD1-CG 3.81Å; F288-L301 HydrophobicContact CE1-CD2 3.78Å; F288-L301 HydrophobicContact CE1-CG 4.4Å; F288-L301 HydrophobicContact CG-CD2 4.12Å; F288-L301 HydrophobicContact CG-CG 4.39Å; F288-L301 HydrophobicContact CZ-CD2 4.47Å; G297-L301 PolarHBondContact O-N 3.47Å; P298-L301 PolarHBondContact O-N 2.83Å; R299-L301 VanDerWaalsContact C-N 3.35Å; L301-N303 PolarHBondContact O-N 3.24Å; L301-L304 WeakPolarHBondContact O-CA 3.12Å; L301-L304 VanDerWaalsContact O-CB 3.28Å; L301-L304 WeakPolarHBondContact O-CB 3.22Å; L301-L304 PolarHBondContact O-N 2.94Å; L301-Y305 VanDerWaalsContact O-CD2 3.24Å; L301-Y305 WeakPolarHBondContact O-CD2 3.48Å; L301-Y305 PolarHBondContact O-N 3.3Å; L301-Y305 VanDerWaalsContact O-N 3.07Å; L301-L457 HydrophobicContact CD1-CD2 4.42Å; L301-L457 HydrophobicContact CD2-CD1 4.12Å; L301-L457 HydrophobicContact CD2-CD2 3.7Å
302	K	90.1	Very high	90.7	Very high	44 Å²	44	22.9 Å²	22.9	19%	0.191	11%	0.106	C	C	.	.	H	α-helix	trans	-57.3	-36.9	170.9	-73.6	-176.4	169.4	-168	0	112.4	Q38 V39 L43 D44 P298 R299 Y305 F306	Q38-K302 VanDerWaalsContact O-CE 3.23Å; Q38-K302 WeakPolarHBondContact O-CE 3.25Å; V39-K302 HydrophobicContact CG1-CG 4.45Å; L43-K302 HydrophobicContact CD2-CB 4.09Å; L43-K302 HydrophobicContact CD2-CG 4.05Å; D44-K302 IonicContact OD2-NZ 3.41Å; D44-K302 PolarHBondContact OD2-NZ 3.37Å; P298-K302 PolarHBondContact O-N 3.47Å; R299-K302 PolarHBondContact O-N 3.33Å; K302-Y305 PolarHBondContact O-N 3.35Å; K302-F306 PolarHBondContact O-N 2.76Å
303	N	92.1	Very high	90.7	Very high	15 Å²	15	19.6 Å²	19.6	8%	0.08	9%	0.087	C	C	.	.	H	α-helix	trans	-70.5	-30.9	175.2	-68.1	-26.4	0	0	0	113	R249 S252 G253 R299 R300 L301 F306 L307	R249-N303 WeakPolarHBondContact CG-OD1 3.26Å; R249-N303 PolarHBondContact NE-OD1 2.88Å; S252-N303 WeakPolarHBondContact CB-ND2 3.24Å; S252-N303 PolarHBondContact OG-ND2 3.2Å; G253-N303 VanDerWaalsContact CA-C 3.49Å; G253-N303 WeakPolarHBondContact CA-O 3.4Å; R299-N303 PolarHBondContact O-N 3.18Å; R299-N303 VanDerWaalsContact O-N 3.08Å; R299-N303 PolarHBondContact O-ND2 3.25Å; R300-N303 WeakPolarHBondContact O-CB 3.26Å; R300-N303 PolarHBondContact O-N 2.89Å; L301-N303 PolarHBondContact O-N 3.24Å; N303-F306 WeakPolarHBondContact O-CB 3.4Å; N303-F306 PolarHBondContact O-N 3.18Å; N303-L307 PolarHBondContact O-N 2.96Å
304	L	96.1	Very high	90.9	Very high	0 Å²	0	19 Å²	19	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63	-47.6	171.1	-173.9	160.7	0	0	0	110.8	A256 V260 R300 L301 F306 L307 Y308 I450 V454	A256-L304 HydrophobicContact CB-CB 4.18Å; A256-L304 HydrophobicContact CB-CD1 4.25Å; V260-L304 HydrophobicContact CG2-CD1 4.11Å; R300-L304 PolarHBondContact O-N 3.39Å; L301-L304 WeakPolarHBondContact O-CA 3.12Å; L301-L304 VanDerWaalsContact O-CB 3.28Å; L301-L304 WeakPolarHBondContact O-CB 3.22Å; L301-L304 PolarHBondContact O-N 2.94Å; L304-F306 VanDerWaalsContact C-N 3.31Å; L304-F306 PolarHBondContact O-N 3.26Å; L304-L307 PolarHBondContact O-N 3.13Å; L304-Y308 PolarHBondContact O-N 2.85Å; L304-I450 HydrophobicContact CD2-CG2 4.18Å; L304-V454 HydrophobicContact CD2-CG2 3.71Å
305	Y	93.1	Very high	91.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62.9	-36.9	174.5	-74.5	-75.6	0	0	0	112.5	V39 V50 I53 D54 L301 K302 Y308 L309 V454 L457	V39-Y305 HydrophobicContact CG1-CD2 4.06Å; V39-Y305 HydrophobicContact CG1-CE2 3.78Å; V50-Y305 HydrophobicContact CG1-CE1 3.89Å; V50-Y305 HydrophobicContact CG1-CE2 3.84Å; V50-Y305 VanDerWaalsContact CG1-CZ 3.47Å; V50-Y305 WeakPolarHBondContact CG1-OH 3.26Å; V50-Y305 HydrophobicContact CG2-CD2 4.3Å; V50-Y305 HydrophobicContact CG2-CE2 4.4Å; V50-Y305 HydrophobicContact CG2-CG 4.45Å; I53-Y305 HydrophobicContact CB-CD1 4.29Å; I53-Y305 HydrophobicContact CB-CE1 4.31Å; I53-Y305 HydrophobicContact CD1-CD1 3.92Å; I53-Y305 HydrophobicContact CG2-CD1 3.9Å; I53-Y305 HydrophobicContact CG2-CE1 4.02Å; D54-Y305 WeakPolarHBondContact OD1-CE1 2.93Å; D54-Y305 PolarHBondContact OD1-OH 3.26Å; L301-Y305 VanDerWaalsContact O-CD2 3.24Å; L301-Y305 WeakPolarHBondContact O-CD2 3.48Å; L301-Y305 PolarHBondContact O-N 3.3Å; L301-Y305 VanDerWaalsContact O-N 3.07Å; K302-Y305 PolarHBondContact O-N 3.35Å; Y305-Y308 WeakPolarHBondContact O-CB 2.92Å; Y305-Y308 PolarHBondContact O-N 3.45Å; Y305-L309 WeakPolarHBondContact O-CG 3.24Å; Y305-L309 PolarHBondContact O-N 2.73Å; Y305-V454 HydrophobicContact CD1-CG2 4.35Å; Y305-V454 HydrophobicContact CE1-CG1 4Å; Y305-V454 HydrophobicContact CE1-CG2 4.08Å; Y305-L457 HydrophobicContact CE2-CD1 3.79Å
306	F	90.3	Very high	91.6	Very high	1 Å²	1	13.7 Å²	13.7	0%	0.004	6%	0.059	C	C	.	.	H	α-helix	trans	-59.7	-49.7	172.8	178.4	-97.7	0	0	0	112	R249 L250 K302 N303 L304 Y308 L309 I310 F363	R249-F306 HydrophobicContact CB-CD1 3.57Å; R249-F306 HydrophobicContact CB-CE1 3.74Å; R249-F306 HydrophobicContact CB-CG 4.29Å; R249-F306 VanDerWaalsContact CZ-CD2 3.47Å; L250-F306 HydrophobicContact CD2-CD1 4.2Å; L250-F306 HydrophobicContact CD2-CE1 3.87Å; L250-F306 HydrophobicContact CG-CE1 4.18Å; K302-F306 PolarHBondContact O-N 2.76Å; N303-F306 WeakPolarHBondContact O-CB 3.4Å; N303-F306 PolarHBondContact O-N 3.18Å; L304-F306 VanDerWaalsContact C-N 3.31Å; L304-F306 PolarHBondContact O-N 3.26Å; F306-Y308 VanDerWaalsContact C-N 3.32Å; F306-Y308 PolarHBondContact O-N 3.01Å; F306-L309 PolarHBondContact O-N 3.17Å; F306-I310 HydrophobicContact CD1-CG1 4.33Å; F306-I310 HydrophobicContact CE1-CG1 3.96Å; F306-I310 HydrophobicContact CE2-CD1 4.46Å; F306-I310 HydrophobicContact CE2-CG1 4.43Å; F306-I310 HydrophobicContact CZ-CD1 4.15Å; F306-I310 HydrophobicContact CZ-CG1 4.02Å; F306-I310 WeakPolarHBondContact O-CG1 3.42Å; F306-I310 PolarHBondContact O-N 3.35Å; F306-F363 HydrophobicContact CE2-CZ 4.33Å; F306-F363 HydrophobicContact CZ-CE1 4.24Å; F306-F363 HydrophobicContact CZ-CZ 4.42Å
307	L	94.1	Very high	91.8	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.2	-44.7	175.4	173.6	61.3	0	0	0	111.6	L250 L254 N303 L304 L309 I310 E311 L408 I450	L250-L307 HydrophobicContact CD2-CD1 3.79Å; L254-L307 HydrophobicContact CB-CD2 3.93Å; L254-L307 VanDerWaalsContact N-CD2 3.32Å; N303-L307 PolarHBondContact O-N 2.96Å; L304-L307 PolarHBondContact O-N 3.13Å; L307-L309 VanDerWaalsContact C-N 3.32Å; L307-L309 PolarHBondContact O-N 3.43Å; L307-I310 PolarHBondContact O-N 2.87Å; L307-E311 HydrophobicContact CD1-CG 4.14Å; L307-E311 PolarHBondContact O-N 3.34Å; L307-L408 HydrophobicContact CD1-CD1 3.61Å; L307-L408 HydrophobicContact CD1-CD2 4.11Å; L307-L408 HydrophobicContact CD1-CG 4.44Å; L307-I450 HydrophobicContact CD2-CD1 3.58Å; L307-I450 HydrophobicContact CD2-CG1 4.04Å; L307-I450 HydrophobicContact CG-CD1 4.31Å; L307-I450 HydrophobicContact CG-CG1 4.24Å
308	Y	95.7	Very high	91.9	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-54	-48.1	175.5	176	-91.1	0	0	0	111.7	I53 N57 L304 Y305 F306 I310 E311 L312 F447 I450 V454	I53-Y308 HydrophobicContact CG2-CD1 3.68Å; I53-Y308 HydrophobicContact CG2-CE1 3.48Å; I53-Y308 VanDerWaalsContact CG2-CE1 3.48Å; N57-Y308 HydrophobicContact CB-CE2 4.31Å; N57-Y308 WeakPolarHBondContact OD1-CE2 3.3Å; N57-Y308 PolarHBondContact OD1-OH 3.05Å; L304-Y308 PolarHBondContact O-N 2.85Å; Y305-Y308 WeakPolarHBondContact O-CB 2.92Å; Y305-Y308 PolarHBondContact O-N 3.45Å; F306-Y308 VanDerWaalsContact C-N 3.32Å; F306-Y308 PolarHBondContact O-N 3.01Å; Y308-I310 PolarHBondContact O-N 3.21Å; Y308-E311 PolarHBondContact O-N 3.08Å; Y308-L312 HydrophobicContact CE1-CB 4.43Å; Y308-L312 HydrophobicContact CE1-CD1 4.44Å; Y308-L312 HydrophobicContact CE1-CD2 3.93Å; Y308-L312 WeakPolarHBondContact O-CB 3.22Å; Y308-L312 PolarHBondContact O-N 2.89Å; Y308-F447 AromaticContact CD2-CE2 3.71Å; Y308-F447 HydrophobicContact CD2-CE2 3.71Å; Y308-F447 HydrophobicContact CD2-CZ 4.2Å; Y308-F447 AromaticContact CE2-CE2 3.52Å; Y308-F447 HydrophobicContact CE2-CE2 3.52Å; Y308-F447 AromaticContact CE2-CZ 3.52Å; Y308-F447 HydrophobicContact CE2-CZ 3.52Å; Y308-F447 HydrophobicContact CG-CE2 4.41Å; Y308-F447 AromaticContact CZ-CZ 3.88Å; Y308-I450 HydrophobicContact CD2-CG2 4.07Å; Y308-I450 HydrophobicContact CG-CG2 4.37Å; Y308-V454 HydrophobicContact CD2-CG2 4.07Å; Y308-V454 HydrophobicContact CG-CG2 4.35Å
309	L	91.2	Very high	92.2	Very high	2 Å²	2	15.1 Å²	15.1	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-67.2	-35.6	-179.1	-69.4	177.4	0	0	0	112.8	L43 C46 C48 I53 Y305 F306 L307 L312 R313 F354 L356	L43-L309 HydrophobicContact CD1-CD1 3.67Å; C46-L309 HydrophobicContact CB-CD1 3.74Å; C48-L309 HydrophobicContact CB-CD1 4.34Å; I53-L309 HydrophobicContact CD1-CD1 4.07Å; I53-L309 HydrophobicContact CD1-CD2 3.99Å; I53-L309 HydrophobicContact CD1-CG 4.15Å; I53-L309 HydrophobicContact CG1-CD2 4.31Å; Y305-L309 WeakPolarHBondContact O-CG 3.24Å; Y305-L309 PolarHBondContact O-N 2.73Å; F306-L309 PolarHBondContact O-N 3.17Å; L307-L309 VanDerWaalsContact C-N 3.32Å; L307-L309 PolarHBondContact O-N 3.43Å; L309-L312 HydrophobicContact CD2-CD2 4.26Å; L309-R313 VanDerWaalsContact O-CB 3.28Å; L309-R313 WeakPolarHBondContact O-CB 3.37Å; L309-R313 PolarHBondContact O-N 3.28Å; L309-F354 HydrophobicContact CD2-CE1 4.09Å; L309-L356 HydrophobicContact CD1-CD1 4.45Å; L309-L356 HydrophobicContact CD2-CD1 3.93Å
310	I	88.9	Confident	92.4	Very high	4 Å²	4	12.7 Å²	12.7	2%	0.021	6%	0.061	C	C	.	.	H	α-helix	trans	-65	-48	176.2	-69	-62.2	0	0	0	110.9	L250 F306 L307 Y308 R313 A314 F358 L412 L415	L250-I310 HydrophobicContact CD2-CB 4.09Å; L250-I310 HydrophobicContact CD2-CG1 4.01Å; L250-I310 HydrophobicContact CD2-CG2 3.96Å; F306-I310 HydrophobicContact CD1-CG1 4.33Å; F306-I310 HydrophobicContact CE1-CG1 3.96Å; F306-I310 HydrophobicContact CE2-CD1 4.46Å; F306-I310 HydrophobicContact CE2-CG1 4.43Å; F306-I310 HydrophobicContact CZ-CD1 4.15Å; F306-I310 HydrophobicContact CZ-CG1 4.02Å; F306-I310 WeakPolarHBondContact O-CG1 3.42Å; F306-I310 PolarHBondContact O-N 3.35Å; L307-I310 PolarHBondContact O-N 2.87Å; Y308-I310 PolarHBondContact O-N 3.21Å; I310-R313 PolarHBondContact O-N 2.96Å; I310-A314 PolarHBondContact O-N 3.45Å; I310-F358 HydrophobicContact CD1-CE2 3.89Å; I310-F358 HydrophobicContact CD1-CZ 4.06Å; I310-L412 HydrophobicContact CG2-CD2 4.42Å; I310-L415 HydrophobicContact CG2-CD1 3.78Å
311	E	95.1	Very high	92.2	Very high	4 Å²	4	10.7 Å²	10.7	2%	0.019	5%	0.054	C	C	.	.	H	α-helix	trans	-67.6	-39.5	177.5	-69.3	-175.9	170.2	0	0	111.8	L307 Y308 R313 A314 L315 A411 F447 I450	L307-E311 HydrophobicContact CD1-CG 4.14Å; L307-E311 PolarHBondContact O-N 3.34Å; Y308-E311 PolarHBondContact O-N 3.08Å; E311-R313 VanDerWaalsContact C-N 3.31Å; E311-R313 PolarHBondContact O-N 3.2Å; E311-A314 PolarHBondContact O-N 2.84Å; E311-L315 WeakPolarHBondContact O-CG 3.36Å; E311-L315 PolarHBondContact O-N 2.86Å; E311-A411 HydrophobicContact CG-CB 4.17Å; E311-F447 HydrophobicContact CB-CD2 3.68Å; E311-F447 HydrophobicContact CB-CE2 4.44Å; E311-F447 WeakPolarHBondContact OE2-CA 3.16Å; E311-F447 PolarHBondContact OE2-N 3.47Å; E311-I450 WeakPolarHBondContact OE2-CG1 3.46Å
312	L	93.9	Very high	92	Very high	3 Å²	3	10.7 Å²	10.7	2%	0.016	5%	0.054	C	C	.	.	H	α-helix	trans	-58.3	-43.9	172.8	-172.7	77.8	0	0	0	111.1	F56 L61 Y308 L309 L315 S316 I351 F354 F447	F56-L312 HydrophobicContact CE1-CD1 3.98Å; F56-L312 HydrophobicContact CE1-CD2 4.46Å; L61-L312 HydrophobicContact CD2-CD1 4.37Å; Y308-L312 HydrophobicContact CE1-CB 4.43Å; Y308-L312 HydrophobicContact CE1-CD1 4.44Å; Y308-L312 HydrophobicContact CE1-CD2 3.93Å; Y308-L312 WeakPolarHBondContact O-CB 3.22Å; Y308-L312 PolarHBondContact O-N 2.89Å; L309-L312 HydrophobicContact CD2-CD2 4.26Å; L312-L315 PolarHBondContact O-N 3.08Å; L312-S316 PolarHBondContact O-N 3.26Å; L312-I351 HydrophobicContact CD1-CB 4.12Å; L312-I351 HydrophobicContact CD1-CD1 4.18Å; L312-I351 HydrophobicContact CD1-CG1 3.7Å; L312-I351 HydrophobicContact CD1-CG2 3.62Å; L312-I351 HydrophobicContact CG-CG2 3.93Å; L312-I351 VanDerWaalsContact O-CG2 3.28Å; L312-I351 WeakPolarHBondContact O-CG2 3.47Å; L312-F354 HydrophobicContact CD2-CB 4.5Å; L312-F354 HydrophobicContact CD2-CD1 3.53Å; L312-F354 HydrophobicContact CD2-CE1 3.92Å; L312-F354 HydrophobicContact CD2-CG 4.1Å; L312-F447 HydrophobicContact CB-CE2 4.04Å; L312-F447 HydrophobicContact CB-CZ 4.42Å; L312-F447 HydrophobicContact CD1-CE2 4.13Å; L312-F447 HydrophobicContact CD1-CZ 3.65Å
313	R	87.6	Confident	92.1	Very high	31 Å²	31	12.9 Å²	12.9	12%	0.117	7%	0.065	C	C	.	.	H	α-helix	trans	-62.9	-44.8	176	-177.9	58.6	177.4	-162	-9.9	111.3	L309 I310 E311 L315 S316 K317 L356 E360 L415	L309-R313 VanDerWaalsContact O-CB 3.28Å; L309-R313 WeakPolarHBondContact O-CB 3.37Å; L309-R313 PolarHBondContact O-N 3.28Å; I310-R313 PolarHBondContact O-N 2.96Å; E311-R313 VanDerWaalsContact C-N 3.31Å; E311-R313 PolarHBondContact O-N 3.2Å; R313-L315 VanDerWaalsContact C-N 3.33Å; R313-L315 PolarHBondContact O-N 2.93Å; R313-S316 PolarHBondContact O-N 2.68Å; R313-S316 PolarHBondContact O-OG 2.87Å; R313-K317 WeakPolarHBondContact O-CG 3.34Å; R313-K317 PolarHBondContact O-N 3.03Å; R313-K317 VanDerWaalsContact O-N 3.09Å; R313-L356 HydrophobicContact CB-CD2 3.8Å; R313-L356 HydrophobicContact CG-CD2 4.37Å; R313-E360 IonicContact CZ-OE1 3.61Å; R313-E360 IonicContact NH2-OE1 2.72Å; R313-E360 PolarHBondContact NH2-OE1 3.07Å; R313-L415 HydrophobicContact CB-CD2 4.19Å; R313-L415 HydrophobicContact CG-CD2 3.64Å
314	A	90.9	Very high	91.7	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.6	-47	176.5	0	0	0	0	0	110.9	I310 E311 S316 K317 V318 A411 I414 L415	I310-A314 PolarHBondContact O-N 3.45Å; E311-A314 PolarHBondContact O-N 2.84Å; A314-S316 VanDerWaalsContact C-N 3.32Å; A314-S316 PolarHBondContact O-N 3.5Å; A314-K317 PolarHBondContact O-N 3.26Å; A314-V318 PolarHBondContact O-N 2.7Å; A314-A411 HydrophobicContact CB-CB 3.69Å; A314-A411 WeakPolarHBondContact CB-O 3.42Å; A314-I414 HydrophobicContact CB-CB 4.25Å; A314-I414 HydrophobicContact CB-CD1 4.49Å; A314-I414 HydrophobicContact CB-CG2 4.14Å; A314-I414 WeakPolarHBondContact O-CG2 3.3Å; A314-L415 HydrophobicContact CB-CD1 4.41Å; A314-L415 HydrophobicContact CB-CD2 4.18Å; A314-L415 HydrophobicContact CB-CG 4Å
315	L	95.5	Very high	91	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.1	-40.8	176	-72.3	170.6	0	0	0	112.5	E311 L312 R313 K317 V318 L348 I351 L443 F444 F447	E311-L315 WeakPolarHBondContact O-CG 3.36Å; E311-L315 PolarHBondContact O-N 2.86Å; L312-L315 PolarHBondContact O-N 3.08Å; R313-L315 VanDerWaalsContact C-N 3.33Å; R313-L315 PolarHBondContact O-N 2.93Å; L315-K317 VanDerWaalsContact C-N 3.26Å; L315-K317 PolarHBondContact O-N 3.41Å; L315-V318 WeakPolarHBondContact O-CG1 3.44Å; L315-L348 HydrophobicContact CB-CD2 3.99Å; L315-L348 HydrophobicContact CD2-CD2 3.99Å; L315-I351 HydrophobicContact CB-CD1 3.89Å; L315-I351 HydrophobicContact CB-CG2 4.09Å; L315-I351 HydrophobicContact CD1-CD1 3.79Å; L315-I351 HydrophobicContact CG-CD1 4.45Å; L315-L443 HydrophobicContact CD2-CD2 3.91Å; L315-L443 HydrophobicContact CD2-CG 4.01Å; L315-F444 HydrophobicContact CD2-CD1 4.2Å; L315-F444 HydrophobicContact CD2-CE1 3.81Å; L315-F444 HydrophobicContact CD2-CE2 4.27Å; L315-F444 HydrophobicContact CD2-CZ 3.86Å; L315-F447 HydrophobicContact CD1-CB 3.92Å; L315-F447 HydrophobicContact CD1-CD1 3.38Å; L315-F447 HydrophobicContact CD1-CD2 3.96Å; L315-F447 HydrophobicContact CD1-CE1 3.83Å; L315-F447 HydrophobicContact CD1-CE2 4.35Å; L315-F447 HydrophobicContact CD1-CG 3.45Å; L315-F447 VanDerWaalsContact CD1-CG 3.45Å; L315-F447 HydrophobicContact CD1-CZ 4.3Å
316	S	91.3	Very high	90.1	Very high	19 Å²	19	21.3 Å²	21.3	13%	0.133	11%	0.113	C	C	.	.	H	α-helix	trans	-63.6	-31.8	175.8	77.9	0	0	0	0	113.2	L312 R313 A314	L312-S316 PolarHBondContact O-N 3.26Å; R313-S316 PolarHBondContact O-N 2.68Å; R313-S316 PolarHBondContact O-OG 2.87Å; A314-S316 VanDerWaalsContact C-N 3.32Å; A314-S316 PolarHBondContact O-N 3.5Å
317	K	88.3	Confident	89.8	Confident	51 Å²	51	22.3 Å²	22.3	22%	0.222	12%	0.117	C	C	.	.	H	α-helix	trans	-84.8	-28.1	-176.6	-70.9	-69.3	175.2	175.8	0	113.8	R313 A314 L315 L319 P320 I414 E418 I421	R313-K317 WeakPolarHBondContact O-CG 3.34Å; R313-K317 PolarHBondContact O-N 3.03Å; R313-K317 VanDerWaalsContact O-N 3.09Å; A314-K317 PolarHBondContact O-N 3.26Å; L315-K317 VanDerWaalsContact C-N 3.26Å; L315-K317 PolarHBondContact O-N 3.41Å; K317-L319 VanDerWaalsContact C-N 3.31Å; K317-P320 VanDerWaalsContact O-CD 3.31Å; K317-P320 WeakPolarHBondContact O-CD 3.45Å; K317-I414 HydrophobicContact CB-CG2 4.1Å; K317-E418 HydrophobicContact CD-CG 4.33Å; K317-E418 VanDerWaalsContact CE-OE1 3.26Å; K317-E418 WeakPolarHBondContact CE-OE1 3.33Å; K317-E418 IonicContact NZ-OE1 3.6Å; K317-E418 PolarHBondContact NZ-OE1 2.62Å; K317-I421 WeakPolarHBondContact O-CG2 3.44Å
318	V	93.2	Very high	88.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-83	-6.1	179.5	70.7	0	0	0	0	113.2	A314 L315 P320 F321 F322 I414 F433 L435	A314-V318 PolarHBondContact O-N 2.7Å; L315-V318 WeakPolarHBondContact O-CG1 3.44Å; V318-P320 VanDerWaalsContact C-N 3.33Å; V318-F321 HydrophobicContact CG2-CB 3.95Å; V318-F321 HydrophobicContact CG2-CD1 4.47Å; V318-F321 HydrophobicContact CG2-CG 4.45Å; V318-F321 VanDerWaalsContact O-CB 3.25Å; V318-F321 WeakPolarHBondContact O-CB 3.48Å; V318-F321 PolarHBondContact O-N 2.87Å; V318-F322 HydrophobicContact CB-CE2 4.27Å; V318-F322 HydrophobicContact CG1-CD2 4.11Å; V318-F322 HydrophobicContact CG1-CE2 3.67Å; V318-F322 HydrophobicContact CG2-CD2 4.2Å; V318-F322 HydrophobicContact CG2-CE2 3.69Å; V318-F322 WeakPolarHBondContact O-CD2 3.27Å; V318-I414 HydrophobicContact CB-CD1 3.87Å; V318-I414 HydrophobicContact CB-CG1 4.17Å; V318-I414 HydrophobicContact CB-CG2 3.94Å; V318-I414 HydrophobicContact CG1-CD1 4.14Å; V318-I414 HydrophobicContact CG2-CD1 3.93Å; V318-I414 HydrophobicContact CG2-CG1 4.11Å; V318-F433 HydrophobicContact CG2-CE1 4.29Å; V318-L435 HydrophobicContact CG2-CD1 3.74Å
319	L	94.1	Very high	88.2	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-45.7	-46.5	178.5	173.3	67.4	0	0	0	114.4	K317 F321 F322 E323 L345 L348 K352	K317-L319 VanDerWaalsContact C-N 3.31Å; L319-F321 PolarHBondContact O-N 3.38Å; L319-F321 VanDerWaalsContact O-N 3.12Å; L319-F322 PolarHBondContact O-N 3.32Å; L319-E323 HydrophobicContact CD1-CG 3.8Å; L319-E323 WeakPolarHBondContact CD2-OE1 3.45Å; L319-E323 HydrophobicContact CG-CG 4.02Å; L319-E323 WeakPolarHBondContact CG-OE1 3.29Å; L319-E323 PolarHBondContact O-N 2.63Å; L319-L345 HydrophobicContact CD1-CD2 4.04Å; L319-L348 HydrophobicContact CB-CB 4.44Å; L319-L348 HydrophobicContact CD1-CB 3.59Å; L319-L348 HydrophobicContact CD1-CD1 4.08Å; L319-K352 HydrophobicContact CD2-CB 4.46Å; L319-K352 HydrophobicContact CD2-CD 3.39Å
320	P	91.8	Very high	87.5	Confident	46 Å²	46	32.1 Å²	32.1	30%	0.299	16%	0.161	S	C	.	.	H	α-helix	trans	-58.6	-28.6	179.8	-24.9	35.9	0	0	0	114.1	K317 V318 F322 I421	K317-P320 VanDerWaalsContact O-CD 3.31Å; K317-P320 WeakPolarHBondContact O-CD 3.45Å; V318-P320 VanDerWaalsContact C-N 3.33Å; P320-F322 VanDerWaalsContact C-N 3.32Å; P320-F322 PolarHBondContact O-N 2.92Å; P320-I421 HydrophobicContact CB-CG2 4.26Å; P320-I421 HydrophobicContact CG-CG2 4.19Å
321	F	88.8	Confident	86.6	Confident	4 Å²	4	32 Å²	32	2%	0.018	16%	0.161	C	C	.	.	H	α-helix	trans	-65.2	-37.1	176.2	176.5	-96.4	0	0	0	112	V318 L319 F327 M424 F433 L435 I440	V318-F321 HydrophobicContact CG2-CB 3.95Å; V318-F321 HydrophobicContact CG2-CD1 4.47Å; V318-F321 HydrophobicContact CG2-CG 4.45Å; V318-F321 VanDerWaalsContact O-CB 3.25Å; V318-F321 WeakPolarHBondContact O-CB 3.48Å; V318-F321 PolarHBondContact O-N 2.87Å; L319-F321 PolarHBondContact O-N 3.38Å; L319-F321 VanDerWaalsContact O-N 3.12Å; F321-F327 HydrophobicContact CD1-CD2 4.39Å; F321-F327 HydrophobicContact CD1-CE2 4.47Å; F321-F327 AromaticContact CE1-CD2 3.72Å; F321-F327 HydrophobicContact CE1-CD2 3.72Å; F321-F327 AromaticContact CE1-CE2 3.64Å; F321-F327 HydrophobicContact CE1-CE2 3.64Å; F321-F327 HydrophobicContact CZ-CD2 4.15Å; F321-F327 HydrophobicContact CZ-CE2 4.27Å; F321-M424 HydrophobicContact CB-CE 4.23Å; F321-M424 HydrophobicContact CB-SD 4.25Å; F321-M424 HydrophobicContact CD2-CE 3.9Å; F321-M424 HydrophobicContact CD2-SD 4.1Å; F321-F433 AromaticContact CD2-CD1 3.93Å; F321-F433 HydrophobicContact CD2-CD1 3.93Å; F321-F433 HydrophobicContact CD2-CE1 4.13Å; F321-F433 HydrophobicContact CE2-CD1 4.4Å; F321-F433 HydrophobicContact CG-CE1 4.38Å; F321-L435 HydrophobicContact CD1-CD1 4.38Å; F321-L435 HydrophobicContact CE1-CB 4.12Å; F321-L435 HydrophobicContact CE1-CD1 4.34Å; F321-L435 HydrophobicContact CZ-CB 4.05Å; F321-I440 HydrophobicContact CE1-CD1 4.36Å
322	F	90.6	Very high	85.3	Confident	1 Å²	1	34.2 Å²	34.2	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-87	-25.4	-177.4	-66.3	-74.3	0	0	0	113.3	V318 L319 P320 R324 F327 L344 L345 L348 I440 F444	V318-F322 HydrophobicContact CB-CE2 4.27Å; V318-F322 HydrophobicContact CG1-CD2 4.11Å; V318-F322 HydrophobicContact CG1-CE2 3.67Å; V318-F322 HydrophobicContact CG2-CD2 4.2Å; V318-F322 HydrophobicContact CG2-CE2 3.69Å; V318-F322 WeakPolarHBondContact O-CD2 3.27Å; L319-F322 PolarHBondContact O-N 3.32Å; P320-F322 VanDerWaalsContact C-N 3.32Å; P320-F322 PolarHBondContact O-N 2.92Å; F322-R324 PolarHBondContact O-N 3.17Å; F322-F327 AromaticContact CD1-CD1 3.87Å; F322-F327 HydrophobicContact CD1-CD1 3.87Å; F322-F327 AromaticContact CD1-CE1 3.41Å; F322-F327 HydrophobicContact CD1-CE1 3.41Å; F322-F327 VanDerWaalsContact CD1-CE1 3.41Å; F322-F327 HydrophobicContact CD1-CE2 4.13Å; F322-F327 HydrophobicContact CD1-CG 4.42Å; F322-F327 AromaticContact CD1-CZ 3.55Å; F322-F327 HydrophobicContact CD1-CZ 3.55Å; F322-F327 AromaticContact CE1-CE1 3.84Å; F322-F327 HydrophobicContact CE1-CE1 3.84Å; F322-F327 HydrophobicContact CE1-CE2 4.03Å; F322-F327 AromaticContact CE1-CZ 3.49Å; F322-F327 HydrophobicContact CE1-CZ 3.49Å; F322-F327 VanDerWaalsContact CE1-CZ 3.49Å; F322-L344 HydrophobicContact CB-CD2 3.77Å; F322-L344 HydrophobicContact CD1-CD1 4.34Å; F322-L344 HydrophobicContact CD1-CD2 3.74Å; F322-L344 HydrophobicContact CD2-CD2 4.32Å; F322-L344 HydrophobicContact CE1-CD1 4.3Å; F322-L344 HydrophobicContact CE1-CD2 4.42Å; F322-L344 HydrophobicContact CG-CD2 3.69Å; F322-L345 HydrophobicContact CB-CD2 3.98Å; F322-L348 HydrophobicContact CB-CD1 4.01Å; F322-L348 HydrophobicContact CD2-CD1 3.45Å; F322-L348 VanDerWaalsContact CD2-CD1 3.45Å; F322-L348 HydrophobicContact CE2-CD1 4.16Å; F322-L348 HydrophobicContact CG-CD1 3.91Å; F322-I440 HydrophobicContact CE1-CD1 4.32Å; F322-I440 HydrophobicContact CE1-CG1 4.41Å; F322-I440 HydrophobicContact CE1-CG2 4.25Å; F322-I440 HydrophobicContact CZ-CG1 4.31Å; F322-I440 HydrophobicContact CZ-CG2 4.34Å; F322-F444 HydrophobicContact CE1-CE2 4.44Å; F322-F444 HydrophobicContact CE2-CE2 4.21Å; F322-F444 HydrophobicContact CE2-CZ 4.31Å; F322-F444 AromaticContact CZ-CE2 3.81Å; F322-F444 HydrophobicContact CZ-CE2 3.81Å; F322-F444 HydrophobicContact CZ-CZ 4.28Å
323	E	91.8	Very high	84.4	Confident	89 Å²	89	37.1 Å²	37.1	42%	0.416	20%	0.201	S	C	.	.	H	α-helix	trans	-67.6	-19.4	175.5	-75.3	179.1	163.1	0	0	112.7	L319 L345 H349	L319-E323 HydrophobicContact CD1-CG 3.8Å; L319-E323 WeakPolarHBondContact CD2-OE1 3.45Å; L319-E323 HydrophobicContact CG-CG 4.02Å; L319-E323 WeakPolarHBondContact CG-OE1 3.29Å; L319-E323 PolarHBondContact O-N 2.63Å; E323-L345 HydrophobicContact CG-CD2 3.94Å; E323-H349 IonicContact OE1-CE1 3.5Å; E323-H349 PolarHBondContact OE1-CE1 2.67Å; E323-H349 IonicContact OE1-NE2 3.74Å
324	R	84.5	Confident	84	Confident	22 Å²	22	43.7 Å²	43.7	8%	0.083	23%	0.23	C	C	.	.	S	Bend	trans	-58.9	133.8	179.5	-73.9	169.4	59.5	-127.3	-12.2	111.1	F322 D326 F327 K341 M424 G428	F322-R324 PolarHBondContact O-N 3.17Å; R324-D326 PolarHBondContact O-N 3.31Å; R324-F327 PolarHBondContact O-N 3.48Å; R324-K341 PolarHBondContact O-NZ 2.89Å; R324-K341 VanDerWaalsContact O-NZ 3.09Å; R324-M424 VanDerWaalsContact CD-SD 3.52Å; R324-G428 PolarHBondContact NE-O 2.96Å; R324-G428 PolarHBondContact NH2-O 3.35Å
325	P	79.6	Confident	83.7	Confident	79 Å²	79	49.5 Å²	49.5	51%	0.513	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-33.8	-179.9	24.5	-33	0	0	0	111.7	F327 K341	P325-F327 VanDerWaalsContact C-N 3.26Å; P325-F327 PolarHBondContact O-N 3.18Å; P325-K341 PolarHBondContact O-NZ 3.14Å
326	D	75.9	Confident	83	Confident	92 Å²	92	53.2 Å²	53.2	49%	0.492	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.2	-178.7	-54.9	-25.5	0	0	0	113.6	R324 G428	R324-D326 PolarHBondContact O-N 3.31Å; D326-G428 VanDerWaalsContact OD2-C 3.24Å; D326-G428 WeakPolarHBondContact OD2-CA 3.45Å; D326-G428 PolarHBondContact OD2-N 2.95Å
327	F	82.3	Confident	82.4	Confident	21 Å²	21	52.8 Å²	52.8	9%	0.092	27%	0.273	C	S	.	.			trans	-76.5	132.3	178.4	178	-92.5	0	0	0	110.8	F321 F322 R324 P325 L329 K341 I440	F321-F327 HydrophobicContact CD1-CD2 4.39Å; F321-F327 HydrophobicContact CD1-CE2 4.47Å; F321-F327 AromaticContact CE1-CD2 3.72Å; F321-F327 HydrophobicContact CE1-CD2 3.72Å; F321-F327 AromaticContact CE1-CE2 3.64Å; F321-F327 HydrophobicContact CE1-CE2 3.64Å; F321-F327 HydrophobicContact CZ-CD2 4.15Å; F321-F327 HydrophobicContact CZ-CE2 4.27Å; F322-F327 AromaticContact CD1-CD1 3.87Å; F322-F327 HydrophobicContact CD1-CD1 3.87Å; F322-F327 AromaticContact CD1-CE1 3.41Å; F322-F327 HydrophobicContact CD1-CE1 3.41Å; F322-F327 VanDerWaalsContact CD1-CE1 3.41Å; F322-F327 HydrophobicContact CD1-CE2 4.13Å; F322-F327 HydrophobicContact CD1-CG 4.42Å; F322-F327 AromaticContact CD1-CZ 3.55Å; F322-F327 HydrophobicContact CD1-CZ 3.55Å; F322-F327 AromaticContact CE1-CE1 3.84Å; F322-F327 HydrophobicContact CE1-CE1 3.84Å; F322-F327 HydrophobicContact CE1-CE2 4.03Å; F322-F327 AromaticContact CE1-CZ 3.49Å; F322-F327 HydrophobicContact CE1-CZ 3.49Å; F322-F327 VanDerWaalsContact CE1-CZ 3.49Å; R324-F327 PolarHBondContact O-N 3.48Å; P325-F327 VanDerWaalsContact C-N 3.26Å; P325-F327 PolarHBondContact O-N 3.18Å; F327-L329 HydrophobicContact CE1-CD2 3.64Å; F327-L329 HydrophobicContact CE1-CG 3.92Å; F327-L329 HydrophobicContact CZ-CD2 3.67Å; F327-L329 HydrophobicContact CZ-CG 4.42Å; F327-K341 WeakPolarHBondContact O-CE 3.44Å; F327-K341 PolarHBondContact O-NZ 3.5Å; F327-I440 HydrophobicContact CE2-CD1 3.78Å; F327-I440 HydrophobicContact CZ-CD1 3.96Å
328	Q	77.1	Confident	82.5	Confident	118 Å²	118	55 Å²	55	55%	0.551	28%	0.284	S	S	*	.			trans	-135.4	140.6	179.3	-68.6	-174.1	-17.1	0	0	112.1	F330	Q328-F330 VanDerWaalsContact C-N 3.26Å; Q328-F330 PolarHBondContact O-N 3.42Å
329	L	79.8	Confident	82.5	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	31%	0.312	C	S	.	.			trans	-88.6	59.4	170.6	-66	178.9	0	0	0	110.6	Y73 F74 F327 T331 N340 K341 L344	Y73-L329 HydrophobicContact CD1-CD2 3.8Å; Y73-L329 VanDerWaalsContact CD2-C 3.45Å; Y73-L329 HydrophobicContact CD2-CB 3.77Å; Y73-L329 HydrophobicContact CD2-CD2 4.12Å; Y73-L329 WeakPolarHBondContact CD2-O 3.32Å; Y73-L329 HydrophobicContact CE1-CD2 3.58Å; Y73-L329 HydrophobicContact CE2-CB 4.05Å; Y73-L329 HydrophobicContact CE2-CD2 3.91Å; Y73-L329 HydrophobicContact CG-CB 4.11Å; Y73-L329 HydrophobicContact CG-CD2 4.05Å; F74-L329 HydrophobicContact CE2-CD1 4.21Å; F74-L329 HydrophobicContact CE2-CD2 4.49Å; F74-L329 HydrophobicContact CZ-CD2 4.37Å; F327-L329 HydrophobicContact CE1-CD2 3.64Å; F327-L329 HydrophobicContact CE1-CG 3.92Å; F327-L329 HydrophobicContact CZ-CD2 3.67Å; F327-L329 HydrophobicContact CZ-CG 4.42Å; L329-T331 PolarHBondContact O-N 3.04Å; L329-N340 HydrophobicContact CD1-CB 3.92Å; L329-K341 HydrophobicContact CD1-CB 4.35Å; L329-L344 HydrophobicContact CD1-CB 4.43Å; L329-L344 HydrophobicContact CD1-CD1 4.16Å; L329-L344 HydrophobicContact CD2-CD1 4.41Å
330	F	76.8	Confident	82.3	Confident	89 Å²	89	61.9 Å²	61.9	39%	0.39	32%	0.317	S	S	.	.			trans	-62.4	120.8	-171.2	-176.2	-109.3	0	0	0	113.1	G112 Q328 D337	G112-F330 WeakPolarHBondContact O-CD1 3.35Å; G112-F330 WeakPolarHBondContact O-CE1 3.32Å; Q328-F330 VanDerWaalsContact C-N 3.26Å; Q328-F330 PolarHBondContact O-N 3.42Å; F330-D337 WeakPolarHBondContact CA-OD2 3.42Å
331	T	69.8	Low	82.4	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.018	31%	0.307	C	S	.	.	S	Bend	trans	-122.7	-13.1	171.4	69.3	0	0	0	0	113.3	D72 Y73 P110 G112 I113 L329 D337	D72-T331 HydrophobicContact CB-CG2 4.26Å; Y73-T331 HydrophobicContact CD2-CG2 3.98Å; Y73-T331 HydrophobicContact CG-CG2 4.38Å; P110-T331 WeakPolarHBondContact CB-O 3.03Å; G112-T331 WeakPolarHBondContact CA-O 3.46Å; G112-T331 PolarHBondContact N-O 3.01Å; G112-T331 VanDerWaalsContact N-O 3.09Å; I113-T331 HydrophobicContact CD1-CG2 4.17Å; I113-T331 HydrophobicContact CG1-CG2 4.35Å; L329-T331 PolarHBondContact O-N 3.04Å; T331-D337 VanDerWaalsContact CB-OD1 3.32Å; T331-D337 WeakPolarHBondContact CB-OD1 3.38Å; T331-D337 WeakPolarHBondContact CG2-OD1 3.44Å; T331-D337 PolarHBondContact N-OD1 3.27Å; T331-D337 VanDerWaalsContact N-OD1 3.14Å; T331-D337 PolarHBondContact N-OD2 3.18Å; T331-D337 PolarHBondContact OG1-OD1 3.46Å
332	G	67.6	Low	82.8	Confident	50 Å²	50	65.1 Å²	65.1	52%	0.515	33%	0.329	S	S	.	.	S	Bend	trans	109.8	-19	-174.9	0	0	0	0	0	112.8
333	N	75.7	Confident	83.1	Confident	64 Å²	64	66 Å²	66	34%	0.342	33%	0.334	S	S	.	.			trans	-104.3	97.5	173.7	-173.5	-15.6	0	0	0	111.3	I335 Q336 D337	N333-I335 VanDerWaalsContact C-N 3.25Å; N333-I335 PolarHBondContact O-N 3.33Å; N333-I335 VanDerWaalsContact O-N 3.13Å; N333-I335 PolarHBondContact OD1-N 2.85Å; N333-Q336 HydrophobicContact CB-CB 4.18Å; N333-Q336 WeakPolarHBondContact ND2-CG 3.45Å; N333-Q336 PolarHBondContact ND2-OE1 2.78Å; N333-Q336 PolarHBondContact O-N 2.87Å; N333-D337 WeakPolarHBondContact O-CB 3.49Å; N333-D337 PolarHBondContact O-N 3.19Å
334	K	78	Confident	83.4	Confident	169 Å²	169	61.9 Å²	61.9	74%	0.735	32%	0.315	S	S	*	.	H	α-helix	trans	-54.5	-35.9	-175.8	-67.2	-174	177.8	-176.2	0	114.6	E338	K334-E338 PolarHBondContact O-N 3.42Å
335	I	85	Confident	84	Confident	122 Å²	122	61.9 Å²	61.9	63%	0.626	32%	0.316	S	S	*	.	H	α-helix	trans	-70.3	-49.1	-177.6	-58.7	172.7	0	0	0	109.4	N333 D337 E338 E339	N333-I335 VanDerWaalsContact C-N 3.25Å; N333-I335 PolarHBondContact O-N 3.33Å; N333-I335 VanDerWaalsContact O-N 3.13Å; N333-I335 PolarHBondContact OD1-N 2.85Å; I335-D337 VanDerWaalsContact C-N 3.3Å; I335-D337 PolarHBondContact O-N 2.94Å; I335-E338 PolarHBondContact O-N 3.4Å; I335-E339 WeakPolarHBondContact O-CG 3.23Å; I335-E339 PolarHBondContact O-N 3.43Å
336	Q	81.2	Confident	84.9	Confident	77 Å²	77	62 Å²	62	36%	0.36	31%	0.31	S	S	.	.	H	α-helix	trans	-66.3	-33.5	177.6	-72.3	177.5	-24.7	0	0	112.1	N333 E339 N340	N333-Q336 HydrophobicContact CB-CB 4.18Å; N333-Q336 WeakPolarHBondContact ND2-CG 3.45Å; N333-Q336 PolarHBondContact ND2-OE1 2.78Å; N333-Q336 PolarHBondContact O-N 2.87Å; Q336-E339 PolarHBondContact O-N 3.19Å; Q336-N340 VanDerWaalsContact O-CB 3.25Å; Q336-N340 WeakPolarHBondContact O-CB 3.43Å; Q336-N340 PolarHBondContact O-N 3.47Å; Q336-N340 PolarHBondContact O-ND2 3.44Å
337	D	79.9	Confident	86	Confident	11 Å²	11	57.7 Å²	57.7	6%	0.059	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-43.2	177.7	-67.1	-10.5	0	0	0	111.3	F330 T331 N333 I335 K341	F330-D337 WeakPolarHBondContact CA-OD2 3.42Å; T331-D337 VanDerWaalsContact CB-OD1 3.32Å; T331-D337 WeakPolarHBondContact CB-OD1 3.38Å; T331-D337 WeakPolarHBondContact CG2-OD1 3.44Å; T331-D337 PolarHBondContact N-OD1 3.27Å; T331-D337 VanDerWaalsContact N-OD1 3.14Å; T331-D337 PolarHBondContact N-OD2 3.18Å; T331-D337 PolarHBondContact OG1-OD1 3.46Å; N333-D337 WeakPolarHBondContact O-CB 3.49Å; N333-D337 PolarHBondContact O-N 3.19Å; I335-D337 VanDerWaalsContact C-N 3.3Å; I335-D337 PolarHBondContact O-N 2.94Å; D337-K341 WeakPolarHBondContact O-CB 3.34Å; D337-K341 PolarHBondContact O-N 3.44Å
338	E	89.1	Confident	86.7	Confident	96 Å²	96	56.7 Å²	56.7	45%	0.449	28%	0.283	S	S	.	.	H	α-helix	trans	-69.8	-42.3	174.9	-71	-60.7	155.7	0	0	112.3	K334 I335 N340 K341 M342	K334-E338 PolarHBondContact O-N 3.42Å; I335-E338 PolarHBondContact O-N 3.4Å; E338-N340 VanDerWaalsContact C-N 3.32Å; E338-N340 PolarHBondContact O-N 2.81Å; E338-K341 PolarHBondContact O-N 3.46Å; E338-M342 WeakPolarHBondContact O-CG 3.3Å; E338-M342 PolarHBondContact O-N 2.99Å
339	E	94.3	Very high	87.6	Confident	123 Å²	123	55.3 Å²	55.3	58%	0.575	28%	0.276	S	S	*	.	H	α-helix	trans	-59.5	-42.9	174.8	-73.8	178.3	175.4	0	0	111.8	I335 Q336 M342 L343	I335-E339 WeakPolarHBondContact O-CG 3.23Å; I335-E339 PolarHBondContact O-N 3.43Å; Q336-E339 PolarHBondContact O-N 3.19Å; E339-M342 PolarHBondContact O-N 3.31Å; E339-L343 WeakPolarHBondContact O-CB 3.5Å; E339-L343 PolarHBondContact O-N 2.96Å
340	N	89.6	Confident	88.3	Confident	22 Å²	22	57.5 Å²	57.5	12%	0.118	29%	0.286	C	S	.	.	H	α-helix	trans	-67.9	-37.7	176.1	-75.4	-42.2	0	0	0	111.7	S71 L329 Q336 E338 L343 L344	S71-N340 VanDerWaalsContact CB-OD1 3.28Å; S71-N340 WeakPolarHBondContact CB-OD1 3.37Å; L329-N340 HydrophobicContact CD1-CB 3.92Å; Q336-N340 VanDerWaalsContact O-CB 3.25Å; Q336-N340 WeakPolarHBondContact O-CB 3.43Å; Q336-N340 PolarHBondContact O-N 3.47Å; Q336-N340 PolarHBondContact O-ND2 3.44Å; E338-N340 VanDerWaalsContact C-N 3.32Å; E338-N340 PolarHBondContact O-N 2.81Å; N340-L343 PolarHBondContact O-N 3.28Å; N340-L344 VanDerWaalsContact O-CB 3.3Å; N340-L344 WeakPolarHBondContact O-CB 3.38Å; N340-L344 PolarHBondContact O-N 2.92Å
341	K	92.6	Very high	89.1	Confident	19 Å²	19	53.5 Å²	53.5	8%	0.083	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-45.5	175.8	-177.7	177.1	177.4	175.1	0	110.4	R324 P325 F327 L329 D337 E338 L344 L345	R324-K341 PolarHBondContact O-NZ 2.89Å; R324-K341 VanDerWaalsContact O-NZ 3.09Å; P325-K341 PolarHBondContact O-NZ 3.14Å; F327-K341 WeakPolarHBondContact O-CE 3.44Å; F327-K341 PolarHBondContact O-NZ 3.5Å; L329-K341 HydrophobicContact CD1-CB 4.35Å; D337-K341 WeakPolarHBondContact O-CB 3.34Å; D337-K341 PolarHBondContact O-N 3.44Å; E338-K341 PolarHBondContact O-N 3.46Å; K341-L344 PolarHBondContact O-N 3.21Å; K341-L345 HydrophobicContact CG-CD1 4.24Å; K341-L345 WeakPolarHBondContact O-CG 3.42Å; K341-L345 PolarHBondContact O-N 3.08Å
342	M	97.3	Very high	90.1	Very high	99 Å²	99	59.1 Å²	59.1	49%	0.488	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-48.3	175.3	-72.8	-57.4	-56.9	0	0	111.8	E338 E339 L344 L345 E346	E338-M342 WeakPolarHBondContact O-CG 3.3Å; E338-M342 PolarHBondContact O-N 2.99Å; E339-M342 PolarHBondContact O-N 3.31Å; M342-L344 VanDerWaalsContact C-N 3.31Å; M342-L344 PolarHBondContact O-N 2.89Å; M342-L345 PolarHBondContact O-N 3.46Å; M342-E346 VanDerWaalsContact O-CG 3.29Å; M342-E346 WeakPolarHBondContact O-CG 3.49Å; M342-E346 PolarHBondContact O-N 3.35Å
343	L	97.9	Very high	91.1	Very high	21 Å²	21	60.2 Å²	60.2	11%	0.11	29%	0.293	C	S	.	.	H	α-helix	trans	-58.6	-42.6	177.4	179.2	59.7	0	0	0	112	R64 K67 L68 E339 N340 E346 I347	R64-L343 HydrophobicContact CB-CD1 4.35Å; K67-L343 HydrophobicContact CB-CD2 4.33Å; K67-L343 HydrophobicContact CD-CD2 4.18Å; K67-L343 HydrophobicContact CG-CD2 4.08Å; L68-L343 HydrophobicContact CB-CD2 4.03Å; L68-L343 HydrophobicContact CB-CG 4.4Å; L68-L343 HydrophobicContact CD1-CB 4.5Å; L68-L343 HydrophobicContact CD1-CD2 4.2Å; L68-L343 HydrophobicContact CD1-CG 4.28Å; E339-L343 WeakPolarHBondContact O-CB 3.5Å; E339-L343 PolarHBondContact O-N 2.96Å; N340-L343 PolarHBondContact O-N 3.28Å; L343-E346 PolarHBondContact O-N 2.86Å; L343-I347 HydrophobicContact CD1-CD1 4.13Å; L343-I347 HydrophobicContact CG-CD1 4.03Å; L343-I347 WeakPolarHBondContact O-CD1 3.5Å; L343-I347 VanDerWaalsContact O-CG1 3.29Å; L343-I347 WeakPolarHBondContact O-CG1 3.43Å; L343-I347 PolarHBondContact O-N 3.42Å
344	L	97.6	Very high	91.6	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-47.6	175.7	177.2	148.3	0	0	0	111.5	L68 F74 F322 L329 N340 K341 M342 E346 I347 L348 F444	L68-L344 HydrophobicContact CD1-CB 4.16Å; L68-L344 HydrophobicContact CD2-CB 4.19Å; L68-L344 HydrophobicContact CD2-CD1 4.43Å; L68-L344 HydrophobicContact CD2-CG 4.45Å; F74-L344 HydrophobicContact CE2-CD1 4.17Å; F74-L344 HydrophobicContact CZ-CD1 3.68Å; F322-L344 HydrophobicContact CB-CD2 3.77Å; F322-L344 HydrophobicContact CD1-CD1 4.34Å; F322-L344 HydrophobicContact CD1-CD2 3.74Å; F322-L344 HydrophobicContact CD2-CD2 4.32Å; F322-L344 HydrophobicContact CE1-CD1 4.3Å; F322-L344 HydrophobicContact CE1-CD2 4.42Å; F322-L344 HydrophobicContact CG-CD2 3.69Å; L329-L344 HydrophobicContact CD1-CB 4.43Å; L329-L344 HydrophobicContact CD1-CD1 4.16Å; L329-L344 HydrophobicContact CD2-CD1 4.41Å; N340-L344 VanDerWaalsContact O-CB 3.3Å; N340-L344 WeakPolarHBondContact O-CB 3.38Å; N340-L344 PolarHBondContact O-N 2.92Å; K341-L344 PolarHBondContact O-N 3.21Å; M342-L344 VanDerWaalsContact C-N 3.31Å; M342-L344 PolarHBondContact O-N 2.89Å; L344-E346 PolarHBondContact O-N 3.4Å; L344-I347 WeakPolarHBondContact O-CB 3.49Å; L344-I347 PolarHBondContact O-N 2.84Å; L344-L348 HydrophobicContact CD2-CD1 3.53Å; L344-L348 HydrophobicContact CD2-CG 4.21Å; L344-L348 HydrophobicContact CG-CD1 4.33Å; L344-L348 WeakPolarHBondContact O-CG 3.16Å; L344-L348 PolarHBondContact O-N 3.07Å; L344-F444 HydrophobicContact CD1-CE1 4.15Å; L344-F444 HydrophobicContact CD1-CE2 3.87Å; L344-F444 HydrophobicContact CD1-CZ 3.59Å; L344-F444 HydrophobicContact CD2-CZ 4.43Å; L344-F444 HydrophobicContact CG-CE1 4.21Å; L344-F444 HydrophobicContact CG-CZ 3.88Å
345	L	97.9	Very high	91.5	Very high	23 Å²	23	54 Å²	54	12%	0.12	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-43.9	179.2	-73.7	172.5	0	0	0	111.5	L319 F322 E323 K341 M342 I347 L348 H349	L319-L345 HydrophobicContact CD1-CD2 4.04Å; F322-L345 HydrophobicContact CB-CD2 3.98Å; E323-L345 HydrophobicContact CG-CD2 3.94Å; K341-L345 HydrophobicContact CG-CD1 4.24Å; K341-L345 WeakPolarHBondContact O-CG 3.42Å; K341-L345 PolarHBondContact O-N 3.08Å; M342-L345 PolarHBondContact O-N 3.46Å; L345-I347 VanDerWaalsContact C-N 3.31Å; L345-I347 PolarHBondContact O-N 2.91Å; L345-L348 PolarHBondContact O-N 3.46Å; L345-H349 PolarHBondContact O-CD2 3.45Å; L345-H349 PolarHBondContact O-N 3.37Å
346	E	97.8	Very high	90.8	Very high	82 Å²	82	49.3 Å²	49.3	38%	0.383	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-39.3	177.4	-62	169.4	171.4	0	0	112.2	R64 M342 L343 L344 H349 E350	R64-E346 IonicContact CZ-OE2 3.74Å; R64-E346 IonicContact NH2-OE2 2.72Å; R64-E346 PolarHBondContact NH2-OE2 3.28Å; M342-E346 VanDerWaalsContact O-CG 3.29Å; M342-E346 WeakPolarHBondContact O-CG 3.49Å; M342-E346 PolarHBondContact O-N 3.35Å; L343-E346 PolarHBondContact O-N 2.86Å; L344-E346 PolarHBondContact O-N 3.4Å; E346-H349 PolarHBondContact O-N 3.5Å; E346-E350 WeakPolarHBondContact O-CG 3.3Å; E346-E350 PolarHBondContact O-N 3.04Å
347	I	98.1	Very high	89.8	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-47.3	173.5	-74.3	162.9	0	0	0	110.4	L61 R64 L68 L343 L344 L345 H349 E350 I351	L61-I347 HydrophobicContact CD1-CG2 3.85Å; R64-I347 HydrophobicContact CB-CD1 4.2Å; R64-I347 HydrophobicContact CB-CG1 4.04Å; L68-I347 HydrophobicContact CB-CD1 3.88Å; L68-I347 HydrophobicContact CD2-CD1 3.84Å; L68-I347 HydrophobicContact CG-CD1 4.4Å; L343-I347 HydrophobicContact CD1-CD1 4.13Å; L343-I347 HydrophobicContact CG-CD1 4.03Å; L343-I347 WeakPolarHBondContact O-CD1 3.5Å; L343-I347 VanDerWaalsContact O-CG1 3.29Å; L343-I347 WeakPolarHBondContact O-CG1 3.43Å; L343-I347 PolarHBondContact O-N 3.42Å; L344-I347 WeakPolarHBondContact O-CB 3.49Å; L344-I347 PolarHBondContact O-N 2.84Å; L345-I347 VanDerWaalsContact C-N 3.31Å; L345-I347 PolarHBondContact O-N 2.91Å; I347-H349 VanDerWaalsContact C-N 3.33Å; I347-H349 PolarHBondContact O-N 3.39Å; I347-E350 PolarHBondContact O-N 3.32Å; I347-I351 HydrophobicContact CG2-CD1 3.95Å; I347-I351 VanDerWaalsContact O-CG1 3.3Å; I347-I351 WeakPolarHBondContact O-CG1 3.43Å; I347-I351 PolarHBondContact O-N 2.98Å
348	L	97.1	Very high	88.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-35	179.5	-68.1	-178.6	0	0	0	112.4	L315 L319 F322 L344 L345 I351 K352 F444	L315-L348 HydrophobicContact CB-CD2 3.99Å; L315-L348 HydrophobicContact CD2-CD2 3.99Å; L319-L348 HydrophobicContact CB-CB 4.44Å; L319-L348 HydrophobicContact CD1-CB 3.59Å; L319-L348 HydrophobicContact CD1-CD1 4.08Å; F322-L348 HydrophobicContact CB-CD1 4.01Å; F322-L348 HydrophobicContact CD2-CD1 3.45Å; F322-L348 VanDerWaalsContact CD2-CD1 3.45Å; F322-L348 HydrophobicContact CE2-CD1 4.16Å; F322-L348 HydrophobicContact CG-CD1 3.91Å; L344-L348 HydrophobicContact CD2-CD1 3.53Å; L344-L348 HydrophobicContact CD2-CG 4.21Å; L344-L348 HydrophobicContact CG-CD1 4.33Å; L344-L348 WeakPolarHBondContact O-CG 3.16Å; L344-L348 PolarHBondContact O-N 3.07Å; L345-L348 PolarHBondContact O-N 3.46Å; L348-I351 HydrophobicContact CD2-CD1 4.39Å; L348-I351 PolarHBondContact O-N 3.01Å; L348-K352 WeakPolarHBondContact O-CB 3.37Å; L348-K352 PolarHBondContact O-N 3.05Å; L348-F444 HydrophobicContact CD1-CZ 4.39Å; L348-F444 HydrophobicContact CD2-CE1 4.04Å; L348-F444 HydrophobicContact CD2-CZ 3.99Å; L348-F444 HydrophobicContact CG-CZ 4.39Å
349	H	96.4	Very high	87.1	Confident	89 Å²	89	52.6 Å²	52.6	41%	0.412	27%	0.265	S	S	.	.	H	α-helix	trans	-65.9	-42.2	172.4	-76.6	-59.3	0	0	0	112.4	E323 L345 E346 I347 I351 K352 S353	E323-H349 IonicContact OE1-CE1 3.5Å; E323-H349 PolarHBondContact OE1-CE1 2.67Å; E323-H349 IonicContact OE1-NE2 3.74Å; L345-H349 PolarHBondContact O-CD2 3.45Å; L345-H349 PolarHBondContact O-N 3.37Å; E346-H349 PolarHBondContact O-N 3.5Å; I347-H349 VanDerWaalsContact C-N 3.33Å; I347-H349 PolarHBondContact O-N 3.39Å; H349-I351 VanDerWaalsContact C-N 3.33Å; H349-I351 PolarHBondContact O-N 3.34Å; H349-K352 PolarHBondContact O-N 3Å; H349-S353 PolarHBondContact O-N 3.25Å
350	E	94.8	Very high	85	Confident	47 Å²	47	50.3 Å²	50.3	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-44.1	172.6	-74.1	-71.5	174.6	0	0	111.2	R60 R64 E346 I347 K352 S353 F354	R60-E350 IonicContact CZ-OE2 3.82Å; R60-E350 IonicContact NH1-OE2 2.7Å; R60-E350 PolarHBondContact NH1-OE2 3.06Å; R64-E350 VanDerWaalsContact NH1-CG 3.29Å; R64-E350 IonicContact NH1-OE1 3.45Å; R64-E350 PolarHBondContact NH1-OE1 3.05Å; E346-E350 WeakPolarHBondContact O-CG 3.3Å; E346-E350 PolarHBondContact O-N 3.04Å; I347-E350 PolarHBondContact O-N 3.32Å; E350-K352 VanDerWaalsContact C-N 3.33Å; E350-K352 PolarHBondContact O-N 3.31Å; E350-S353 WeakPolarHBondContact O-CB 3.25Å; E350-S353 PolarHBondContact O-N 3.09Å; E350-S353 VanDerWaalsContact O-N 3.12Å; E350-S353 PolarHBondContact O-OG 3.2Å; E350-F354 PolarHBondContact O-N 3.33Å
351	I	93.3	Very high	83.2	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-58.8	-44.5	175	-71.1	174	0	0	0	111.1	L61 L312 L315 I347 L348 H349 S353 F354 F447	L61-I351 HydrophobicContact CD1-CD1 4.2Å; L61-I351 HydrophobicContact CD1-CG1 3.87Å; L61-I351 HydrophobicContact CD2-CG1 4.31Å; L312-I351 HydrophobicContact CD1-CB 4.12Å; L312-I351 HydrophobicContact CD1-CD1 4.18Å; L312-I351 HydrophobicContact CD1-CG1 3.7Å; L312-I351 HydrophobicContact CD1-CG2 3.62Å; L312-I351 HydrophobicContact CG-CG2 3.93Å; L312-I351 VanDerWaalsContact O-CG2 3.28Å; L312-I351 WeakPolarHBondContact O-CG2 3.47Å; L315-I351 HydrophobicContact CB-CD1 3.89Å; L315-I351 HydrophobicContact CB-CG2 4.09Å; L315-I351 HydrophobicContact CD1-CD1 3.79Å; L315-I351 HydrophobicContact CG-CD1 4.45Å; I347-I351 HydrophobicContact CG2-CD1 3.95Å; I347-I351 VanDerWaalsContact O-CG1 3.3Å; I347-I351 WeakPolarHBondContact O-CG1 3.43Å; I347-I351 PolarHBondContact O-N 2.98Å; L348-I351 HydrophobicContact CD2-CD1 4.39Å; L348-I351 PolarHBondContact O-N 3.01Å; H349-I351 VanDerWaalsContact C-N 3.33Å; H349-I351 PolarHBondContact O-N 3.34Å; I351-S353 VanDerWaalsContact C-N 3.26Å; I351-S353 PolarHBondContact O-N 3.35Å; I351-F354 WeakPolarHBondContact O-CB 3.41Å; I351-F354 PolarHBondContact O-N 3.15Å; I351-F447 HydrophobicContact CD1-CE1 4.27Å
352	K	90	Very high	81.2	Confident	122 Å²	122	56.6 Å²	56.6	53%	0.53	29%	0.293	S	S	.	.	H	α-helix	trans	-66.1	-27.3	176.8	-175.1	168.9	177.9	177	0	113	L319 L348 H349 E350 F354	L319-K352 HydrophobicContact CD2-CB 4.46Å; L319-K352 HydrophobicContact CD2-CD 3.39Å; L348-K352 WeakPolarHBondContact O-CB 3.37Å; L348-K352 PolarHBondContact O-N 3.05Å; H349-K352 PolarHBondContact O-N 3Å; E350-K352 VanDerWaalsContact C-N 3.33Å; E350-K352 PolarHBondContact O-N 3.31Å; K352-F354 VanDerWaalsContact C-N 3.28Å
353	S	89.2	Confident	78.9	Confident	72 Å²	72	53.2 Å²	53.2	50%	0.503	28%	0.275	S	S	.	.	H	α-helix	trans	-74.5	-17.2	176.6	81.6	0	0	0	0	113.6	H349 E350 I351	H349-S353 PolarHBondContact O-N 3.25Å; E350-S353 WeakPolarHBondContact O-CB 3.25Å; E350-S353 PolarHBondContact O-N 3.09Å; E350-S353 VanDerWaalsContact O-N 3.12Å; E350-S353 PolarHBondContact O-OG 3.2Å; I351-S353 VanDerWaalsContact C-N 3.26Å; I351-S353 PolarHBondContact O-N 3.35Å
354	F	85.9	Confident	76.9	Confident	15 Å²	15	54.1 Å²	54.1	7%	0.066	28%	0.279	C	S	.	.	S	Bend	trans	-66.8	126.9	179.2	-174.1	-103.4	0	0	0	110	T52 I53 F56 L309 L312 E350 I351 K352 L356	T52-F354 HydrophobicContact CG2-CE2 3.99Å; T52-F354 HydrophobicContact CG2-CZ 4.32Å; I53-F354 HydrophobicContact CG1-CZ 4.16Å; F56-F354 HydrophobicContact CB-CD2 3.87Å; F56-F354 HydrophobicContact CB-CE2 3.74Å; F56-F354 AromaticContact CD1-CD2 3.59Å; F56-F354 HydrophobicContact CD1-CD2 3.59Å; F56-F354 AromaticContact CD1-CE2 3.92Å; F56-F354 HydrophobicContact CD1-CE2 3.92Å; F56-F354 HydrophobicContact CD1-CG 4.22Å; F56-F354 AromaticContact CD2-CD2 3.72Å; F56-F354 HydrophobicContact CD2-CD2 3.72Å; F56-F354 HydrophobicContact CD2-CE2 4.46Å; F56-F354 HydrophobicContact CE1-CB 4.24Å; F56-F354 HydrophobicContact CE1-CD2 4.01Å; F56-F354 HydrophobicContact CE1-CG 4.23Å; F56-F354 HydrophobicContact CE2-CB 4.15Å; F56-F354 HydrophobicContact CE2-CD2 4.14Å; F56-F354 AromaticContact CG-CD2 3.43Å; F56-F354 HydrophobicContact CG-CD2 3.43Å; F56-F354 VanDerWaalsContact CG-CD2 3.43Å; F56-F354 AromaticContact CG-CE2 3.79Å; F56-F354 HydrophobicContact CG-CE2 3.79Å; F56-F354 HydrophobicContact CG-CG 4.39Å; F56-F354 HydrophobicContact CZ-CB 3.99Å; F56-F354 HydrophobicContact CZ-CD2 4.28Å; F56-F354 HydrophobicContact CZ-CG 4.41Å; L309-F354 HydrophobicContact CD2-CE1 4.09Å; L312-F354 HydrophobicContact CD2-CB 4.5Å; L312-F354 HydrophobicContact CD2-CD1 3.53Å; L312-F354 HydrophobicContact CD2-CE1 3.92Å; L312-F354 HydrophobicContact CD2-CG 4.1Å; E350-F354 PolarHBondContact O-N 3.33Å; I351-F354 WeakPolarHBondContact O-CB 3.41Å; I351-F354 PolarHBondContact O-N 3.15Å; K352-F354 VanDerWaalsContact C-N 3.28Å; F354-L356 HydrophobicContact CD1-CB 3.95Å; F354-L356 HydrophobicContact CE1-CB 4.32Å; F354-L356 HydrophobicContact CE1-CD1 4.46Å; F354-L356 PolarHBondContact O-N 3.04Å
355	P	76.6	Confident	74.4	Confident	87 Å²	87	56.6 Å²	56.6	57%	0.565	30%	0.299	S	S	*	.			trans	-76.5	70.4	-175.7	32.4	-36.2	0	0	0	110.9	H357	P355-H357 PolarHBondContact O-N 3.31Å
356	L	70.3	Confident	72	Confident	25 Å²	25	57.4 Å²	57.4	13%	0.131	31%	0.313	C	S	.	.			trans	-86.1	105.7	175.3	-174.2	58	0	0	0	109.8	L309 R313 F354	L309-L356 HydrophobicContact CD1-CD1 4.45Å; L309-L356 HydrophobicContact CD2-CD1 3.93Å; R313-L356 HydrophobicContact CB-CD2 3.8Å; R313-L356 HydrophobicContact CG-CD2 4.37Å; F354-L356 HydrophobicContact CD1-CB 3.95Å; F354-L356 HydrophobicContact CE1-CB 4.32Å; F354-L356 HydrophobicContact CE1-CD1 4.46Å; F354-L356 PolarHBondContact O-N 3.04Å
357	H	61.3	Low	70	Confident	136 Å²	136	59.5 Å²	59.5	63%	0.63	33%	0.327	S	S	*	.			trans	-87.8	105.6	165.5	-60.2	-64.5	0	0	0	108.1	T47 P355	T47-H357 PolarHBondContact OG1-O 3.4Å; P355-H357 PolarHBondContact O-N 3.31Å
358	F	58.9	Low	68.2	Low	16 Å²	16	68 Å²	68	7%	0.07	36%	0.363	C	S	.	.			trans	-113.2	125.3	172.8	-167.6	-94.1	0	0	0	106.7	I310 E360 F363 F364	I310-F358 HydrophobicContact CD1-CE2 3.89Å; I310-F358 HydrophobicContact CD1-CZ 4.06Å; F358-E360 HydrophobicContact CD1-CG 4.35Å; F358-E360 PolarHBondContact O-N 2.8Å; F358-F363 HydrophobicContact CE1-CB 3.91Å; F358-F363 AromaticContact CE1-CD2 3.95Å; F358-F363 HydrophobicContact CE1-CD2 3.95Å; F358-F363 HydrophobicContact CE1-CG 4.24Å; F358-F363 HydrophobicContact CE2-CD2 4.21Å; F358-F363 HydrophobicContact CZ-CB 3.86Å; F358-F363 AromaticContact CZ-CD2 3.41Å; F358-F363 HydrophobicContact CZ-CD2 3.41Å; F358-F363 VanDerWaalsContact CZ-CD2 3.41Å; F358-F363 HydrophobicContact CZ-CE2 4.14Å; F358-F363 AromaticContact CZ-CG 3.75Å; F358-F363 HydrophobicContact CZ-CG 3.75Å; F358-F364 AromaticContact CE1-CD2 3.93Å; F358-F364 HydrophobicContact CE1-CD2 3.93Å; F358-F364 AromaticContact CE1-CE2 3.89Å; F358-F364 HydrophobicContact CE1-CE2 3.89Å; F358-F364 HydrophobicContact CZ-CD2 4.47Å; F358-F364 HydrophobicContact CZ-CE2 4Å
359	D	52.1	Low	66.7	Low	100 Å²	100	76.7 Å²	76.7	54%	0.535	40%	0.402	S	S	.	.			trans	-75.9	93.9	173.7	-174.4	-4.6	0	0	0	108.5	N361 S362	D359-N361 PolarHBondContact O-N 3.47Å; D359-N361 VanDerWaalsContact O-N 3.13Å; D359-N361 WeakPolarHBondContact OD1-CB 3.42Å; D359-N361 PolarHBondContact OD1-N 3.04Å; D359-S362 PolarHBondContact O-N 3.1Å; D359-S362 PolarHBondContact O-OG 3.41Å
360	E	50.8	Low	65.2	Low	75 Å²	75	78.3 Å²	78.3	35%	0.35	41%	0.409	S	S	.	.	H	α-helix	trans	-61	-23.6	-175.2	-60.2	90.5	170.5	0	0	112.6	R313 F358 S362 F364 A365	R313-E360 IonicContact CZ-OE1 3.61Å; R313-E360 IonicContact NH2-OE1 2.72Å; R313-E360 PolarHBondContact NH2-OE1 3.07Å; F358-E360 HydrophobicContact CD1-CG 4.35Å; F358-E360 PolarHBondContact O-N 2.8Å; E360-S362 PolarHBondContact O-N 2.83Å; E360-F364 PolarHBondContact O-N 2.89Å; E360-A365 PolarHBondContact O-N 3.2Å
361	N	50.7	Low	63.8	Low	125 Å²	125	77.1 Å²	77.1	67%	0.668	41%	0.408	S	S	*	.	H	α-helix	trans	-72.7	-14.4	176.9	-68.4	-34.2	0	0	0	113.9	D359 A365	D359-N361 PolarHBondContact O-N 3.47Å; D359-N361 VanDerWaalsContact O-N 3.13Å; D359-N361 WeakPolarHBondContact OD1-CB 3.42Å; D359-N361 PolarHBondContact OD1-N 3.04Å; N361-A365 WeakPolarHBondContact OD1-CB 3.43Å
362	S	50.4	Low	62.6	Low	48 Å²	48	82.6 Å²	82.6	34%	0.336	43%	0.433	S	S	.	.	H	α-helix	trans	-91.4	-20.8	-177.4	67.9	0	0	0	0	114.6	D359 E360	D359-S362 PolarHBondContact O-N 3.1Å; D359-S362 PolarHBondContact O-OG 3.41Å; E360-S362 PolarHBondContact O-N 2.83Å
363	F	50.9	Low	61.8	Low	28 Å²	28	82.4 Å²	82.4	12%	0.123	43%	0.432	C	S	.	.	H	α-helix	trans	-125.9	-32.9	-174.9	-78.4	-88.4	0	0	0	115.8	D45 A246 F306 F358	D45-F363 HydrophobicContact CB-CZ 4.46Å; A246-F363 HydrophobicContact CB-CD1 3.97Å; A246-F363 HydrophobicContact CB-CE1 3.82Å; F306-F363 HydrophobicContact CE2-CZ 4.33Å; F306-F363 HydrophobicContact CZ-CE1 4.24Å; F306-F363 HydrophobicContact CZ-CZ 4.42Å; F358-F363 HydrophobicContact CE1-CB 3.91Å; F358-F363 AromaticContact CE1-CD2 3.95Å; F358-F363 HydrophobicContact CE1-CD2 3.95Å; F358-F363 HydrophobicContact CE1-CG 4.24Å; F358-F363 HydrophobicContact CE2-CD2 4.21Å; F358-F363 HydrophobicContact CZ-CB 3.86Å; F358-F363 AromaticContact CZ-CD2 3.41Å; F358-F363 HydrophobicContact CZ-CD2 3.41Å; F358-F363 VanDerWaalsContact CZ-CD2 3.41Å; F358-F363 HydrophobicContact CZ-CE2 4.14Å; F358-F363 AromaticContact CZ-CG 3.75Å; F358-F363 HydrophobicContact CZ-CG 3.75Å
364	F	54.4	Low	60.8	Low	41 Å²	41	79.9 Å²	79.9	18%	0.18	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-15.6	-170.1	-57.8	-69.3	0	0	0	114.2	F358 E360 G366 L412 L415 F416	F358-F364 AromaticContact CE1-CD2 3.93Å; F358-F364 HydrophobicContact CE1-CD2 3.93Å; F358-F364 AromaticContact CE1-CE2 3.89Å; F358-F364 HydrophobicContact CE1-CE2 3.89Å; F358-F364 HydrophobicContact CZ-CD2 4.47Å; F358-F364 HydrophobicContact CZ-CE2 4Å; E360-F364 PolarHBondContact O-N 2.89Å; F364-G366 PolarHBondContact O-N 2.72Å; F364-L412 HydrophobicContact CE1-CD2 4.46Å; F364-L412 HydrophobicContact CZ-CD2 4.46Å; F364-L415 HydrophobicContact CE2-CD1 4.12Å; F364-L415 HydrophobicContact CZ-CB 4.41Å; F364-L415 HydrophobicContact CZ-CD1 3.94Å; F364-F416 HydrophobicContact CD1-CD1 4.13Å; F364-F416 AromaticContact CD1-CE1 3.58Å; F364-F416 HydrophobicContact CD1-CE1 3.58Å; F364-F416 HydrophobicContact CD1-CE2 4.4Å; F364-F416 AromaticContact CD1-CZ 3.71Å; F364-F416 HydrophobicContact CD1-CZ 3.71Å; F364-F416 HydrophobicContact CE1-CE1 4.16Å; F364-F416 HydrophobicContact CE1-CE2 4.21Å; F364-F416 AromaticContact CE1-CZ 3.81Å; F364-F416 HydrophobicContact CE1-CZ 3.81Å
365	A	46.6	Very low	60.2	Low	53 Å²	53	81.2 Å²	81.2	44%	0.438	42%	0.418	S	S	.	.			trans	-93.8	62.3	174.6	0	0	0	0	0	112.2	E360 N361	E360-A365 PolarHBondContact O-N 3.2Å; N361-A365 WeakPolarHBondContact OD1-CB 3.43Å
366	G	47.4	Very low	60.2	Low	39 Å²	39	79.9 Å²	79.9	40%	0.402	41%	0.405	S	S	.	.	S	Bend	trans	-79.3	168.5	159.3	0	0	0	0	0	111.3	F364	F364-G366 PolarHBondContact O-N 2.72Å
367	D	54.3	Low	60.5	Low	126 Å²	126	80.1 Å²	80.1	67%	0.674	41%	0.406	S	S	*	.			trans	-48.4	145.9	168.5	-91.6	-33	0	0	0	110.3	K369 E370 A371	D367-K369 CarbonylContact O-C 3.47Å; D367-K369 PolarHBondContact O-N 3.33Å; D367-E370 HydrophobicContact CB-CG 4.46Å; D367-E370 PolarHBondContact O-N 3.5Å; D367-A371 PolarHBondContact O-N 2.96Å
368	K	61.6	Low	61.3	Low	179 Å²	179	73.8 Å²	73.8	78%	0.778	38%	0.377	S	S	*	.	H	α-helix	trans	-46.9	-33	-172.8	-73	-174.1	178.9	-177.9	0	114	H372	K368-H372 WeakPolarHBondContact O-CB 3.28Å; K368-H372 PolarHBondContact O-N 3.42Å
369	K	66	Low	62.2	Low	184 Å²	184	74.5 Å²	74.5	80%	0.8	38%	0.379	S	S	*	.	H	α-helix	trans	-75.8	-40	177.7	-71.1	-175.7	176.9	-180	0	113.3	D367 K373	D367-K369 CarbonylContact O-C 3.47Å; D367-K369 PolarHBondContact O-N 3.33Å; K369-K373 WeakPolarHBondContact O-CB 3.33Å; K369-K373 PolarHBondContact O-N 3.26Å
370	E	64.1	Low	63.5	Low	122 Å²	122	72.5 Å²	72.5	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-69.6	-45.6	179	-66	-177	158.1	0	0	110.7	D367 H372 K373 L374	D367-E370 HydrophobicContact CB-CG 4.46Å; D367-E370 PolarHBondContact O-N 3.5Å; E370-H372 VanDerWaalsContact C-N 3.31Å; E370-H372 PolarHBondContact O-N 3.49Å; E370-K373 PolarHBondContact O-N 2.69Å; E370-L374 VanDerWaalsContact O-CB 3.24Å; E370-L374 WeakPolarHBondContact O-CB 3.41Å; E370-L374 PolarHBondContact O-N 2.86Å
371	A	64.5	Low	65.1	Low	23 Å²	23	69.9 Å²	69.9	19%	0.19	36%	0.356	C	S	.	.	H	α-helix	trans	-61.1	-39.5	175.8	0	0	0	0	0	112.2	D367 K375	D367-A371 PolarHBondContact O-N 2.96Å; A371-K375 WeakPolarHBondContact O-CB 3.31Å; A371-K375 PolarHBondContact O-N 3.2Å
372	H	69.4	Low	66.6	Low	119 Å²	119	63.9 Å²	63.9	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-69.3	-41.7	176.2	-168.4	-63.7	0	0	0	112.3	K368 E370 L374 K375 E376	K368-H372 WeakPolarHBondContact O-CB 3.28Å; K368-H372 PolarHBondContact O-N 3.42Å; E370-H372 VanDerWaalsContact C-N 3.31Å; E370-H372 PolarHBondContact O-N 3.49Å; H372-L374 VanDerWaalsContact C-N 3.3Å; H372-K375 PolarHBondContact O-N 3.45Å; H372-E376 PolarHBondContact O-N 3.47Å; H372-E376 VanDerWaalsContact O-N 3.13Å
373	K	72.3	Confident	68.2	Low	117 Å²	117	65 Å²	65	51%	0.509	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-43.2	175.9	179.4	53.5	178.4	153.2	0	110.5	K369 E370 E376 D377	K369-K373 WeakPolarHBondContact O-CB 3.33Å; K369-K373 PolarHBondContact O-N 3.26Å; E370-K373 PolarHBondContact O-N 2.69Å; K373-E376 PolarHBondContact O-N 3.14Å; K373-D377 VanDerWaalsContact CE-OD1 3.3Å; K373-D377 WeakPolarHBondContact CE-OD1 3.45Å; K373-D377 WeakPolarHBondContact CE-OD2 3.29Å; K373-D377 IonicContact NZ-OD1 3.61Å; K373-D377 PolarHBondContact NZ-OD1 2.82Å; K373-D377 IonicContact NZ-OD2 2.67Å; K373-D377 WeakPolarHBondContact O-CB 3.43Å; K373-D377 VanDerWaalsContact O-CG 3.24Å; K373-D377 PolarHBondContact O-N 3.23Å
374	L	69.6	Low	69.8	Low	19 Å²	19	65.3 Å²	65.3	10%	0.099	32%	0.323	C	S	.	.	H	α-helix	trans	-64.1	-44	178.9	-175.6	61	0	0	0	112.6	E243 E370 H372 E376 D377 F378 F416	E243-L374 HydrophobicContact CB-CD1 3.57Å; E243-L374 HydrophobicContact CB-CD2 4.16Å; E243-L374 HydrophobicContact CB-CG 4.46Å; E243-L374 HydrophobicContact CG-CD1 3.56Å; E243-L374 HydrophobicContact CG-CD2 3.39Å; E243-L374 HydrophobicContact CG-CG 4.06Å; E370-L374 VanDerWaalsContact O-CB 3.24Å; E370-L374 WeakPolarHBondContact O-CB 3.41Å; E370-L374 PolarHBondContact O-N 2.86Å; H372-L374 VanDerWaalsContact C-N 3.3Å; L374-E376 VanDerWaalsContact C-N 3.31Å; L374-E376 PolarHBondContact O-N 2.85Å; L374-D377 PolarHBondContact O-N 3.25Å; L374-F378 HydrophobicContact CD1-CD2 3.76Å; L374-F378 HydrophobicContact CD1-CE2 3.5Å; L374-F378 HydrophobicContact CD2-CE2 4.1Å; L374-F378 HydrophobicContact CG-CD2 3.76Å; L374-F378 HydrophobicContact CG-CE2 3.68Å; L374-F378 VanDerWaalsContact O-CD2 3.3Å; L374-F378 WeakPolarHBondContact O-CD2 3.27Å; L374-F378 PolarHBondContact O-N 3.44Å; L374-F416 HydrophobicContact CD2-CE1 4.01Å; L374-F416 HydrophobicContact CD2-CZ 3.97Å; L374-F416 HydrophobicContact CG-CE1 4.23Å; L374-F416 HydrophobicContact CG-CZ 3.97Å
375	K	72.6	Confident	71.4	Confident	43 Å²	43	63.4 Å²	63.4	19%	0.187	32%	0.315	C	S	.	.	H	α-helix	trans	-54.3	-49.3	173.8	-177.9	-170	177.4	-171.7	0	110.9	F165 A371 H372 D377 F378 R379 F416	F165-K375 HydrophobicContact CE1-CG 4.5Å; F165-K375 HydrophobicContact CZ-CD 4.47Å; F165-K375 HydrophobicContact CZ-CG 3.78Å; A371-K375 WeakPolarHBondContact O-CB 3.31Å; A371-K375 PolarHBondContact O-N 3.2Å; H372-K375 PolarHBondContact O-N 3.45Å; K375-D377 VanDerWaalsContact C-N 3.34Å; K375-F378 PolarHBondContact O-N 3.32Å; K375-R379 WeakPolarHBondContact O-CB 3.24Å; K375-R379 PolarHBondContact O-N 3.1Å; K375-F416 HydrophobicContact CB-CB 4.26Å; K375-F416 HydrophobicContact CB-CD1 3.99Å; K375-F416 HydrophobicContact CB-CD2 4.13Å; K375-F416 HydrophobicContact CB-CE1 4.36Å; K375-F416 HydrophobicContact CB-CG 3.88Å; K375-F416 HydrophobicContact CD-CB 3.95Å; K375-F416 HydrophobicContact CD-CG 4.48Å; K375-F416 HydrophobicContact CG-CB 3.83Å; K375-F416 HydrophobicContact CG-CD1 4.46Å; K375-F416 HydrophobicContact CG-CD2 4Å; K375-F416 HydrophobicContact CG-CG 3.86Å
376	E	77.2	Confident	73.3	Confident	59 Å²	59	61.2 Å²	61.2	28%	0.276	30%	0.296	S	S	.	.	H	α-helix	trans	-66.2	-38.5	-179.2	-179.9	55.8	-163.1	0	0	112.4	H372 K373 L374 R379 L380	H372-E376 PolarHBondContact O-N 3.47Å; H372-E376 VanDerWaalsContact O-N 3.13Å; K373-E376 PolarHBondContact O-N 3.14Å; L374-E376 VanDerWaalsContact C-N 3.31Å; L374-E376 PolarHBondContact O-N 2.85Å; E376-R379 WeakPolarHBondContact O-CB 3.49Å; E376-R379 PolarHBondContact O-N 3.13Å; E376-R379 IonicContact OE1-CZ 3.85Å; E376-R379 IonicContact OE1-NE 3.09Å; E376-R379 PolarHBondContact OE1-NE 3.28Å; E376-R379 IonicContact OE1-NH2 3.75Å; E376-R379 PolarHBondContact OE1-NH2 2.98Å; E376-R379 IonicContact OE2-CZ 3.17Å; E376-R379 IonicContact OE2-NE 2.68Å; E376-R379 PolarHBondContact OE2-NE 3.44Å; E376-R379 IonicContact OE2-NH2 2.68Å; E376-L380 PolarHBondContact O-N 3.43Å
377	D	76.1	Confident	75.2	Confident	30 Å²	30	63.6 Å²	63.6	16%	0.16	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-47.6	177.7	-85.7	0.6	0	0	0	111.1	F209 K373 L374 K375 R379 L380 H381	F209-D377 HydrophobicContact CD1-CB 4.24Å; F209-D377 HydrophobicContact CE1-CB 3.8Å; K373-D377 VanDerWaalsContact CE-OD1 3.3Å; K373-D377 WeakPolarHBondContact CE-OD1 3.45Å; K373-D377 WeakPolarHBondContact CE-OD2 3.29Å; K373-D377 IonicContact NZ-OD1 3.61Å; K373-D377 PolarHBondContact NZ-OD1 2.82Å; K373-D377 IonicContact NZ-OD2 2.67Å; K373-D377 WeakPolarHBondContact O-CB 3.43Å; K373-D377 VanDerWaalsContact O-CG 3.24Å; K373-D377 PolarHBondContact O-N 3.23Å; L374-D377 PolarHBondContact O-N 3.25Å; K375-D377 VanDerWaalsContact C-N 3.34Å; D377-R379 VanDerWaalsContact C-N 3.35Å; D377-R379 PolarHBondContact O-N 2.99Å; D377-L380 PolarHBondContact O-N 3.42Å; D377-H381 PolarHBondContact O-CD2 3.43Å; D377-H381 PolarHBondContact O-N 3.11Å; D377-H381 VanDerWaalsContact O-N 3.09Å
378	F	76.8	Confident	77	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-59.6	-44.5	171	-85.5	-72.3	0	0	0	112	F247 L374 K375 L380 H381 F382 L412 F416	F247-F378 HydrophobicContact CB-CE1 3.88Å; F247-F378 HydrophobicContact CB-CZ 4.41Å; F247-F378 HydrophobicContact CD2-CD1 4.04Å; F247-F378 AromaticContact CD2-CE1 3.83Å; F247-F378 HydrophobicContact CD2-CE1 3.83Å; F247-F378 HydrophobicContact CG-CE1 4.36Å; L374-F378 HydrophobicContact CD1-CD2 3.76Å; L374-F378 HydrophobicContact CD1-CE2 3.5Å; L374-F378 HydrophobicContact CD2-CE2 4.1Å; L374-F378 HydrophobicContact CG-CD2 3.76Å; L374-F378 HydrophobicContact CG-CE2 3.68Å; L374-F378 VanDerWaalsContact O-CD2 3.3Å; L374-F378 WeakPolarHBondContact O-CD2 3.27Å; L374-F378 PolarHBondContact O-N 3.44Å; K375-F378 PolarHBondContact O-N 3.32Å; F378-L380 VanDerWaalsContact C-N 3.29Å; F378-L380 PolarHBondContact O-N 3.49Å; F378-H381 PolarHBondContact O-N 3.07Å; F378-F382 HydrophobicContact CD1-CD2 4.45Å; F378-F382 AromaticContact CD1-CE2 3.95Å; F378-F382 HydrophobicContact CD1-CE2 3.95Å; F378-F382 VanDerWaalsContact O-CD2 3.29Å; F378-F382 WeakPolarHBondContact O-CD2 3.37Å; F378-F382 PolarHBondContact O-N 2.81Å; F378-L412 HydrophobicContact CB-CD1 4.5Å; F378-L412 HydrophobicContact CD1-CD1 3.83Å; F378-L412 HydrophobicContact CE1-CD1 4.28Å; F378-L412 HydrophobicContact CG-CD1 4.26Å; F378-F416 HydrophobicContact CB-CE2 4.48Å; F378-F416 AromaticContact CD2-CE2 3.86Å; F378-F416 HydrophobicContact CD2-CE2 3.86Å; F378-F416 AromaticContact CD2-CZ 3.75Å; F378-F416 HydrophobicContact CD2-CZ 3.75Å; F378-F416 HydrophobicContact CE2-CE2 4.49Å; F378-F416 HydrophobicContact CE2-CZ 4.1Å; F378-F416 HydrophobicContact CG-CE2 4.42Å
379	R	78.2	Confident	78.4	Confident	30 Å²	30	49.6 Å²	49.6	11%	0.113	23%	0.227	C	C	.	.	H	α-helix	trans	-54.2	-47	177.6	-164.4	-167.1	69.4	90.8	-5.2	111.3	N164 F165 K375 E376 D377 R383	N164-R379 WeakPolarHBondContact O-CD 3.48Å; N164-R379 PolarHBondContact O-NH1 2.89Å; F165-R379 HydrophobicContact CB-CG 4.14Å; F165-R379 HydrophobicContact CD1-CB 3.76Å; F165-R379 HydrophobicContact CD1-CG 3.75Å; F165-R379 HydrophobicContact CD2-CG 3.99Å; F165-R379 HydrophobicContact CE1-CB 3.79Å; F165-R379 HydrophobicContact CE1-CG 4.1Å; F165-R379 HydrophobicContact CE2-CG 4.32Å; F165-R379 HydrophobicContact CG-CB 4.25Å; F165-R379 HydrophobicContact CG-CG 3.69Å; F165-R379 HydrophobicContact CZ-CB 4.31Å; F165-R379 HydrophobicContact CZ-CG 4.38Å; K375-R379 WeakPolarHBondContact O-CB 3.24Å; K375-R379 PolarHBondContact O-N 3.1Å; E376-R379 WeakPolarHBondContact O-CB 3.49Å; E376-R379 PolarHBondContact O-N 3.13Å; E376-R379 IonicContact OE1-CZ 3.85Å; E376-R379 IonicContact OE1-NE 3.09Å; E376-R379 PolarHBondContact OE1-NE 3.28Å; E376-R379 IonicContact OE1-NH2 3.75Å; E376-R379 PolarHBondContact OE1-NH2 2.98Å; E376-R379 IonicContact OE2-CZ 3.17Å; E376-R379 IonicContact OE2-NE 2.68Å; E376-R379 PolarHBondContact OE2-NE 3.44Å; E376-R379 IonicContact OE2-NH2 2.68Å; D377-R379 VanDerWaalsContact C-N 3.35Å; D377-R379 PolarHBondContact O-N 2.99Å; R379-R383 WeakPolarHBondContact O-CB 3.2Å; R379-R383 PolarHBondContact O-N 3.39Å
380	L	80.6	Confident	79.5	Confident	59 Å²	59	41 Å²	41	31%	0.309	19%	0.19	S	C	.	.	H	α-helix	trans	-63.2	-45.2	178.5	-179.6	60.2	0	0	0	112.1	E376 D377 F378 R383 N384	E376-L380 PolarHBondContact O-N 3.43Å; D377-L380 PolarHBondContact O-N 3.42Å; F378-L380 VanDerWaalsContact C-N 3.29Å; F378-L380 PolarHBondContact O-N 3.49Å; L380-R383 WeakPolarHBondContact O-CB 3.37Å; L380-R383 PolarHBondContact O-N 3.19Å; L380-N384 PolarHBondContact O-N 3.13Å
381	H	83.3	Confident	80.7	Confident	19 Å²	19	35.4 Å²	35.4	9%	0.088	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-44.9	178.9	-69	-51.9	0	0	0	112.4	E206 F209 F247 D377 F378 R383 N384 I385	E206-H381 PolarHBondContact O-CE1 3.47Å; E206-H381 PolarHBondContact O-ND1 2.93Å; E206-H381 IonicContact OE2-ND1 2.72Å; E206-H381 PolarHBondContact OE2-ND1 3.32Å; F209-H381 AromaticContact CD1-NE2 3.53Å; F209-H381 AromaticContact CE1-CD2 3.26Å; F209-H381 WeakPolarHBondContact CE1-CD2 3.28Å; F209-H381 AromaticContact CE1-NE2 2.92Å; F209-H381 WeakPolarHBondContact CE1-NE2 3.34Å; F209-H381 AromaticContact CE2-NE2 3.96Å; F209-H381 AromaticContact CZ-CD2 3.24Å; F209-H381 WeakPolarHBondContact CZ-CD2 3.44Å; F209-H381 AromaticContact CZ-NE2 3.22Å; F209-H381 WeakPolarHBondContact CZ-NE2 3.4Å; F247-H381 HydrophobicContact CE2-CB 3.84Å; F247-H381 HydrophobicContact CZ-CB 4.31Å; D377-H381 PolarHBondContact O-CD2 3.43Å; D377-H381 PolarHBondContact O-N 3.11Å; D377-H381 VanDerWaalsContact O-N 3.09Å; F378-H381 PolarHBondContact O-N 3.07Å; H381-R383 VanDerWaalsContact C-N 3.29Å; H381-R383 PolarHBondContact O-N 3.45Å; H381-N384 WeakPolarHBondContact O-CB 3.43Å; H381-N384 PolarHBondContact O-N 3.43Å; H381-N384 VanDerWaalsContact O-N 3.11Å; H381-I385 VanDerWaalsContact O-CG1 3.24Å; H381-I385 WeakPolarHBondContact O-CG1 3.43Å; H381-I385 PolarHBondContact O-N 3.37Å
382	F	82.3	Confident	81.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.5	-33.5	177.8	-82.7	-79.1	0	0	0	112.7	F247 I251 F378 I385 S386 T405 L408 L412	F247-F382 HydrophobicContact CD2-CE2 4.44Å; F247-F382 HydrophobicContact CE2-CE2 4.31Å; I251-F382 HydrophobicContact CD1-CE1 4.47Å; I251-F382 HydrophobicContact CD1-CZ 4.49Å; F378-F382 HydrophobicContact CD1-CD2 4.45Å; F378-F382 AromaticContact CD1-CE2 3.95Å; F378-F382 HydrophobicContact CD1-CE2 3.95Å; F378-F382 VanDerWaalsContact O-CD2 3.29Å; F378-F382 WeakPolarHBondContact O-CD2 3.37Å; F378-F382 PolarHBondContact O-N 2.81Å; F382-I385 HydrophobicContact CD1-CD1 4.19Å; F382-I385 HydrophobicContact CE1-CD1 4.29Å; F382-I385 PolarHBondContact O-N 3.01Å; F382-S386 PolarHBondContact O-N 2.95Å; F382-T405 WeakPolarHBondContact CD1-O 3.29Å; F382-L408 HydrophobicContact CE1-CB 4.09Å; F382-L408 HydrophobicContact CE1-CD2 3.59Å; F382-L408 HydrophobicContact CE1-CG 3.65Å; F382-L408 HydrophobicContact CZ-CD2 3.58Å; F382-L408 HydrophobicContact CZ-CG 3.6Å; F382-L412 HydrophobicContact CD2-CD1 4Å; F382-L412 HydrophobicContact CE2-CD1 3.28Å; F382-L412 HydrophobicContact CZ-CD1 3.89Å
383	R	83.3	Confident	82.6	Confident	72 Å²	72	29.2 Å²	29.2	27%	0.272	13%	0.133	S	C	.	.	H	α-helix	trans	-62.2	-44.6	169.9	-171.6	179.5	67.5	177.8	0.5	111.9	F165 E167 R379 L380 H381 S386 R387	F165-R383 PolarHBondContact O-N 3.26Å; E167-R383 HydrophobicContact CG-CG 3.95Å; R379-R383 WeakPolarHBondContact O-CB 3.2Å; R379-R383 PolarHBondContact O-N 3.39Å; L380-R383 WeakPolarHBondContact O-CB 3.37Å; L380-R383 PolarHBondContact O-N 3.19Å; H381-R383 VanDerWaalsContact C-N 3.29Å; H381-R383 PolarHBondContact O-N 3.45Å; R383-S386 PolarHBondContact O-N 3.27Å; R383-R387 PolarHBondContact O-N 3.38Å
384	N	86.1	Confident	83.3	Confident	33 Å²	33	23.6 Å²	23.6	18%	0.176	11%	0.109	C	C	.	.	H	α-helix	trans	-64.4	-41.9	176.7	-68.4	-12.2	0	0	0	111.7	E206 L380 H381 S386 R387 I388	E206-N384 HydrophobicContact CG-CB 4.37Å; E206-N384 WeakPolarHBondContact OE2-CB 3.46Å; E206-N384 PolarHBondContact OE2-ND2 3.03Å; L380-N384 PolarHBondContact O-N 3.13Å; H381-N384 WeakPolarHBondContact O-CB 3.43Å; H381-N384 PolarHBondContact O-N 3.43Å; H381-N384 VanDerWaalsContact O-N 3.11Å; N384-S386 VanDerWaalsContact C-N 3.31Å; N384-S386 PolarHBondContact O-N 3.03Å; N384-R387 WeakPolarHBondContact O-CB 3.35Å; N384-R387 PolarHBondContact O-N 3.11Å; N384-R387 VanDerWaalsContact O-N 3.11Å; N384-I388 WeakPolarHBondContact O-CG1 3.46Å; N384-I388 PolarHBondContact O-N 2.92Å
385	I	88.3	Confident	84.1	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-59.3	-43.1	174.9	-64.2	167.4	0	0	0	110.7	I203 F247 I251 H381 F382 R387 I388 M389 T405	I203-I385 HydrophobicContact CG1-CG2 4.4Å; I203-I385 HydrophobicContact CG2-CD1 4.27Å; I203-I385 HydrophobicContact CG2-CG1 4.21Å; I203-I385 HydrophobicContact CG2-CG2 4.43Å; F247-I385 HydrophobicContact CE2-CD1 4.01Å; F247-I385 HydrophobicContact CZ-CD1 3.8Å; I251-I385 HydrophobicContact CD1-CD1 3.87Å; H381-I385 VanDerWaalsContact O-CG1 3.24Å; H381-I385 WeakPolarHBondContact O-CG1 3.43Å; H381-I385 PolarHBondContact O-N 3.37Å; F382-I385 HydrophobicContact CD1-CD1 4.19Å; F382-I385 HydrophobicContact CE1-CD1 4.29Å; F382-I385 PolarHBondContact O-N 3.01Å; I385-R387 VanDerWaalsContact C-N 3.28Å; I385-R387 PolarHBondContact O-N 3.21Å; I385-I388 WeakPolarHBondContact O-CB 3.38Å; I385-I388 PolarHBondContact O-N 3.42Å; I385-M389 HydrophobicContact CG2-CE 3.89Å; I385-M389 WeakPolarHBondContact O-CG 3.49Å; I385-M389 PolarHBondContact O-N 3.27Å; I385-T405 HydrophobicContact CG2-CG2 3.53Å
386	S	85.8	Confident	84.8	Confident	7 Å²	7	25.3 Å²	25.3	5%	0.049	12%	0.116	C	C	.	.	H	α-helix	trans	-59.1	-39.1	175.8	-174.7	0	0	0	0	112.4	F382 R383 N384 M389	F382-S386 PolarHBondContact O-N 2.95Å; R383-S386 PolarHBondContact O-N 3.27Å; N384-S386 VanDerWaalsContact C-N 3.31Å; N384-S386 PolarHBondContact O-N 3.03Å; S386-M389 WeakPolarHBondContact O-CB 3.37Å; S386-M389 PolarHBondContact O-N 3.44Å
387	R	87.3	Confident	85.5	Confident	89 Å²	89	24.2 Å²	24.2	34%	0.336	11%	0.114	S	C	.	.	H	α-helix	trans	-67.8	-35.9	172.7	-67.3	178.9	176.1	-172.1	-4.6	112.8	P86 F87 E167 R383 N384 I385 M389 D390	P86-R387 HydrophobicContact CG-CB 4.25Å; F87-R387 HydrophobicContact CE2-CB 4.08Å; F87-R387 HydrophobicContact CZ-CB 4.15Å; E167-R387 IonicContact OE1-CZ 2.81Å; E167-R387 IonicContact OE1-NE 2.97Å; E167-R387 PolarHBondContact OE1-NE 2.81Å; E167-R387 IonicContact OE1-NH2 2.73Å; E167-R387 PolarHBondContact OE1-NH2 3.34Å; R383-R387 PolarHBondContact O-N 3.38Å; N384-R387 WeakPolarHBondContact O-CB 3.35Å; N384-R387 PolarHBondContact O-N 3.11Å; N384-R387 VanDerWaalsContact O-N 3.11Å; I385-R387 VanDerWaalsContact C-N 3.28Å; I385-R387 PolarHBondContact O-N 3.21Å; R387-M389 PolarHBondContact O-N 2.97Å; R387-D390 WeakPolarHBondContact O-CB 3.31Å; R387-D390 PolarHBondContact O-N 2.98Å; R387-D390 VanDerWaalsContact O-N 3.15Å
388	I	91	Very high	86.2	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.3	-32.6	174.9	-66.2	159.5	0	0	0	110.2	F87 I199 V202 I203 E206 N384 I385 D390 C391	F87-I388 HydrophobicContact CD2-CG1 4.31Å; F87-I388 HydrophobicContact CE2-CB 4.38Å; F87-I388 HydrophobicContact CE2-CG1 3.61Å; F87-I388 HydrophobicContact CZ-CG1 4.25Å; I199-I388 HydrophobicContact CD1-CG2 4.12Å; I199-I388 HydrophobicContact CG2-CG2 4.13Å; V202-I388 HydrophobicContact CB-CD1 4.45Å; V202-I388 HydrophobicContact CG1-CD1 3.57Å; V202-I388 HydrophobicContact CG1-CG1 3.95Å; I203-I388 HydrophobicContact CD1-CG2 4.35Å; I203-I388 HydrophobicContact CG1-CB 4.47Å; I203-I388 HydrophobicContact CG1-CD1 4.3Å; I203-I388 HydrophobicContact CG1-CG2 3.87Å; E206-I388 HydrophobicContact CG-CD1 3.9Å; N384-I388 WeakPolarHBondContact O-CG1 3.46Å; N384-I388 PolarHBondContact O-N 2.92Å; I385-I388 WeakPolarHBondContact O-CB 3.38Å; I385-I388 PolarHBondContact O-N 3.42Å; I388-D390 PolarHBondContact O-N 3.45Å; I388-C391 VanDerWaalsContact O-CB 3.27Å; I388-C391 WeakPolarHBondContact O-CB 3.27Å; I388-C391 PolarHBondContact O-N 3.21Å
389	M	90.9	Very high	86.9	Confident	11 Å²	11	23 Å²	23	5%	0.054	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-27.8	175.2	-63	-57.2	174	0	0	112.7	I203 I385 S386 R387 C391 V392 R398 K402 T405	I203-M389 HydrophobicContact CD1-CE 3.8Å; I385-M389 HydrophobicContact CG2-CE 3.89Å; I385-M389 WeakPolarHBondContact O-CG 3.49Å; I385-M389 PolarHBondContact O-N 3.27Å; S386-M389 WeakPolarHBondContact O-CB 3.37Å; S386-M389 PolarHBondContact O-N 3.44Å; R387-M389 PolarHBondContact O-N 2.97Å; M389-C391 PolarHBondContact O-N 3.5Å; M389-C391 VanDerWaalsContact O-N 3.11Å; M389-V392 WeakPolarHBondContact O-CB 3.26Å; M389-V392 PolarHBondContact O-N 3.46Å; M389-V392 HydrophobicContact SD-CG2 4.08Å; M389-R398 WeakPolarHBondContact O-CG 3.46Å; M389-R398 PolarHBondContact O-NE 3.05Å; M389-K402 HydrophobicContact CB-CG 3.78Å; M389-K402 HydrophobicContact CG-CG 4.35Å; M389-T405 HydrophobicContact CE-CG2 3.62Å
390	D	89.5	Confident	87.7	Confident	5 Å²	5	21.8 Å²	21.8	3%	0.027	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-7.9	173.2	-61	-37.5	0	0	0	113.3	R83 C85 R387 I388 R398 K402	R83-D390 HydrophobicContact CB-CB 4.16Å; C85-D390 PolarHBondContact N-O 3.24Å; R387-D390 WeakPolarHBondContact O-CB 3.31Å; R387-D390 PolarHBondContact O-N 2.98Å; R387-D390 VanDerWaalsContact O-N 3.15Å; I388-D390 PolarHBondContact O-N 3.45Å; D390-R398 VanDerWaalsContact C-NH2 3.3Å; D390-R398 VanDerWaalsContact O-CZ 3.26Å; D390-R398 PolarHBondContact O-NH1 3.41Å; D390-R398 PolarHBondContact O-NH2 2.62Å; D390-K402 WeakPolarHBondContact OD1-CE 3.16Å; D390-K402 IonicContact OD1-NZ 3.02Å; D390-K402 PolarHBondContact OD1-NZ 3.38Å; D390-K402 IonicContact OD2-NZ 2.74Å
391	C	89.8	Confident	88.3	Confident	4 Å²	4	19.2 Å²	19.2	3%	0.027	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-3.2	173.2	-55.9	0	0	0	0	113.9	C85 W88 I199 I388 M389 G393	C85-C391 VanDerWaalsContact CA-SG 3.55Å; C85-C391 HydrophobicContact CB-CB 3.77Å; C85-C391 WeakPolarHBondContact CB-SG 3.08Å; C85-C391 WeakPolarHBondContact SG-CB 3.37Å; C85-C391 CovalentContact SG-SG 2.03Å; C85-C391 PolarHBondContact SG-SG 3.37Å; W88-C391 HydrophobicContact CH2-CB 4.27Å; W88-C391 HydrophobicContact CZ2-CB 3.55Å; I199-C391 HydrophobicContact CD1-CB 3.67Å; I388-C391 VanDerWaalsContact O-CB 3.27Å; I388-C391 WeakPolarHBondContact O-CB 3.27Å; I388-C391 PolarHBondContact O-N 3.21Å; M389-C391 PolarHBondContact O-N 3.5Å; M389-C391 VanDerWaalsContact O-N 3.11Å; C391-G393 PolarHBondContact O-N 3.22Å
392	V	89.2	Confident	88.7	Confident	5 Å²	5	18.4 Å²	18.4	3%	0.03	9%	0.087	C	C	.	.			trans	-77.5	114.6	178.4	177.9	0	0	0	0	109.3	Y191 I199 M389 C394 C397 R398	Y191-V392 HydrophobicContact CE1-CG1 4.12Å; I199-V392 HydrophobicContact CD1-CG2 4.03Å; I199-V392 HydrophobicContact CG1-CG2 4.17Å; I199-V392 HydrophobicContact CG2-CG2 3.94Å; M389-V392 WeakPolarHBondContact O-CB 3.26Å; M389-V392 PolarHBondContact O-N 3.46Å; M389-V392 HydrophobicContact SD-CG2 4.08Å; V392-C394 HydrophobicContact CG1-CB 4.48Å; V392-C394 PolarHBondContact O-N 3.36Å; V392-C397 HydrophobicContact CG1-CB 3.8Å; V392-R398 HydrophobicContact CB-CB 4.18Å; V392-R398 HydrophobicContact CG1-CB 4.35Å; V392-R398 PolarHBondContact O-NE 2.86Å; V392-R398 PolarHBondContact O-NH2 2.64Å
393	G	84.1	Confident	89.3	Confident	6 Å²	6	18.4 Å²	18.4	6%	0.062	9%	0.087	C	C	.	.	S	Bend	trans	-72.7	-8.7	-178.9	0	0	0	0	0	114.8	C94 C391	C94-G393 PolarHBondContact N-O 3.04Å; C391-G393 PolarHBondContact O-N 3.22Å
394	C	87.4	Confident	89.9	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.074	C	C	.	.			trans	-99.3	114.4	170.8	-176.7	0	0	0	0	112.8	C94 C99 Y191 V392 K396 C397 R398	C94-C394 HydrophobicContact CB-CB 3.98Å; C99-C394 HydrophobicContact CB-CB 4.44Å; C99-C394 WeakPolarHBondContact CB-SG 3.36Å; C99-C394 WeakPolarHBondContact SG-CA 3.43Å; C99-C394 WeakPolarHBondContact SG-CB 3.47Å; C99-C394 CovalentContact SG-SG 2.04Å; C99-C394 PolarHBondContact SG-SG 3.11Å; Y191-C394 HydrophobicContact CD2-CB 3.89Å; Y191-C394 HydrophobicContact CG-CB 3.89Å; V392-C394 HydrophobicContact CG1-CB 4.48Å; V392-C394 PolarHBondContact O-N 3.36Å; C394-K396 PolarHBondContact O-N 2.94Å; C394-C397 HydrophobicContact CB-CB 3.89Å; C394-C397 CarbonylContact O-C 3.56Å; C394-C397 WeakPolarHBondContact O-CB 3.43Å; C394-C397 PolarHBondContact O-N 3.45Å; C394-C397 VanDerWaalsContact O-N 3.12Å; C394-C397 PolarHBondContact SG-SG 2.95Å; C394-R398 WeakPolarHBondContact O-CB 3.28Å; C394-R398 PolarHBondContact O-N 3.26Å
395	F	86.9	Confident	90.2	Very high	82 Å²	82	13.6 Å²	13.6	36%	0.36	7%	0.066	S	C	.	.	H	α-helix	trans	-62	-41.3	-174.5	-64.3	-71.6	0	0	0	114.3	L81 C99 V101 R398 L399	L81-F395 HydrophobicContact CB-CD1 4.33Å; C99-F395 PolarHBondContact SG-N 3.2Å; V101-F395 HydrophobicContact CB-CB 4.41Å; V101-F395 HydrophobicContact CG2-CB 3.79Å; F395-R398 WeakPolarHBondContact O-CB 3.29Å; F395-R398 PolarHBondContact O-N 3.22Å; F395-L399 WeakPolarHBondContact O-CB 3.44Å; F395-L399 PolarHBondContact O-N 3.38Å
396	K	87.7	Confident	90.4	Very high	16 Å²	16	14.1 Å²	14.1	7%	0.07	7%	0.069	C	C	.	.	H	α-helix	trans	-64.3	-40.8	173.2	-77.3	-172.9	-172.9	166.9	0	112.5	D98 C99 A100 V101 T189 C394 R398 L399 W400	D98-K396 VanDerWaalsContact O-CD 3.32Å; D98-K396 WeakPolarHBondContact O-CD 3.37Å; D98-K396 WeakPolarHBondContact O-CE 3.44Å; D98-K396 PolarHBondContact O-NZ 3.12Å; C99-K396 PolarHBondContact O-N 2.67Å; C99-K396 VanDerWaalsContact O-N 3.14Å; A100-K396 WeakPolarHBondContact O-CE 3.09Å; V101-K396 HydrophobicContact CG2-CB 4.4Å; V101-K396 HydrophobicContact CG2-CG 3.69Å; T189-K396 HydrophobicContact CG2-CB 4.25Å; C394-K396 PolarHBondContact O-N 2.94Å; K396-R398 VanDerWaalsContact C-N 3.31Å; K396-R398 PolarHBondContact O-N 3.49Å; K396-L399 WeakPolarHBondContact O-CB 3.35Å; K396-L399 PolarHBondContact O-N 3.35Å; K396-W400 PolarHBondContact O-N 2.64Å
397	C	90.4	Very high	90.8	Very high	36 Å²	36	13.8 Å²	13.8	24%	0.243	7%	0.066	C	C	.	.	H	α-helix	trans	-65.2	-37.3	175.7	-59.2	0	0	0	0	111.3	T189 V392 C394 G401	T189-C397 PolarHBondContact OG1-SG 3.33Å; T189-C397 VanDerWaalsContact OG1-SG 3.37Å; V392-C397 HydrophobicContact CG1-CB 3.8Å; C394-C397 HydrophobicContact CB-CB 3.89Å; C394-C397 CarbonylContact O-C 3.56Å; C394-C397 WeakPolarHBondContact O-CB 3.43Å; C394-C397 PolarHBondContact O-N 3.45Å; C394-C397 VanDerWaalsContact O-N 3.12Å; C394-C397 PolarHBondContact SG-SG 2.95Å; C397-G401 WeakPolarHBondContact O-CA 3.33Å; C397-G401 PolarHBondContact O-N 3.38Å
398	R	91.8	Very high	91.1	Very high	9 Å²	9	9.6 Å²	9.6	3%	0.034	5%	0.051	C	C	.	.	H	α-helix	trans	-63.5	-46.2	173.7	-179.6	-177.8	-60.8	-151.9	-10.9	111.7	L81 R83 M389 D390 V392 C394 F395 K396 G401 K402	L81-R398 HydrophobicContact CD2-CB 4.35Å; L81-R398 HydrophobicContact CD2-CG 3.89Å; L81-R398 PolarHBondContact O-NH1 2.97Å; R83-R398 PolarHBondContact O-NH1 3.4Å; M389-R398 WeakPolarHBondContact O-CG 3.46Å; M389-R398 PolarHBondContact O-NE 3.05Å; D390-R398 VanDerWaalsContact C-NH2 3.3Å; D390-R398 VanDerWaalsContact O-CZ 3.26Å; D390-R398 PolarHBondContact O-NH1 3.41Å; D390-R398 PolarHBondContact O-NH2 2.62Å; V392-R398 HydrophobicContact CB-CB 4.18Å; V392-R398 HydrophobicContact CG1-CB 4.35Å; V392-R398 PolarHBondContact O-NE 2.86Å; V392-R398 PolarHBondContact O-NH2 2.64Å; C394-R398 WeakPolarHBondContact O-CB 3.28Å; C394-R398 PolarHBondContact O-N 3.26Å; F395-R398 WeakPolarHBondContact O-CB 3.29Å; F395-R398 PolarHBondContact O-N 3.22Å; K396-R398 VanDerWaalsContact C-N 3.31Å; K396-R398 PolarHBondContact O-N 3.49Å; R398-G401 PolarHBondContact O-N 3.11Å; R398-K402 WeakPolarHBondContact O-CB 3.39Å; R398-K402 PolarHBondContact O-N 2.97Å
399	L	90.6	Very high	91	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-56	-56.7	176.2	169.7	68.3	0	0	0	111.2	Y77 V79 L81 V101 V179 L181 N184 F395 K396 K402 L403	Y77-L399 HydrophobicContact CD1-CD1 3.91Å; Y77-L399 HydrophobicContact CE1-CD1 4.41Å; V79-L399 HydrophobicContact CG1-CD1 3.65Å; L81-L399 HydrophobicContact CD1-CB 4.49Å; L81-L399 HydrophobicContact CD2-CB 4.13Å; V101-L399 HydrophobicContact CG1-CD2 4.39Å; V101-L399 HydrophobicContact CG2-CB 4.44Å; V101-L399 HydrophobicContact CG2-CD2 4.26Å; V179-L399 HydrophobicContact CB-CD1 4.35Å; V179-L399 HydrophobicContact CG1-CD1 4.32Å; V179-L399 HydrophobicContact CG1-CD2 3.88Å; L181-L399 HydrophobicContact CD2-CD1 4.32Å; L181-L399 HydrophobicContact CD2-CD2 4.28Å; L181-L399 HydrophobicContact CD2-CG 4.48Å; N184-L399 HydrophobicContact CB-CD2 3.94Å; F395-L399 WeakPolarHBondContact O-CB 3.44Å; F395-L399 PolarHBondContact O-N 3.38Å; K396-L399 WeakPolarHBondContact O-CB 3.35Å; K396-L399 PolarHBondContact O-N 3.35Å; L399-K402 PolarHBondContact O-N 3.02Å; L399-L403 WeakPolarHBondContact O-CB 3.42Å; L399-L403 PolarHBondContact O-N 3.06Å
400	W	95.1	Very high	91	Very high	3 Å²	3	9.2 Å²	9.2	1%	0.011	5%	0.049	C	C	.	.	H	α-helix	trans	-67.6	-36.5	-179.4	-71.7	107.5	0	0	0	112.1	L181 N184 E186 K396 L403 Q404 R449	L181-W400 HydrophobicContact CB-CH2 4.12Å; L181-W400 HydrophobicContact CB-CZ2 4.39Å; L181-W400 HydrophobicContact CD1-CH2 4.34Å; L181-W400 HydrophobicContact CD2-CH2 3.99Å; L181-W400 HydrophobicContact CD2-CZ2 4.17Å; L181-W400 HydrophobicContact CG-CH2 4.38Å; N184-W400 VanDerWaalsContact O-CE2 3.31Å; N184-W400 VanDerWaalsContact O-CZ2 3.26Å; N184-W400 WeakPolarHBondContact O-CZ2 3.08Å; N184-W400 PolarHBondContact O-NE1 2.95Å; E186-W400 HydrophobicContact CB-CD2 3.79Å; E186-W400 HydrophobicContact CB-CE3 4.46Å; E186-W400 HydrophobicContact CB-CG 3.83Å; E186-W400 HydrophobicContact CB-CZ2 4.44Å; E186-W400 HydrophobicContact CG-CB 4.49Å; E186-W400 HydrophobicContact CG-CD2 4.5Å; E186-W400 HydrophobicContact CG-CG 4.11Å; E186-W400 VanDerWaalsContact N-NE1 3.17Å; K396-W400 PolarHBondContact O-N 2.64Å; W400-L403 HydrophobicContact CE3-CD1 4.39Å; W400-L403 HydrophobicContact CE3-CD2 4.21Å; W400-L403 HydrophobicContact CZ3-CD1 4.08Å; W400-L403 HydrophobicContact CZ3-CD2 4.16Å; W400-L403 PolarHBondContact O-N 3.37Å; W400-Q404 WeakPolarHBondContact O-CB 3.16Å; W400-Q404 WeakPolarHBondContact O-CG 3.28Å; W400-Q404 PolarHBondContact O-N 3.32Å; W400-Q404 PolarHBondContact O-OE1 3.3Å; W400-R449 HydrophobicContact CE3-CG 3.98Å; W400-R449 HydrophobicContact CZ3-CG 3.91Å
401	G	94.1	Very high	91.1	Very high	5 Å²	5	9 Å²	9	5%	0.052	5%	0.047	C	C	.	.	H	α-helix	trans	-59.9	-50.6	174	0	0	0	0	0	112.8	C397 R398 T405	C397-G401 WeakPolarHBondContact O-CA 3.33Å; C397-G401 PolarHBondContact O-N 3.38Å; R398-G401 PolarHBondContact O-N 3.11Å; G401-T405 WeakPolarHBondContact O-CB 3.37Å; G401-T405 WeakPolarHBondContact O-CG2 3.4Å; G401-T405 PolarHBondContact O-N 3.05Å; G401-T405 PolarHBondContact O-OG1 3.47Å
402	K	92.1	Very high	90.9	Very high	3 Å²	3	8.8 Å²	8.8	1%	0.013	5%	0.046	C	C	.	.	H	α-helix	trans	-60.2	-48	174.2	-79.1	-173.1	176.3	-82	0	111.4	V79 D170 M389 D390 R398 L399 Q404 T405 Q406	V79-K402 HydrophobicContact CG2-CB 4.44Å; V79-K402 HydrophobicContact CG2-CD 3.64Å; D170-K402 IonicContact OD2-NZ 3.89Å; D170-K402 PolarHBondContact OD2-NZ 3.11Å; M389-K402 HydrophobicContact CB-CG 3.78Å; M389-K402 HydrophobicContact CG-CG 4.35Å; D390-K402 WeakPolarHBondContact OD1-CE 3.16Å; D390-K402 IonicContact OD1-NZ 3.02Å; D390-K402 PolarHBondContact OD1-NZ 3.38Å; D390-K402 IonicContact OD2-NZ 2.74Å; R398-K402 WeakPolarHBondContact O-CB 3.39Å; R398-K402 PolarHBondContact O-N 2.97Å; L399-K402 PolarHBondContact O-N 3.02Å; K402-Q404 PolarHBondContact O-N 3.48Å; K402-T405 PolarHBondContact O-OG1 2.88Å; K402-T405 VanDerWaalsContact O-OG1 3.11Å; K402-Q406 VanDerWaalsContact O-CB 3.29Å; K402-Q406 WeakPolarHBondContact O-CB 3.28Å; K402-Q406 PolarHBondContact O-N 3.22Å
403	L	94.1	Very high	90.7	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-59.2	-51	-179.6	-176.8	153.7	0	0	0	112.4	Y77 L181 L399 W400 Q406 G407 N445 A446	Y77-L403 HydrophobicContact CD1-CB 4.39Å; Y77-L403 HydrophobicContact CD1-CD1 4.04Å; Y77-L403 HydrophobicContact CD2-CD1 4.27Å; Y77-L403 HydrophobicContact CE1-CB 3.91Å; Y77-L403 HydrophobicContact CE1-CD1 4.35Å; Y77-L403 HydrophobicContact CE1-CG 4.42Å; Y77-L403 HydrophobicContact CE2-CG 4.5Å; Y77-L403 HydrophobicContact CG-CD1 3.99Å; L181-L403 HydrophobicContact CD1-CD1 3.7Å; L181-L403 HydrophobicContact CD2-CD1 3.92Å; L181-L403 HydrophobicContact CG-CD1 4.49Å; L399-L403 WeakPolarHBondContact O-CB 3.42Å; L399-L403 PolarHBondContact O-N 3.06Å; W400-L403 HydrophobicContact CE3-CD1 4.39Å; W400-L403 HydrophobicContact CE3-CD2 4.21Å; W400-L403 HydrophobicContact CZ3-CD1 4.08Å; W400-L403 HydrophobicContact CZ3-CD2 4.16Å; W400-L403 PolarHBondContact O-N 3.37Å; L403-Q406 PolarHBondContact O-N 2.92Å; L403-G407 PolarHBondContact O-N 2.91Å; L403-N445 HydrophobicContact CD1-CB 3.95Å; L403-N445 HydrophobicContact CD2-CB 3.63Å; L403-N445 HydrophobicContact CG-CB 4.28Å; L403-A446 HydrophobicContact CD2-CB 4.48Å
404	Q	96.1	Very high	90.8	Very high	3 Å²	3	9.3 Å²	9.3	1%	0.014	5%	0.047	C	C	.	.	H	α-helix	trans	-71.4	-36.7	-174.8	-70.3	172.1	-68.5	0	0	112	E186 L254 W400 K402 G407 L408 R449	E186-Q404 PolarHBondContact OE1-OE1 2.89Å; L254-Q404 HydrophobicContact CD1-CB 3.63Å; L254-Q404 HydrophobicContact CD1-CG 4.12Å; L254-Q404 HydrophobicContact CD2-CB 4.43Å; W400-Q404 WeakPolarHBondContact O-CB 3.16Å; W400-Q404 WeakPolarHBondContact O-CG 3.28Å; W400-Q404 PolarHBondContact O-N 3.32Å; W400-Q404 PolarHBondContact O-OE1 3.3Å; K402-Q404 PolarHBondContact O-N 3.48Å; Q404-G407 PolarHBondContact O-N 3.49Å; Q404-L408 VanDerWaalsContact O-CB 3.29Å; Q404-L408 WeakPolarHBondContact O-CB 3.45Å; Q404-L408 PolarHBondContact O-N 2.71Å; Q404-R449 HydrophobicContact CG-CG 4.36Å
405	T	92.5	Very high	90.6	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.006	5%	0.049	C	C	.	.	H	α-helix	trans	-69.9	-36.9	176	56.4	0	0	0	0	112.1	L254 F382 I385 M389 G401 K402 G409	L254-T405 HydrophobicContact CD2-CG2 4.01Å; F382-T405 WeakPolarHBondContact CD1-O 3.29Å; I385-T405 HydrophobicContact CG2-CG2 3.53Å; M389-T405 HydrophobicContact CE-CG2 3.62Å; G401-T405 WeakPolarHBondContact O-CB 3.37Å; G401-T405 WeakPolarHBondContact O-CG2 3.4Å; G401-T405 PolarHBondContact O-N 3.05Å; G401-T405 PolarHBondContact O-OG1 3.47Å; K402-T405 PolarHBondContact O-OG1 2.88Å; K402-T405 VanDerWaalsContact O-OG1 3.11Å; T405-G409 PolarHBondContact O-N 3.32Å
406	Q	91.3	Very high	90.1	Very high	12 Å²	12	7.7 Å²	7.7	6%	0.056	4%	0.04	C	C	.	.	H	α-helix	trans	-64.3	-48.2	171.4	-173.4	177.2	24.2	0	0	111.3	Y77 C166 K402 L403 L408 G409 T410 S442	Y77-Q406 PolarHBondContact OH-OE1 2.83Å; C166-Q406 HydrophobicContact CB-CG 4.26Å; K402-Q406 VanDerWaalsContact O-CB 3.29Å; K402-Q406 WeakPolarHBondContact O-CB 3.28Å; K402-Q406 PolarHBondContact O-N 3.22Å; L403-Q406 PolarHBondContact O-N 2.92Å; Q406-L408 VanDerWaalsContact C-N 3.32Å; Q406-L408 PolarHBondContact O-N 2.87Å; Q406-G409 CarbonylContact O-C 3.5Å; Q406-G409 PolarHBondContact O-N 3.47Å; Q406-G409 VanDerWaalsContact O-N 3.14Å; Q406-T410 PolarHBondContact O-N 3.2Å; Q406-T410 PolarHBondContact O-OG1 3.44Å; Q406-T410 VanDerWaalsContact O-OG1 3.09Å; Q406-S442 WeakPolarHBondContact CG-OG 3.48Å
407	G	94.1	Very high	89.8	Confident	0 Å²	0	7 Å²	7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-59.4	-41.8	178.3	0	0	0	0	0	112.7	L403 Q404 T410 A411 S442	L403-G407 PolarHBondContact O-N 2.91Å; Q404-G407 PolarHBondContact O-N 3.49Å; G407-T410 PolarHBondContact O-N 2.85Å; G407-A411 PolarHBondContact O-N 2.66Å; G407-S442 PolarHBondContact N-OG 2.98Å
408	L	93.6	Very high	89	Confident	1 Å²	1	8.6 Å²	8.6	1%	0.005	4%	0.041	C	C	.	.	H	α-helix	trans	-65.9	-42.1	174.1	177.7	53.5	0	0	0	112.2	L250 L307 F382 Q404 Q406 T410 A411 L412	L250-L408 HydrophobicContact CB-CD2 4.12Å; L250-L408 HydrophobicContact CD1-CD1 4.36Å; L250-L408 HydrophobicContact CD2-CD1 4.15Å; L307-L408 HydrophobicContact CD1-CD1 3.61Å; L307-L408 HydrophobicContact CD1-CD2 4.11Å; L307-L408 HydrophobicContact CD1-CG 4.44Å; F382-L408 HydrophobicContact CE1-CB 4.09Å; F382-L408 HydrophobicContact CE1-CD2 3.59Å; F382-L408 HydrophobicContact CE1-CG 3.65Å; F382-L408 HydrophobicContact CZ-CD2 3.58Å; F382-L408 HydrophobicContact CZ-CG 3.6Å; Q404-L408 VanDerWaalsContact O-CB 3.29Å; Q404-L408 WeakPolarHBondContact O-CB 3.45Å; Q404-L408 PolarHBondContact O-N 2.71Å; Q406-L408 VanDerWaalsContact C-N 3.32Å; Q406-L408 PolarHBondContact O-N 2.87Å; L408-T410 VanDerWaalsContact C-N 3.32Å; L408-T410 PolarHBondContact O-N 3.3Å; L408-A411 WeakPolarHBondContact O-CB 3.26Å; L408-A411 PolarHBondContact O-N 2.58Å; L408-L412 WeakPolarHBondContact O-CG 3.45Å; L408-L412 PolarHBondContact O-N 2.99Å
409	G	90.1	Very high	88.2	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-59.2	-42.1	172.4	0	0	0	0	0	112.3	T405 Q406 L412 K413	T405-G409 PolarHBondContact O-N 3.32Å; Q406-G409 CarbonylContact O-C 3.5Å; Q406-G409 PolarHBondContact O-N 3.47Å; Q406-G409 VanDerWaalsContact O-N 3.14Å; G409-L412 PolarHBondContact O-N 3.07Å; G409-K413 WeakPolarHBondContact O-CB 3.34Å; G409-K413 PolarHBondContact O-N 3.01Å
410	T	90.5	Very high	87.6	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.012	9%	0.088	C	C	.	.	H	α-helix	trans	-65.2	-39.9	174.3	-59.8	0	0	0	0	111.9	Q406 G407 L408 L412 K413 I414 L435 E439 L443	Q406-T410 PolarHBondContact O-N 3.2Å; Q406-T410 PolarHBondContact O-OG1 3.44Å; Q406-T410 VanDerWaalsContact O-OG1 3.09Å; G407-T410 PolarHBondContact O-N 2.85Å; L408-T410 VanDerWaalsContact C-N 3.32Å; L408-T410 PolarHBondContact O-N 3.3Å; T410-L412 VanDerWaalsContact C-N 3.34Å; T410-L412 PolarHBondContact O-N 3.46Å; T410-K413 WeakPolarHBondContact O-CB 3.4Å; T410-K413 PolarHBondContact O-N 3.42Å; T410-I414 HydrophobicContact CG2-CD1 4.2Å; T410-I414 WeakPolarHBondContact O-CG1 3.04Å; T410-I414 PolarHBondContact O-N 2.92Å; T410-L435 HydrophobicContact CG2-CD2 3.82Å; T410-E439 HydrophobicContact CG2-CB 3.98Å; T410-L443 HydrophobicContact CG2-CB 4.14Å; T410-L443 HydrophobicContact CG2-CD1 4.3Å; T410-L443 HydrophobicContact CG2-CD2 4.23Å; T410-L443 HydrophobicContact CG2-CG 4.47Å
411	A	90.9	Very high	86.8	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.4	-44.9	174.9	0	0	0	0	0	111.1	E311 A314 G407 L408 I414 L415 L443	E311-A411 HydrophobicContact CG-CB 4.17Å; A314-A411 HydrophobicContact CB-CB 3.69Å; A314-A411 WeakPolarHBondContact CB-O 3.42Å; G407-A411 PolarHBondContact O-N 2.66Å; L408-A411 WeakPolarHBondContact O-CB 3.26Å; L408-A411 PolarHBondContact O-N 2.58Å; A411-I414 WeakPolarHBondContact O-CB 3.19Å; A411-I414 PolarHBondContact O-N 2.87Å; A411-L415 WeakPolarHBondContact O-CG 3.27Å; A411-L415 PolarHBondContact O-N 2.83Å; A411-L443 HydrophobicContact CB-CD1 3.9Å
412	L	85.6	Confident	85.9	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-65.7	-41.7	175	-65.7	174.7	0	0	0	112	L250 I310 F364 F378 F382 L408 G409 T410 I414 L415 F416	L250-L412 HydrophobicContact CD1-CD1 4.15Å; L250-L412 HydrophobicContact CD1-CD2 4.13Å; I310-L412 HydrophobicContact CG2-CD2 4.42Å; F364-L412 HydrophobicContact CE1-CD2 4.46Å; F364-L412 HydrophobicContact CZ-CD2 4.46Å; F378-L412 HydrophobicContact CB-CD1 4.5Å; F378-L412 HydrophobicContact CD1-CD1 3.83Å; F378-L412 HydrophobicContact CE1-CD1 4.28Å; F378-L412 HydrophobicContact CG-CD1 4.26Å; F382-L412 HydrophobicContact CD2-CD1 4Å; F382-L412 HydrophobicContact CE2-CD1 3.28Å; F382-L412 HydrophobicContact CZ-CD1 3.89Å; L408-L412 WeakPolarHBondContact O-CG 3.45Å; L408-L412 PolarHBondContact O-N 2.99Å; G409-L412 PolarHBondContact O-N 3.07Å; T410-L412 VanDerWaalsContact C-N 3.34Å; T410-L412 PolarHBondContact O-N 3.46Å; L412-I414 PolarHBondContact O-N 3.06Å; L412-L415 HydrophobicContact CD2-CD1 4.44Å; L412-L415 PolarHBondContact O-N 3.29Å; L412-L415 VanDerWaalsContact O-N 3.12Å; L412-F416 HydrophobicContact CB-CD2 4.35Å; L412-F416 HydrophobicContact CB-CE2 4.29Å; L412-F416 WeakPolarHBondContact O-CD2 3.46Å; L412-F416 PolarHBondContact O-N 2.84Å
413	K	85.8	Confident	85.3	Confident	22 Å²	22	28.7 Å²	28.7	10%	0.096	15%	0.151	C	C	.	.	H	α-helix	trans	-51.6	-45	172.6	176	179.1	168.4	-178.9	0	111.3	F165 G409 T410 S417 F433 H434 L435 E439	F165-K413 HydrophobicContact CD2-CB 3.63Å; F165-K413 HydrophobicContact CD2-CD 3.82Å; F165-K413 HydrophobicContact CD2-CG 3.83Å; F165-K413 HydrophobicContact CE1-CB 4.41Å; F165-K413 HydrophobicContact CE2-CB 3.44Å; F165-K413 VanDerWaalsContact CE2-CB 3.44Å; F165-K413 HydrophobicContact CE2-CD 4.03Å; F165-K413 HydrophobicContact CE2-CG 3.54Å; F165-K413 HydrophobicContact CG-CB 4.19Å; F165-K413 HydrophobicContact CZ-CB 3.86Å; F165-K413 HydrophobicContact CZ-CG 4.34Å; G409-K413 WeakPolarHBondContact O-CB 3.34Å; G409-K413 PolarHBondContact O-N 3.01Å; T410-K413 WeakPolarHBondContact O-CB 3.4Å; T410-K413 PolarHBondContact O-N 3.42Å; K413-S417 VanDerWaalsContact O-CB 3.26Å; K413-S417 WeakPolarHBondContact O-CB 3.2Å; K413-S417 PolarHBondContact O-N 3.14Å; K413-S417 PolarHBondContact O-OG 3.09Å; K413-F433 HydrophobicContact CG-CE2 4.32Å; K413-H434 PolarHBondContact NZ-O 2.94Å; K413-L435 HydrophobicContact CD-CD2 4.29Å; K413-E439 WeakPolarHBondContact CD-OE1 3.38Å; K413-E439 IonicContact NZ-OE1 3.63Å; K413-E439 PolarHBondContact NZ-OE1 2.84Å; K413-E439 IonicContact NZ-OE2 2.76Å; K413-E439 PolarHBondContact NZ-OE2 3.45Å
414	I	86.8	Confident	84.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.2	-49.9	176.8	-71.2	158.8	0	0	0	111	A314 K317 V318 T410 A411 L412 F416 S417 E418 I421 F433 L435 L443	A314-I414 HydrophobicContact CB-CB 4.25Å; A314-I414 HydrophobicContact CB-CD1 4.49Å; A314-I414 HydrophobicContact CB-CG2 4.14Å; A314-I414 WeakPolarHBondContact O-CG2 3.3Å; K317-I414 HydrophobicContact CB-CG2 4.1Å; V318-I414 HydrophobicContact CB-CD1 3.87Å; V318-I414 HydrophobicContact CB-CG1 4.17Å; V318-I414 HydrophobicContact CB-CG2 3.94Å; V318-I414 HydrophobicContact CG1-CD1 4.14Å; V318-I414 HydrophobicContact CG2-CD1 3.93Å; V318-I414 HydrophobicContact CG2-CG1 4.11Å; T410-I414 HydrophobicContact CG2-CD1 4.2Å; T410-I414 WeakPolarHBondContact O-CG1 3.04Å; T410-I414 PolarHBondContact O-N 2.92Å; A411-I414 WeakPolarHBondContact O-CB 3.19Å; A411-I414 PolarHBondContact O-N 2.87Å; L412-I414 PolarHBondContact O-N 3.06Å; I414-F416 VanDerWaalsContact C-N 3.31Å; I414-F416 PolarHBondContact O-N 3.31Å; I414-S417 CarbonylContact O-C 3.34Å; I414-S417 WeakPolarHBondContact O-CA 3.47Å; I414-S417 PolarHBondContact O-N 3.04Å; I414-E418 PolarHBondContact O-N 2.97Å; I414-I421 HydrophobicContact CG2-CD1 3.9Å; I414-F433 HydrophobicContact CG1-CE2 4.5Å; I414-F433 HydrophobicContact CG1-CZ 3.83Å; I414-L435 HydrophobicContact CD1-CD1 4.29Å; I414-L435 HydrophobicContact CG1-CD1 4.5Å; I414-L443 HydrophobicContact CD1-CD1 4.25Å; I414-L443 HydrophobicContact CD1-CD2 3.54Å
415	L	82	Confident	83.4	Confident	11 Å²	11	32.7 Å²	32.7	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-37.9	-177.8	-66.2	173.3	0	0	0	112.4	I310 R313 A314 F364 A411 L412 S417	I310-L415 HydrophobicContact CG2-CD1 3.78Å; R313-L415 HydrophobicContact CB-CD2 4.19Å; R313-L415 HydrophobicContact CG-CD2 3.64Å; A314-L415 HydrophobicContact CB-CD1 4.41Å; A314-L415 HydrophobicContact CB-CD2 4.18Å; A314-L415 HydrophobicContact CB-CG 4Å; F364-L415 HydrophobicContact CE2-CD1 4.12Å; F364-L415 HydrophobicContact CZ-CB 4.41Å; F364-L415 HydrophobicContact CZ-CD1 3.94Å; A411-L415 WeakPolarHBondContact O-CG 3.27Å; A411-L415 PolarHBondContact O-N 2.83Å; L412-L415 HydrophobicContact CD2-CD1 4.44Å; L412-L415 PolarHBondContact O-N 3.29Å; L412-L415 VanDerWaalsContact O-N 3.12Å; L415-S417 PolarHBondContact O-N 3.29Å
416	F	77.7	Confident	82.3	Confident	36 Å²	36	41 Å²	41	16%	0.158	21%	0.214	C	C	.	.	H	α-helix	trans	-74.3	-12.5	173.8	-73.4	-64.7	0	0	0	114.1	F364 L374 K375 F378 L412 I414	F364-F416 HydrophobicContact CD1-CD1 4.13Å; F364-F416 AromaticContact CD1-CE1 3.58Å; F364-F416 HydrophobicContact CD1-CE1 3.58Å; F364-F416 HydrophobicContact CD1-CE2 4.4Å; F364-F416 AromaticContact CD1-CZ 3.71Å; F364-F416 HydrophobicContact CD1-CZ 3.71Å; F364-F416 HydrophobicContact CE1-CE1 4.16Å; F364-F416 HydrophobicContact CE1-CE2 4.21Å; F364-F416 AromaticContact CE1-CZ 3.81Å; F364-F416 HydrophobicContact CE1-CZ 3.81Å; L374-F416 HydrophobicContact CD2-CE1 4.01Å; L374-F416 HydrophobicContact CD2-CZ 3.97Å; L374-F416 HydrophobicContact CG-CE1 4.23Å; L374-F416 HydrophobicContact CG-CZ 3.97Å; K375-F416 HydrophobicContact CB-CB 4.26Å; K375-F416 HydrophobicContact CB-CD1 3.99Å; K375-F416 HydrophobicContact CB-CD2 4.13Å; K375-F416 HydrophobicContact CB-CE1 4.36Å; K375-F416 HydrophobicContact CB-CG 3.88Å; K375-F416 HydrophobicContact CD-CB 3.95Å; K375-F416 HydrophobicContact CD-CG 4.48Å; K375-F416 HydrophobicContact CG-CB 3.83Å; K375-F416 HydrophobicContact CG-CD1 4.46Å; K375-F416 HydrophobicContact CG-CD2 4Å; K375-F416 HydrophobicContact CG-CG 3.86Å; F378-F416 HydrophobicContact CB-CE2 4.48Å; F378-F416 AromaticContact CD2-CE2 3.86Å; F378-F416 HydrophobicContact CD2-CE2 3.86Å; F378-F416 AromaticContact CD2-CZ 3.75Å; F378-F416 HydrophobicContact CD2-CZ 3.75Å; F378-F416 HydrophobicContact CE2-CE2 4.49Å; F378-F416 HydrophobicContact CE2-CZ 4.1Å; F378-F416 HydrophobicContact CG-CE2 4.42Å; L412-F416 HydrophobicContact CB-CD2 4.35Å; L412-F416 HydrophobicContact CB-CE2 4.29Å; L412-F416 WeakPolarHBondContact O-CD2 3.46Å; L412-F416 PolarHBondContact O-N 2.84Å; I414-F416 VanDerWaalsContact C-N 3.31Å; I414-F416 PolarHBondContact O-N 3.31Å
417	S	80.6	Confident	80.8	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.021	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	15.9	-177.3	-55	0	0	0	0	112.8	K413 I414 L415 K419 L420 I421	K413-S417 VanDerWaalsContact O-CB 3.26Å; K413-S417 WeakPolarHBondContact O-CB 3.2Å; K413-S417 PolarHBondContact O-N 3.14Å; K413-S417 PolarHBondContact O-OG 3.09Å; I414-S417 CarbonylContact O-C 3.34Å; I414-S417 WeakPolarHBondContact O-CA 3.47Å; I414-S417 PolarHBondContact O-N 3.04Å; L415-S417 PolarHBondContact O-N 3.29Å; S417-K419 VanDerWaalsContact C-N 3.28Å; S417-K419 PolarHBondContact O-N 3.29Å; S417-L420 WeakPolarHBondContact O-CA 3.37Å; S417-L420 WeakPolarHBondContact O-CB 3.46Å; S417-L420 PolarHBondContact O-N 3.25Å; S417-I421 WeakPolarHBondContact O-CG1 3.47Å; S417-I421 PolarHBondContact O-N 2.6Å
418	E	74.8	Confident	78.8	Confident	69 Å²	69	46 Å²	46	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-53.2	-42.6	-175.6	-178.8	167.8	-169.8	0	0	113.1	K317 I414 L420 I421 A422	K317-E418 HydrophobicContact CD-CG 4.33Å; K317-E418 VanDerWaalsContact CE-OE1 3.26Å; K317-E418 WeakPolarHBondContact CE-OE1 3.33Å; K317-E418 IonicContact NZ-OE1 3.6Å; K317-E418 PolarHBondContact NZ-OE1 2.62Å; I414-E418 PolarHBondContact O-N 2.97Å; E418-L420 VanDerWaalsContact C-N 3.35Å; E418-L420 PolarHBondContact O-N 2.92Å; E418-I421 PolarHBondContact O-N 2.99Å; E418-A422 VanDerWaalsContact O-CB 3.27Å; E418-A422 WeakPolarHBondContact O-CB 3.38Å; E418-A422 PolarHBondContact O-N 3.36Å
419	K	74.4	Confident	77	Confident	158 Å²	158	49.1 Å²	49.1	69%	0.687	28%	0.275	S	S	*	.	H	α-helix	trans	-66.7	-34.2	176.8	-69.2	178.9	-178.5	169.9	0	113.2	S417 N423	S417-K419 VanDerWaalsContact C-N 3.28Å; S417-K419 PolarHBondContact O-N 3.29Å; K419-N423 PolarHBondContact O-N 3.04Å; K419-N423 PolarHBondContact O-ND2 3.07Å
420	L	76.6	Confident	75.5	Confident	65 Å²	65	49.8 Å²	49.8	34%	0.34	28%	0.279	S	S	.	.	H	α-helix	trans	-72.7	-40.2	178.1	-59.3	174	0	0	0	110.3	S417 E418 N423 M424	S417-L420 WeakPolarHBondContact O-CA 3.37Å; S417-L420 WeakPolarHBondContact O-CB 3.46Å; S417-L420 PolarHBondContact O-N 3.25Å; E418-L420 VanDerWaalsContact C-N 3.35Å; E418-L420 PolarHBondContact O-N 2.92Å; L420-N423 PolarHBondContact O-N 3.48Å; L420-M424 PolarHBondContact O-N 2.87Å
421	I	79.1	Confident	74.2	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-70.8	-38.7	178.3	-60.1	165.8	0	0	0	111	K317 P320 I414 S417 E418 N423 M424 F433	K317-I421 WeakPolarHBondContact O-CG2 3.44Å; P320-I421 HydrophobicContact CB-CG2 4.26Å; P320-I421 HydrophobicContact CG-CG2 4.19Å; I414-I421 HydrophobicContact CG2-CD1 3.9Å; S417-I421 WeakPolarHBondContact O-CG1 3.47Å; S417-I421 PolarHBondContact O-N 2.6Å; E418-I421 PolarHBondContact O-N 2.99Å; I421-N423 VanDerWaalsContact C-N 3.27Å; I421-N423 PolarHBondContact O-N 2.72Å; I421-M424 HydrophobicContact CG1-CE 4.4Å; I421-M424 HydrophobicContact CG2-CE 4.43Å; I421-M424 VanDerWaalsContact O-CB 3.24Å; I421-M424 WeakPolarHBondContact O-CB 3.05Å; I421-M424 PolarHBondContact O-N 3.08Å; I421-F433 HydrophobicContact CD1-CD2 4.43Å; I421-F433 HydrophobicContact CD1-CE1 4.17Å; I421-F433 HydrophobicContact CD1-CE2 4.1Å; I421-F433 HydrophobicContact CD1-CZ 3.96Å; I421-F433 HydrophobicContact CG1-CD1 4.01Å; I421-F433 HydrophobicContact CG1-CD2 4.15Å; I421-F433 HydrophobicContact CG1-CE1 4.17Å; I421-F433 HydrophobicContact CG1-CE2 4.31Å; I421-F433 HydrophobicContact CG1-CG 4Å; I421-F433 HydrophobicContact CG1-CZ 4.32Å
422	A	76.3	Confident	73.1	Confident	76 Å²	76	63.9 Å²	63.9	63%	0.628	34%	0.339	S	S	*	.	H	α-helix	trans	-65.4	-29.4	177.3	0	0	0	0	0	113.4	E418	E418-A422 VanDerWaalsContact O-CB 3.27Å; E418-A422 WeakPolarHBondContact O-CB 3.38Å; E418-A422 PolarHBondContact O-N 3.36Å
423	N	78.7	Confident	72.9	Confident	137 Å²	137	64.1 Å²	64.1	73%	0.733	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	13.5	178.8	-65.2	-21.5	0	0	0	112.8	K419 L420 I421	K419-N423 PolarHBondContact O-N 3.04Å; K419-N423 PolarHBondContact O-ND2 3.07Å; L420-N423 PolarHBondContact O-N 3.48Å; I421-N423 VanDerWaalsContact C-N 3.27Å; I421-N423 PolarHBondContact O-N 2.72Å
424	M	75.6	Confident	72.6	Confident	23 Å²	23	68.8 Å²	68.8	11%	0.113	36%	0.362	C	S	.	.			trans	-68.8	137.6	-177.8	-166.1	177.7	-70.5	0	0	110.7	F321 R324 L420 I421 E426 F433	F321-M424 HydrophobicContact CB-CE 4.23Å; F321-M424 HydrophobicContact CB-SD 4.25Å; F321-M424 HydrophobicContact CD2-CE 3.9Å; F321-M424 HydrophobicContact CD2-SD 4.1Å; R324-M424 VanDerWaalsContact CD-SD 3.52Å; L420-M424 PolarHBondContact O-N 2.87Å; I421-M424 HydrophobicContact CG1-CE 4.4Å; I421-M424 HydrophobicContact CG2-CE 4.43Å; I421-M424 VanDerWaalsContact O-CB 3.24Å; I421-M424 WeakPolarHBondContact O-CB 3.05Å; I421-M424 PolarHBondContact O-N 3.08Å; M424-E426 PolarHBondContact O-N 2.77Å; M424-F433 HydrophobicContact CE-CB 3.87Å; M424-F433 HydrophobicContact CE-CD1 3.62Å; M424-F433 HydrophobicContact CE-CG 4.13Å
425	P	74.1	Confident	72.4	Confident	64 Å²	64	69 Å²	69	42%	0.416	36%	0.363	S	S	.	.			trans	-64.5	134	176.9	25.8	-33.6	0	0	0	111	S427	P425-S427 PolarHBondContact O-N 3.47Å
426	E	69.4	Low	72.5	Confident	175 Å²	175	70.4 Å²	70.4	82%	0.818	37%	0.373	S	S	*	.	S	Bend	trans	-66.4	-21.4	178.6	-63.2	-177.7	171.2	0	0	112.6	M424	M424-E426 PolarHBondContact O-N 2.77Å
427	S	59.4	Low	72.7	Confident	93 Å²	93	70.8 Å²	70.8	65%	0.65	37%	0.373	S	S	*	.	S	Bend	trans	-143.2	140.3	179	-60.8	0	0	0	0	110.4	P425	P425-S427 PolarHBondContact O-N 3.47Å
428	G	52.9	Low	72.9	Confident	23 Å²	23	71.4 Å²	71.4	24%	0.237	38%	0.376	C	S	.	.	S	Bend	trans	96.7	169.7	-175.1	0	0	0	0	0	113.3	R324 D326	R324-G428 PolarHBondContact NE-O 2.96Å; R324-G428 PolarHBondContact NH2-O 3.35Å; D326-G428 VanDerWaalsContact OD2-C 3.24Å; D326-G428 WeakPolarHBondContact OD2-CA 3.45Å; D326-G428 PolarHBondContact OD2-N 2.95Å
429	P	55.2	Low	73.5	Confident	68 Å²	68	68.6 Å²	68.6	44%	0.442	36%	0.363	S	S	.	.			trans	-62.3	135.3	179.9	24	-34	0	0	0	112.6	Y431	P429-Y431 HydrophobicContact CB-CE1 4.07Å; P429-Y431 HydrophobicContact CB-CE2 4.22Å; P429-Y431 HydrophobicContact CG-CE1 3.96Å; P429-Y431 HydrophobicContact CG-CE2 3.65Å; P429-Y431 WeakPolarHBondContact CG-OH 3.49Å; P429-Y431 WeakPolarHBondContact O-CD2 3.48Å; P429-Y431 PolarHBondContact O-N 3.31Å
430	S	58.3	Low	74.3	Confident	14 Å²	14	61.2 Å²	61.2	10%	0.098	33%	0.33	C	S	.	.			trans	-83.8	108.8	171.1	174.8	0	0	0	0	108.4	F433	S430-F433 WeakPolarHBondContact CB-O 3.47Å; S430-F433 PolarHBondContact OG-N 3.17Å; S430-F433 PolarHBondContact OG-O 3.17Å
431	Y	63.8	Low	75	Confident	149 Å²	149	58.1 Å²	58.1	58%	0.584	31%	0.314	S	S	*	.	S	Bend	trans	-89.7	-24.6	178.6	-58	-74.4	0	0	0	112.7	W155 P429	W155-Y431 HydrophobicContact CD2-CE1 4.48Å; W155-Y431 HydrophobicContact CH2-CE1 4.07Å; W155-Y431 AromaticContact CZ2-CE1 3.87Å; W155-Y431 HydrophobicContact CZ2-CE1 3.87Å; W155-Y431 HydrophobicContact CZ3-CE1 4.4Å; P429-Y431 HydrophobicContact CB-CE1 4.07Å; P429-Y431 HydrophobicContact CB-CE2 4.22Å; P429-Y431 HydrophobicContact CG-CE1 3.96Å; P429-Y431 HydrophobicContact CG-CE2 3.65Å; P429-Y431 WeakPolarHBondContact CG-OH 3.49Å; P429-Y431 WeakPolarHBondContact O-CD2 3.48Å; P429-Y431 PolarHBondContact O-N 3.31Å
432	E	67.9	Low	75.8	Confident	148 Å²	148	57.8 Å²	57.8	69%	0.692	31%	0.313	S	S	*	.	S	Bend	trans	-85.6	-27.6	-174.1	-68.7	-79.1	151.2	0	0	113
433	F	80.6	Confident	76.8	Confident	7 Å²	7	54.2 Å²	54.2	3%	0.031	28%	0.283	C	S	.	.			trans	-143.9	122.3	-179.8	178.6	-89.6	0	0	0	110.9	V318 F321 K413 I414 I421 M424 S430 L435	V318-F433 HydrophobicContact CG2-CE1 4.29Å; F321-F433 AromaticContact CD2-CD1 3.93Å; F321-F433 HydrophobicContact CD2-CD1 3.93Å; F321-F433 HydrophobicContact CD2-CE1 4.13Å; F321-F433 HydrophobicContact CE2-CD1 4.4Å; F321-F433 HydrophobicContact CG-CE1 4.38Å; K413-F433 HydrophobicContact CG-CE2 4.32Å; I414-F433 HydrophobicContact CG1-CE2 4.5Å; I414-F433 HydrophobicContact CG1-CZ 3.83Å; I421-F433 HydrophobicContact CD1-CD2 4.43Å; I421-F433 HydrophobicContact CD1-CE1 4.17Å; I421-F433 HydrophobicContact CD1-CE2 4.1Å; I421-F433 HydrophobicContact CD1-CZ 3.96Å; I421-F433 HydrophobicContact CG1-CD1 4.01Å; I421-F433 HydrophobicContact CG1-CD2 4.15Å; I421-F433 HydrophobicContact CG1-CE1 4.17Å; I421-F433 HydrophobicContact CG1-CE2 4.31Å; I421-F433 HydrophobicContact CG1-CG 4Å; I421-F433 HydrophobicContact CG1-CZ 4.32Å; M424-F433 HydrophobicContact CE-CB 3.87Å; M424-F433 HydrophobicContact CE-CD1 3.62Å; M424-F433 HydrophobicContact CE-CG 4.13Å; S430-F433 WeakPolarHBondContact CB-O 3.47Å; S430-F433 PolarHBondContact OG-N 3.17Å; S430-F433 PolarHBondContact OG-O 3.17Å; F433-L435 HydrophobicContact CE1-CD1 3.92Å; F433-L435 HydrophobicContact CE1-CD2 4.21Å; F433-L435 HydrophobicContact CE1-CG 3.69Å; F433-L435 HydrophobicContact CE2-CD2 4.48Å; F433-L435 HydrophobicContact CZ-CD1 4.01Å; F433-L435 HydrophobicContact CZ-CD2 3.74Å; F433-L435 HydrophobicContact CZ-CG 3.74Å
434	H	80.4	Confident	77.7	Confident	119 Å²	119	47.7 Å²	47.7	55%	0.551	25%	0.248	S	C	*	.			trans	-133.1	146	179.3	-175.2	72.6	0	0	0	111.4	K413	K413-H434 PolarHBondContact NZ-O 2.94Å
435	L	83.1	Confident	78.8	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.021	24%	0.244	C	C	.	.			trans	-124.5	125.3	171	-64.8	177.4	0	0	0	109.1	V318 F321 T410 K413 I414 F433 E439 I440	V318-L435 HydrophobicContact CG2-CD1 3.74Å; F321-L435 HydrophobicContact CD1-CD1 4.38Å; F321-L435 HydrophobicContact CE1-CB 4.12Å; F321-L435 HydrophobicContact CE1-CD1 4.34Å; F321-L435 HydrophobicContact CZ-CB 4.05Å; T410-L435 HydrophobicContact CG2-CD2 3.82Å; K413-L435 HydrophobicContact CD-CD2 4.29Å; I414-L435 HydrophobicContact CD1-CD1 4.29Å; I414-L435 HydrophobicContact CG1-CD1 4.5Å; F433-L435 HydrophobicContact CE1-CD1 3.92Å; F433-L435 HydrophobicContact CE1-CD2 4.21Å; F433-L435 HydrophobicContact CE1-CG 3.69Å; F433-L435 HydrophobicContact CE2-CD2 4.48Å; F433-L435 HydrophobicContact CZ-CD1 4.01Å; F433-L435 HydrophobicContact CZ-CD2 3.74Å; F433-L435 HydrophobicContact CZ-CG 3.74Å; L435-E439 WeakPolarHBondContact CA-OE2 3.47Å; L435-E439 HydrophobicContact CD2-CB 4.39Å; L435-I440 HydrophobicContact CB-CD1 4.23Å; L435-I440 HydrophobicContact CB-CG1 3.86Å
436	T	83.9	Confident	79.9	Confident	42 Å²	42	43.8 Å²	43.8	26%	0.258	22%	0.224	S	C	.	.			trans	-71.1	162.4	174.8	63.7	0	0	0	0	111.2	Q438 E439 I440	T436-Q438 PolarHBondContact O-N 2.88Å; T436-E439 PolarHBondContact N-OE2 3.39Å; T436-E439 PolarHBondContact O-N 3.34Å; T436-E439 WeakPolarHBondContact OG1-CG 3.27Å; T436-E439 PolarHBondContact OG1-N 3.01Å; T436-E439 PolarHBondContact OG1-OE2 3.49Å; T436-E439 VanDerWaalsContact OG1-OE2 3.11Å; T436-I440 VanDerWaalsContact O-CG1 3.32Å; T436-I440 WeakPolarHBondContact O-CG1 3.37Å; T436-I440 PolarHBondContact O-N 3.29Å
437	R	81.8	Confident	81.3	Confident	43 Å²	43	35.4 Å²	35.4	16%	0.162	19%	0.185	C	C	.	.	H	α-helix	trans	-53.5	-41.4	172.3	-177.6	177.8	-166.4	-76.4	-6.3	111.9	Y73 Y76 I113 I440 V441	Y73-R437 HydrophobicContact CE1-CG 4.36Å; Y73-R437 HydrophobicContact CE2-CG 4.39Å; Y73-R437 PolarHBondContact O-NH2 2.6Å; Y76-R437 PolarHBondContact O-NH1 3.44Å; I113-R437 VanDerWaalsContact CG1-NH2 3.32Å; I113-R437 VanDerWaalsContact CG2-CZ 3.46Å; R437-I440 PolarHBondContact O-N 2.99Å; R437-V441 HydrophobicContact CG-CG2 4.26Å; R437-V441 WeakPolarHBondContact O-CB 3.49Å; R437-V441 VanDerWaalsContact O-CG2 3.26Å; R437-V441 WeakPolarHBondContact O-CG2 3.29Å; R437-V441 PolarHBondContact O-N 2.7Å
438	Q	83.7	Confident	83.2	Confident	16 Å²	16	31 Å²	31	8%	0.075	16%	0.155	C	C	.	.	H	α-helix	trans	-65.7	-44.3	-178.9	-163.5	-171	43.7	0	0	111.2	Y77 K78 I171 T436 V441 S442	Y77-Q438 HydrophobicContact CD2-CG 4.35Å; Y77-Q438 HydrophobicContact CE2-CG 3.67Å; K78-Q438 PolarHBondContact O-NE2 2.69Å; I171-Q438 HydrophobicContact CD1-CB 3.88Å; I171-Q438 HydrophobicContact CD1-CG 4.48Å; I171-Q438 VanDerWaalsContact CD1-OE1 3.29Å; I171-Q438 HydrophobicContact CG1-CB 4.38Å; I171-Q438 VanDerWaalsContact CG1-OE1 3.27Å; T436-Q438 PolarHBondContact O-N 2.88Å; Q438-V441 PolarHBondContact O-N 3.2Å; Q438-S442 VanDerWaalsContact O-CB 3.25Å; Q438-S442 WeakPolarHBondContact O-CB 3.14Å; Q438-S442 PolarHBondContact O-N 2.81Å; Q438-S442 PolarHBondContact O-OG 3.43Å
439	E	88.3	Confident	85.4	Confident	11 Å²	11	31.3 Å²	31.3	5%	0.051	15%	0.149	C	C	.	.	H	α-helix	trans	-60.1	-46.4	174.4	-73.7	173.9	116.9	0	0	111.3	T410 K413 L435 T436 S442 L443	T410-E439 HydrophobicContact CG2-CB 3.98Å; K413-E439 WeakPolarHBondContact CD-OE1 3.38Å; K413-E439 IonicContact NZ-OE1 3.63Å; K413-E439 PolarHBondContact NZ-OE1 2.84Å; K413-E439 IonicContact NZ-OE2 2.76Å; K413-E439 PolarHBondContact NZ-OE2 3.45Å; L435-E439 WeakPolarHBondContact CA-OE2 3.47Å; L435-E439 HydrophobicContact CD2-CB 4.39Å; T436-E439 PolarHBondContact N-OE2 3.39Å; T436-E439 PolarHBondContact O-N 3.34Å; T436-E439 WeakPolarHBondContact OG1-CG 3.27Å; T436-E439 PolarHBondContact OG1-N 3.01Å; T436-E439 PolarHBondContact OG1-OE2 3.49Å; T436-E439 VanDerWaalsContact OG1-OE2 3.11Å; E439-S442 WeakPolarHBondContact CA-OG 3.39Å; E439-S442 PolarHBondContact O-N 3.09Å; E439-S442 PolarHBondContact O-OG 2.74Å; E439-L443 VanDerWaalsContact O-CB 3.26Å; E439-L443 WeakPolarHBondContact O-CB 3.36Å; E439-L443 PolarHBondContact O-N 3.43Å
440	I	91	Very high	87.4	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-51	178.4	-64.5	164.9	0	0	0	110.7	Y73 F74 F321 F322 F327 L435 T436 R437 S442 L443 F444	Y73-I440 HydrophobicContact CE1-CG2 3.91Å; F74-I440 HydrophobicContact CE1-CG2 3.91Å; F74-I440 HydrophobicContact CZ-CG2 4.13Å; F321-I440 HydrophobicContact CE1-CD1 4.36Å; F322-I440 HydrophobicContact CE1-CD1 4.32Å; F322-I440 HydrophobicContact CE1-CG1 4.41Å; F322-I440 HydrophobicContact CE1-CG2 4.25Å; F322-I440 HydrophobicContact CZ-CG1 4.31Å; F322-I440 HydrophobicContact CZ-CG2 4.34Å; F327-I440 HydrophobicContact CE2-CD1 3.78Å; F327-I440 HydrophobicContact CZ-CD1 3.96Å; L435-I440 HydrophobicContact CB-CD1 4.23Å; L435-I440 HydrophobicContact CB-CG1 3.86Å; T436-I440 VanDerWaalsContact O-CG1 3.32Å; T436-I440 WeakPolarHBondContact O-CG1 3.37Å; T436-I440 PolarHBondContact O-N 3.29Å; R437-I440 PolarHBondContact O-N 2.99Å; I440-S442 VanDerWaalsContact C-N 3.3Å; I440-S442 PolarHBondContact O-N 2.98Å; I440-L443 PolarHBondContact O-N 2.71Å; I440-F444 HydrophobicContact CG2-CD2 4.1Å; I440-F444 HydrophobicContact CG2-CE2 4.16Å; I440-F444 WeakPolarHBondContact O-CD2 3.49Å; I440-F444 PolarHBondContact O-N 3.38Å
441	V	91.1	Very high	89.3	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.2	-43.9	178.7	171.7	0	0	0	0	110.7	Y73 Y77 R437 Q438 N445	Y73-V441 HydrophobicContact CD1-CG2 4.25Å; Y73-V441 HydrophobicContact CE1-CG2 4.1Å; Y73-V441 WeakPolarHBondContact O-CG2 3.44Å; Y77-V441 HydrophobicContact CD2-CB 4.5Å; Y77-V441 HydrophobicContact CD2-CG1 3.89Å; R437-V441 HydrophobicContact CG-CG2 4.26Å; R437-V441 WeakPolarHBondContact O-CB 3.49Å; R437-V441 VanDerWaalsContact O-CG2 3.26Å; R437-V441 WeakPolarHBondContact O-CG2 3.29Å; R437-V441 PolarHBondContact O-N 2.7Å; Q438-V441 PolarHBondContact O-N 3.2Å; V441-N445 WeakPolarHBondContact CG1-ND2 3.24Å; V441-N445 VanDerWaalsContact O-CB 3.26Å; V441-N445 WeakPolarHBondContact O-CB 3.37Å; V441-N445 PolarHBondContact O-N 3.03Å; V441-N445 PolarHBondContact O-ND2 3.23Å
442	S	95.5	Very high	91	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66.3	-41	179.9	74.3	0	0	0	0	112.6	Q406 G407 Q438 E439 I440 N445 A446	Q406-S442 WeakPolarHBondContact CG-OG 3.48Å; G407-S442 PolarHBondContact N-OG 2.98Å; Q438-S442 VanDerWaalsContact O-CB 3.25Å; Q438-S442 WeakPolarHBondContact O-CB 3.14Å; Q438-S442 PolarHBondContact O-N 2.81Å; Q438-S442 PolarHBondContact O-OG 3.43Å; E439-S442 WeakPolarHBondContact CA-OG 3.39Å; E439-S442 PolarHBondContact O-N 3.09Å; E439-S442 PolarHBondContact O-OG 2.74Å; I440-S442 VanDerWaalsContact C-N 3.3Å; I440-S442 PolarHBondContact O-N 2.98Å; S442-N445 PolarHBondContact O-N 3.01Å; S442-A446 WeakPolarHBondContact O-CB 3.15Å; S442-A446 PolarHBondContact O-N 3.13Å
443	L	97.4	Very high	92.5	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-60.5	-52.8	-179.6	178	66.8	0	0	0	111.5	L315 T410 A411 I414 E439 I440 F447	L315-L443 HydrophobicContact CD2-CD2 3.91Å; L315-L443 HydrophobicContact CD2-CG 4.01Å; T410-L443 HydrophobicContact CG2-CB 4.14Å; T410-L443 HydrophobicContact CG2-CD1 4.3Å; T410-L443 HydrophobicContact CG2-CD2 4.23Å; T410-L443 HydrophobicContact CG2-CG 4.47Å; A411-L443 HydrophobicContact CB-CD1 3.9Å; I414-L443 HydrophobicContact CD1-CD1 4.25Å; I414-L443 HydrophobicContact CD1-CD2 3.54Å; E439-L443 VanDerWaalsContact O-CB 3.26Å; E439-L443 WeakPolarHBondContact O-CB 3.36Å; E439-L443 PolarHBondContact O-N 3.43Å; I440-L443 PolarHBondContact O-N 2.71Å; L443-F447 WeakPolarHBondContact O-CB 3.48Å; L443-F447 PolarHBondContact O-N 2.72Å; L443-F447 VanDerWaalsContact O-N 3.12Å
444	F	98.4	Very high	93.3	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-71.9	-36.9	-178.7	-75.7	-90.5	0	0	0	112.2	L68 L69 F74 L315 F322 L344 L348 I440 G448	L68-F444 HydrophobicContact CD2-CD1 4.03Å; L68-F444 HydrophobicContact CD2-CE1 4.27Å; L69-F444 HydrophobicContact CD2-CB 4.01Å; F74-F444 HydrophobicContact CD1-CB 3.95Å; F74-F444 HydrophobicContact CD1-CG 4.49Å; F74-F444 HydrophobicContact CE1-CB 3.7Å; F74-F444 AromaticContact CE1-CD2 3.61Å; F74-F444 HydrophobicContact CE1-CD2 3.61Å; F74-F444 HydrophobicContact CE1-CE2 4.42Å; F74-F444 AromaticContact CE1-CG 3.77Å; F74-F444 HydrophobicContact CE1-CG 3.77Å; F74-F444 HydrophobicContact CZ-CD2 4.06Å; F74-F444 HydrophobicContact CZ-CE2 4.46Å; F74-F444 HydrophobicContact CZ-CG 4.28Å; L315-F444 HydrophobicContact CD2-CD1 4.2Å; L315-F444 HydrophobicContact CD2-CE1 3.81Å; L315-F444 HydrophobicContact CD2-CE2 4.27Å; L315-F444 HydrophobicContact CD2-CZ 3.86Å; F322-F444 HydrophobicContact CE1-CE2 4.44Å; F322-F444 HydrophobicContact CE2-CE2 4.21Å; F322-F444 HydrophobicContact CE2-CZ 4.31Å; F322-F444 AromaticContact CZ-CE2 3.81Å; F322-F444 HydrophobicContact CZ-CE2 3.81Å; F322-F444 HydrophobicContact CZ-CZ 4.28Å; L344-F444 HydrophobicContact CD1-CE1 4.15Å; L344-F444 HydrophobicContact CD1-CE2 3.87Å; L344-F444 HydrophobicContact CD1-CZ 3.59Å; L344-F444 HydrophobicContact CD2-CZ 4.43Å; L344-F444 HydrophobicContact CG-CE1 4.21Å; L344-F444 HydrophobicContact CG-CZ 3.88Å; L348-F444 HydrophobicContact CD1-CZ 4.39Å; L348-F444 HydrophobicContact CD2-CE1 4.04Å; L348-F444 HydrophobicContact CD2-CZ 3.99Å; L348-F444 HydrophobicContact CG-CZ 4.39Å; I440-F444 HydrophobicContact CG2-CD2 4.1Å; I440-F444 HydrophobicContact CG2-CE2 4.16Å; I440-F444 WeakPolarHBondContact O-CD2 3.49Å; I440-F444 PolarHBondContact O-N 3.38Å; F444-G448 PolarHBondContact O-N 3.5Å
445	N	98.3	Very high	94.1	Very high	3 Å²	3	9.5 Å²	9.5	2%	0.016	5%	0.045	C	C	.	.	H	α-helix	trans	-69.8	-38.6	176.8	-83.6	-79.3	0	0	0	112.2	L69 F74 L181 L403 V441 S442 G448 R449	L69-N445 HydrophobicContact CD2-CB 4.49Å; F74-N445 PolarHBondContact O-ND2 2.86Å; L181-N445 HydrophobicContact CD1-CB 4.41Å; L181-N445 WeakPolarHBondContact CD1-OD1 3.5Å; L403-N445 HydrophobicContact CD1-CB 3.95Å; L403-N445 HydrophobicContact CD2-CB 3.63Å; L403-N445 HydrophobicContact CG-CB 4.28Å; V441-N445 WeakPolarHBondContact CG1-ND2 3.24Å; V441-N445 VanDerWaalsContact O-CB 3.26Å; V441-N445 WeakPolarHBondContact O-CB 3.37Å; V441-N445 PolarHBondContact O-N 3.03Å; V441-N445 PolarHBondContact O-ND2 3.23Å; S442-N445 PolarHBondContact O-N 3.01Å; N445-G448 WeakPolarHBondContact O-CA 3.43Å; N445-G448 PolarHBondContact O-N 3.16Å; N445-R449 WeakPolarHBondContact O-CG 3.46Å; N445-R449 PolarHBondContact O-N 3.39Å
446	A	98.3	Very high	94.9	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.008	5%	0.049	C	C	.	.	H	α-helix	trans	-58.9	-53.4	174.4	0	0	0	0	0	110.2	L403 S442 G448 R449 I450	L403-A446 HydrophobicContact CD2-CB 4.48Å; S442-A446 WeakPolarHBondContact O-CB 3.15Å; S442-A446 PolarHBondContact O-N 3.13Å; A446-G448 VanDerWaalsContact C-N 3.25Å; A446-G448 PolarHBondContact O-N 3.09Å; A446-R449 WeakPolarHBondContact O-CB 3.38Å; A446-R449 PolarHBondContact O-N 3.15Å; A446-I450 PolarHBondContact O-N 3.38Å; A446-I450 VanDerWaalsContact O-N 3.13Å
447	F	98.7	Very high	95.5	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-59.3	-37.2	175	-177.3	-108.2	0	0	0	112.6	L61 L65 Y308 E311 L312 L315 I351 L443 R449 I450 S451	L61-F447 HydrophobicContact CD2-CE1 3.62Å; L61-F447 HydrophobicContact CD2-CZ 3.68Å; L65-F447 HydrophobicContact CD1-CD1 4.49Å; L65-F447 HydrophobicContact CD2-CD1 3.66Å; L65-F447 HydrophobicContact CD2-CE1 3.74Å; Y308-F447 AromaticContact CD2-CE2 3.71Å; Y308-F447 HydrophobicContact CD2-CE2 3.71Å; Y308-F447 HydrophobicContact CD2-CZ 4.2Å; Y308-F447 AromaticContact CE2-CE2 3.52Å; Y308-F447 HydrophobicContact CE2-CE2 3.52Å; Y308-F447 AromaticContact CE2-CZ 3.52Å; Y308-F447 HydrophobicContact CE2-CZ 3.52Å; Y308-F447 HydrophobicContact CG-CE2 4.41Å; Y308-F447 AromaticContact CZ-CZ 3.88Å; E311-F447 HydrophobicContact CB-CD2 3.68Å; E311-F447 HydrophobicContact CB-CE2 4.44Å; E311-F447 WeakPolarHBondContact OE2-CA 3.16Å; E311-F447 PolarHBondContact OE2-N 3.47Å; L312-F447 HydrophobicContact CB-CE2 4.04Å; L312-F447 HydrophobicContact CB-CZ 4.42Å; L312-F447 HydrophobicContact CD1-CE2 4.13Å; L312-F447 HydrophobicContact CD1-CZ 3.65Å; L315-F447 HydrophobicContact CD1-CB 3.92Å; L315-F447 HydrophobicContact CD1-CD1 3.38Å; L315-F447 HydrophobicContact CD1-CD2 3.96Å; L315-F447 HydrophobicContact CD1-CE1 3.83Å; L315-F447 HydrophobicContact CD1-CE2 4.35Å; L315-F447 HydrophobicContact CD1-CG 3.45Å; L315-F447 VanDerWaalsContact CD1-CG 3.45Å; L315-F447 HydrophobicContact CD1-CZ 4.3Å; I351-F447 HydrophobicContact CD1-CE1 4.27Å; L443-F447 WeakPolarHBondContact O-CB 3.48Å; L443-F447 PolarHBondContact O-N 2.72Å; L443-F447 VanDerWaalsContact O-N 3.12Å; F447-R449 VanDerWaalsContact C-N 3.32Å; F447-R449 PolarHBondContact O-N 3.27Å; F447-I450 PolarHBondContact O-N 2.97Å; F447-S451 VanDerWaalsContact O-CB 3.23Å; F447-S451 WeakPolarHBondContact O-CB 3.24Å; F447-S451 PolarHBondContact O-N 3.48Å
448	G	98.6	Very high	96.1	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.01	4%	0.035	C	C	.	.	H	α-helix	trans	-57.4	-39.3	172.2	0	0	0	0	0	114	F444 N445 A446 T452	F444-G448 PolarHBondContact O-N 3.5Å; N445-G448 WeakPolarHBondContact O-CA 3.43Å; N445-G448 PolarHBondContact O-N 3.16Å; A446-G448 VanDerWaalsContact C-N 3.25Å; A446-G448 PolarHBondContact O-N 3.09Å; G448-T452 WeakPolarHBondContact O-CB 3.31Å; G448-T452 PolarHBondContact O-N 3.19Å; G448-T452 PolarHBondContact O-OG1 3.02Å
449	R	98.5	Very high	96.7	Very high	29 Å²	29	9 Å²	9	11%	0.109	4%	0.043	C	C	.	.	H	α-helix	trans	-68.2	-44.2	174.2	-62.9	-50	82.5	133.2	0.5	110.9	H261 W400 Q404 N445 A446 F447 S451 T452 S453	H261-R449 PolarHBondContact CE1-O 3.45Å; W400-R449 HydrophobicContact CE3-CG 3.98Å; W400-R449 HydrophobicContact CZ3-CG 3.91Å; Q404-R449 HydrophobicContact CG-CG 4.36Å; N445-R449 WeakPolarHBondContact O-CG 3.46Å; N445-R449 PolarHBondContact O-N 3.39Å; A446-R449 WeakPolarHBondContact O-CB 3.38Å; A446-R449 PolarHBondContact O-N 3.15Å; F447-R449 VanDerWaalsContact C-N 3.32Å; F447-R449 PolarHBondContact O-N 3.27Å; R449-S451 PolarHBondContact O-N 2.88Å; R449-T452 WeakPolarHBondContact O-CB 3.42Å; R449-T452 PolarHBondContact O-N 3.46Å; R449-S453 PolarHBondContact O-N 3.06Å; R449-S453 PolarHBondContact O-OG 2.88Å
450	I	98.5	Very high	97.1	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.005	4%	0.04	C	C	.	.	H	α-helix	trans	-65	-44.4	178.8	-49.1	-49	0	0	0	110.8	S257 L304 L307 Y308 E311 A446 F447 T452 S453 V454	S257-I450 WeakPolarHBondContact OG-CD1 3.36Å; L304-I450 HydrophobicContact CD2-CG2 4.18Å; L307-I450 HydrophobicContact CD2-CD1 3.58Å; L307-I450 HydrophobicContact CD2-CG1 4.04Å; L307-I450 HydrophobicContact CG-CD1 4.31Å; L307-I450 HydrophobicContact CG-CG1 4.24Å; Y308-I450 HydrophobicContact CD2-CG2 4.07Å; Y308-I450 HydrophobicContact CG-CG2 4.37Å; E311-I450 WeakPolarHBondContact OE2-CG1 3.46Å; A446-I450 PolarHBondContact O-N 3.38Å; A446-I450 VanDerWaalsContact O-N 3.13Å; F447-I450 PolarHBondContact O-N 2.97Å; I450-T452 VanDerWaalsContact C-N 3.33Å; I450-T452 PolarHBondContact O-N 3.19Å; I450-S453 WeakPolarHBondContact O-CA 3.34Å; I450-S453 WeakPolarHBondContact O-CB 3.27Å; I450-S453 PolarHBondContact O-N 3.3Å; I450-V454 PolarHBondContact O-N 2.61Å
451	S	98.6	Very high	97.1	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-57.3	-42.6	173	176.2	0	0	0	0	112.4	N57 F447 R449 S453 V454 K455	N57-S451 PolarHBondContact ND2-O 3.21Å; N57-S451 VanDerWaalsContact OD1-CB 3.3Å; N57-S451 WeakPolarHBondContact OD1-CB 3.46Å; N57-S451 PolarHBondContact OD1-OG 3.13Å; F447-S451 VanDerWaalsContact O-CB 3.23Å; F447-S451 WeakPolarHBondContact O-CB 3.24Å; F447-S451 PolarHBondContact O-N 3.48Å; R449-S451 PolarHBondContact O-N 2.88Å; S451-S453 VanDerWaalsContact C-N 3.34Å; S451-V454 PolarHBondContact O-N 3.37Å; S451-K455 PolarHBondContact O-N 2.98Å; S451-K455 VanDerWaalsContact O-N 3.07Å
452	T	98.7	Very high	97.2	Very high	8 Å²	8	14.8 Å²	14.8	5%	0.049	7%	0.07	C	C	.	.	H	α-helix	trans	-61.8	-42.7	172.5	-59.1	0	0	0	0	111.2	F62 G448 R449 I450 V454 K455 E456	F62-T452 HydrophobicContact CE2-CG2 4.49Å; G448-T452 WeakPolarHBondContact O-CB 3.31Å; G448-T452 PolarHBondContact O-N 3.19Å; G448-T452 PolarHBondContact O-OG1 3.02Å; R449-T452 WeakPolarHBondContact O-CB 3.42Å; R449-T452 PolarHBondContact O-N 3.46Å; I450-T452 VanDerWaalsContact C-N 3.33Å; I450-T452 PolarHBondContact O-N 3.19Å; T452-V454 PolarHBondContact O-N 3.25Å; T452-K455 WeakPolarHBondContact O-CB 3.35Å; T452-K455 PolarHBondContact O-N 3.42Å; T452-K455 VanDerWaalsContact O-N 3.11Å; T452-E456 HydrophobicContact CG2-CG 4.26Å; T452-E456 WeakPolarHBondContact O-CG 3.47Å; T452-E456 PolarHBondContact O-N 2.99Å
453	S	98.6	Very high	97.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.6	-43.6	-179.8	-52.8	0	0	0	0	111.5	S257 H261 R449 I450 S451 K455 E456 L457	S257-S453 WeakPolarHBondContact CB-OG 3.41Å; S257-S453 PolarHBondContact OG-OG 3.33Å; H261-S453 PolarHBondContact CE1-OG 3.26Å; H261-S453 PolarHBondContact ND1-OG 3Å; R449-S453 PolarHBondContact O-N 3.06Å; R449-S453 PolarHBondContact O-OG 2.88Å; I450-S453 WeakPolarHBondContact O-CA 3.34Å; I450-S453 WeakPolarHBondContact O-CB 3.27Å; I450-S453 PolarHBondContact O-N 3.3Å; S451-S453 VanDerWaalsContact C-N 3.34Å; S453-K455 VanDerWaalsContact C-N 3.29Å; S453-K455 PolarHBondContact O-N 3.02Å; S453-E456 PolarHBondContact O-N 3.22Å; S453-E456 VanDerWaalsContact O-N 3.14Å; S453-L457 WeakPolarHBondContact O-CG 3.44Å; S453-L457 PolarHBondContact O-N 3.01Å
454	V	97.8	Very high	96.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.2	-42.5	173.4	174.3	0	0	0	0	110.9	D54 N57 L304 Y305 Y308 I450 S451 T452 E456 L457	D54-V454 WeakPolarHBondContact OD1-CG1 3.44Å; N57-V454 HydrophobicContact CB-CG1 4.07Å; L304-V454 HydrophobicContact CD2-CG2 3.71Å; Y305-V454 HydrophobicContact CD1-CG2 4.35Å; Y305-V454 HydrophobicContact CE1-CG1 4Å; Y305-V454 HydrophobicContact CE1-CG2 4.08Å; Y308-V454 HydrophobicContact CD2-CG2 4.07Å; Y308-V454 HydrophobicContact CG-CG2 4.35Å; I450-V454 PolarHBondContact O-N 2.61Å; S451-V454 PolarHBondContact O-N 3.37Å; T452-V454 PolarHBondContact O-N 3.25Å; V454-E456 PolarHBondContact O-N 2.78Å; V454-L457 WeakPolarHBondContact O-CB 3.32Å; V454-L457 PolarHBondContact O-N 3.25Å
455	K	98.1	Very high	95.9	Very high	38 Å²	38	23.1 Å²	23.1	17%	0.165	11%	0.111	C	C	.	.	H	α-helix	trans	-63.1	-40.5	175	-179	61.7	-172.7	176.7	0	112.6	N58 F62 S451 T452 S453 L457 E458 N459	N58-K455 HydrophobicContact CB-CD 3.71Å; N58-K455 VanDerWaalsContact OD1-CA 3.31Å; N58-K455 WeakPolarHBondContact OD1-CA 3.47Å; N58-K455 PolarHBondContact OD1-N 3.33Å; F62-K455 HydrophobicContact CD1-CG 4.3Å; F62-K455 HydrophobicContact CD2-CB 4.09Å; F62-K455 HydrophobicContact CD2-CG 4.48Å; F62-K455 HydrophobicContact CE1-CG 4.19Å; F62-K455 HydrophobicContact CE2-CB 4.11Å; F62-K455 HydrophobicContact CE2-CG 4.38Å; F62-K455 HydrophobicContact CG-CB 4.44Å; F62-K455 HydrophobicContact CG-CG 4.45Å; F62-K455 HydrophobicContact CZ-CB 4.43Å; F62-K455 HydrophobicContact CZ-CG 4.23Å; S451-K455 PolarHBondContact O-N 2.98Å; S451-K455 VanDerWaalsContact O-N 3.07Å; T452-K455 WeakPolarHBondContact O-CB 3.35Å; T452-K455 PolarHBondContact O-N 3.42Å; T452-K455 VanDerWaalsContact O-N 3.11Å; S453-K455 VanDerWaalsContact C-N 3.29Å; S453-K455 PolarHBondContact O-N 3.02Å; K455-L457 VanDerWaalsContact C-N 3.3Å; K455-L457 PolarHBondContact O-N 3.37Å; K455-E458 IonicContact NZ-OE2 3.64Å; K455-E458 PolarHBondContact NZ-OE2 2.89Å; K455-E458 WeakPolarHBondContact O-CB 3.37Å; K455-E458 PolarHBondContact O-N 3.43Å; K455-N459 PolarHBondContact O-N 3.43Å
456	E	98.3	Very high	94.7	Very high	20 Å²	20	27 Å²	27	9%	0.093	14%	0.138	C	C	.	.	H	α-helix	trans	-68.3	-28.5	178.1	-66.4	-57.8	168.1	0	0	112.9	V260 A264 H279 T452 S453 V454 E458 N459 F460	V260-E456 HydrophobicContact CG1-CB 3.81Å; A264-E456 HydrophobicContact CB-CB 4.06Å; A264-E456 HydrophobicContact CB-CG 3.68Å; H279-E456 IonicContact CD2-OE2 3.11Å; H279-E456 IonicContact CE1-OE2 3.41Å; H279-E456 IonicContact NE2-OE2 3.89Å; H279-E456 PolarHBondContact NE2-OE2 3.38Å; T452-E456 HydrophobicContact CG2-CG 4.26Å; T452-E456 WeakPolarHBondContact O-CG 3.47Å; T452-E456 PolarHBondContact O-N 2.99Å; S453-E456 PolarHBondContact O-N 3.22Å; S453-E456 VanDerWaalsContact O-N 3.14Å; V454-E456 PolarHBondContact O-N 2.78Å; E456-E458 VanDerWaalsContact C-N 3.3Å; E456-E458 PolarHBondContact O-N 3.16Å; E456-N459 WeakPolarHBondContact O-CB 3.16Å; E456-N459 PolarHBondContact O-N 3.31Å; E456-N459 PolarHBondContact OE2-ND2 3.3Å; E456-F460 WeakPolarHBondContact O-CD2 3.4Å; E456-F460 PolarHBondContact O-N 3.32Å
457	L	96.9	Very high	93	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.7	-39.2	172.4	-64.7	-176.3	0	0	0	111.8	F36 V260 F284 L301 Y305 S453 V454 K455 F460 R461	F36-L457 HydrophobicContact CE1-CB 4.06Å; F36-L457 HydrophobicContact CE1-CD2 4.31Å; F36-L457 WeakPolarHBondContact CZ-O 3.23Å; V260-L457 HydrophobicContact CG1-CD2 4.43Å; V260-L457 HydrophobicContact CG2-CD2 4.02Å; F284-L457 HydrophobicContact CE2-CD2 3.76Å; F284-L457 HydrophobicContact CZ-CD2 3.79Å; L301-L457 HydrophobicContact CD1-CD2 4.42Å; L301-L457 HydrophobicContact CD2-CD1 4.12Å; L301-L457 HydrophobicContact CD2-CD2 3.7Å; Y305-L457 HydrophobicContact CE2-CD1 3.79Å; S453-L457 WeakPolarHBondContact O-CG 3.44Å; S453-L457 PolarHBondContact O-N 3.01Å; V454-L457 WeakPolarHBondContact O-CB 3.32Å; V454-L457 PolarHBondContact O-N 3.25Å; K455-L457 VanDerWaalsContact C-N 3.3Å; K455-L457 PolarHBondContact O-N 3.37Å; L457-F460 PolarHBondContact O-N 3.14Å; L457-R461 WeakPolarHBondContact O-CB 3.19Å; L457-R461 PolarHBondContact O-N 2.96Å
458	E	95.3	Very high	90.4	Very high	30 Å²	30	40.4 Å²	40.4	14%	0.14	20%	0.202	C	C	.	.	H	α-helix	trans	-64.3	-43.5	172.8	-179.4	179.9	-142	0	0	111.3	N58 Y59 K455 E456 F460 R461 N462	N58-E458 WeakPolarHBondContact CB-OE2 3.4Å; N58-E458 WeakPolarHBondContact ND2-CB 3.42Å; N58-E458 PolarHBondContact ND2-OE2 3.29Å; Y59-E458 PolarHBondContact OH-OE1 2.88Å; K455-E458 IonicContact NZ-OE2 3.64Å; K455-E458 PolarHBondContact NZ-OE2 2.89Å; K455-E458 WeakPolarHBondContact O-CB 3.37Å; K455-E458 PolarHBondContact O-N 3.43Å; E456-E458 VanDerWaalsContact C-N 3.3Å; E456-E458 PolarHBondContact O-N 3.16Å; E458-F460 PolarHBondContact O-N 3.23Å; E458-R461 WeakPolarHBondContact O-CB 3.35Å; E458-R461 PolarHBondContact O-N 3.12Å; E458-N462 VanDerWaalsContact O-CG 3.28Å; E458-N462 PolarHBondContact O-N 3.23Å; E458-N462 PolarHBondContact O-ND2 2.87Å
459	N	96.2	Very high	90	Very high	43 Å²	43	42.4 Å²	42.4	23%	0.23	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-46.4	176.7	-65.6	-24.1	0	0	0	111.5	K455 E456 R461 N462 L463	K455-N459 PolarHBondContact O-N 3.43Å; E456-N459 WeakPolarHBondContact O-CB 3.16Å; E456-N459 PolarHBondContact O-N 3.31Å; E456-N459 PolarHBondContact OE2-ND2 3.3Å; N459-R461 VanDerWaalsContact C-N 3.34Å; N459-R461 PolarHBondContact O-N 2.91Å; N459-N462 PolarHBondContact O-N 2.76Å; N459-L463 WeakPolarHBondContact O-CB 3.26Å; N459-L463 VanDerWaalsContact O-CG 3.27Å; N459-L463 WeakPolarHBondContact O-CG 3.49Å; N459-L463 PolarHBondContact O-N 2.9Å
460	F	96.5	Very high	89.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-39	175.5	-80.7	-62.4	0	0	0	112.5	F36 A264 H279 F284 E456 L457 E458 N462 L463 L464	F36-F460 HydrophobicContact CZ-CB 4.34Å; A264-F460 HydrophobicContact CB-CE2 3.85Å; A264-F460 HydrophobicContact CB-CZ 4.1Å; H279-F460 HydrophobicContact CB-CE1 4.08Å; H279-F460 HydrophobicContact CB-CZ 4.44Å; H279-F460 AromaticContact CD2-CZ 3.94Å; F284-F460 HydrophobicContact CB-CD1 3.89Å; F284-F460 HydrophobicContact CB-CE1 3.58Å; F284-F460 HydrophobicContact CB-CE2 4.26Å; F284-F460 HydrophobicContact CB-CG 4.37Å; F284-F460 HydrophobicContact CB-CZ 3.77Å; F284-F460 HydrophobicContact CD1-CB 4.02Å; F284-F460 AromaticContact CD1-CD1 3.93Å; F284-F460 HydrophobicContact CD1-CD1 3.93Å; F284-F460 HydrophobicContact CD1-CD2 4.3Å; F284-F460 HydrophobicContact CD1-CE1 4.48Å; F284-F460 AromaticContact CD1-CG 3.83Å; F284-F460 HydrophobicContact CD1-CG 3.83Å; F284-F460 HydrophobicContact CD2-CD1 4.22Å; F284-F460 AromaticContact CD2-CD2 3.45Å; F284-F460 HydrophobicContact CD2-CD2 3.45Å; F284-F460 VanDerWaalsContact CD2-CD2 3.45Å; F284-F460 HydrophobicContact CD2-CE1 4.26Å; F284-F460 AromaticContact CD2-CE2 3.48Å; F284-F460 HydrophobicContact CD2-CE2 3.48Å; F284-F460 VanDerWaalsContact CD2-CE2 3.48Å; F284-F460 AromaticContact CD2-CG 3.84Å; F284-F460 HydrophobicContact CD2-CG 3.84Å; F284-F460 AromaticContact CD2-CZ 3.91Å; F284-F460 HydrophobicContact CD2-CZ 3.91Å; F284-F460 HydrophobicContact CE1-CB 3.82Å; F284-F460 HydrophobicContact CE1-CD2 4.42Å; F284-F460 HydrophobicContact CE1-CG 4.05Å; F284-F460 HydrophobicContact CE2-CB 4.39Å; F284-F460 AromaticContact CE2-CD2 3.59Å; F284-F460 HydrophobicContact CE2-CD2 3.59Å; F284-F460 HydrophobicContact CE2-CE2 4.03Å; F284-F460 HydrophobicContact CE2-CG 4.05Å; F284-F460 HydrophobicContact CG-CB 4.39Å; F284-F460 AromaticContact CG-CD1 3.74Å; F284-F460 HydrophobicContact CG-CD1 3.74Å; F284-F460 AromaticContact CG-CD2 3.84Å; F284-F460 HydrophobicContact CG-CD2 3.84Å; F284-F460 AromaticContact CG-CE1 3.86Å; F284-F460 HydrophobicContact CG-CE1 3.86Å; F284-F460 AromaticContact CG-CE2 3.95Å; F284-F460 HydrophobicContact CG-CE2 3.95Å; F284-F460 AromaticContact CG-CG 3.73Å; F284-F460 HydrophobicContact CG-CG 3.73Å; F284-F460 AromaticContact CG-CZ 3.96Å; F284-F460 HydrophobicContact CG-CZ 3.96Å; F284-F460 HydrophobicContact CZ-CB 4.02Å; F284-F460 HydrophobicContact CZ-CD2 4.09Å; F284-F460 HydrophobicContact CZ-CG 4.15Å; E456-F460 WeakPolarHBondContact O-CD2 3.4Å; E456-F460 PolarHBondContact O-N 3.32Å; L457-F460 PolarHBondContact O-N 3.14Å; E458-F460 PolarHBondContact O-N 3.23Å; F460-N462 VanDerWaalsContact C-N 3.34Å; F460-N462 PolarHBondContact O-N 3.45Å; F460-L463 PolarHBondContact O-N 3.26Å; F460-L464 VanDerWaalsContact O-CB 3.31Å; F460-L464 WeakPolarHBondContact O-CB 3.46Å; F460-L464 WeakPolarHBondContact O-CG 3.31Å; F460-L464 PolarHBondContact O-N 3.13Å
461	R	91.7	Very high	89	Confident	53 Å²	53	45.4 Å²	45.4	20%	0.2	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-45.9	175.3	-167.2	-179.4	-59.9	-171.4	12.4	111.2	F36 D54 L457 E458 N459 L464 Q465	F36-R461 HydrophobicContact CD2-CB 4.03Å; F36-R461 HydrophobicContact CD2-CG 3.88Å; F36-R461 HydrophobicContact CE2-CB 3.72Å; F36-R461 HydrophobicContact CE2-CG 4.1Å; F36-R461 HydrophobicContact CG-CG 4.38Å; F36-R461 HydrophobicContact CZ-CB 4.1Å; D54-R461 IonicContact OD2-NH2 2.89Å; D54-R461 PolarHBondContact OD2-NH2 2.98Å; L457-R461 WeakPolarHBondContact O-CB 3.19Å; L457-R461 PolarHBondContact O-N 2.96Å; E458-R461 WeakPolarHBondContact O-CB 3.35Å; E458-R461 PolarHBondContact O-N 3.12Å; N459-R461 VanDerWaalsContact C-N 3.34Å; N459-R461 PolarHBondContact O-N 2.91Å; R461-L464 PolarHBondContact O-N 2.99Å; R461-Q465 WeakPolarHBondContact O-CG 3.43Å; R461-Q465 PolarHBondContact O-N 3.05Å; R461-Q465 VanDerWaalsContact O-N 3.15Å
462	N	93	Very high	88.5	Confident	82 Å²	82	48.1 Å²	48.1	44%	0.439	24%	0.243	S	C	.	.	H	α-helix	trans	-65.7	-44.4	177.7	-66.2	-23.1	0	0	0	112	E458 N459 F460 L464 Q465 S466	E458-N462 VanDerWaalsContact O-CG 3.28Å; E458-N462 PolarHBondContact O-N 3.23Å; E458-N462 PolarHBondContact O-ND2 2.87Å; N459-N462 PolarHBondContact O-N 2.76Å; F460-N462 VanDerWaalsContact C-N 3.34Å; F460-N462 PolarHBondContact O-N 3.45Å; N462-L464 VanDerWaalsContact C-N 3.35Å; N462-L464 PolarHBondContact O-N 2.87Å; N462-Q465 PolarHBondContact O-N 3.01Å; N462-S466 PolarHBondContact O-N 3.25Å; N462-S466 VanDerWaalsContact O-N 3.09Å
463	L	92.6	Very high	87.8	Confident	55 Å²	55	50.6 Å²	50.6	29%	0.288	26%	0.255	S	S	.	.	H	α-helix	trans	-61.1	-43.7	177.1	-72.5	169.8	0	0	0	111.4	H279 I281 N459 F460 Q465 S466 I467	H279-L463 HydrophobicContact CB-CD1 3.66Å; I281-L463 HydrophobicContact CD1-CB 4.32Å; I281-L463 HydrophobicContact CG1-CB 4.33Å; I281-L463 HydrophobicContact CG1-CD1 4.48Å; N459-L463 WeakPolarHBondContact O-CB 3.26Å; N459-L463 VanDerWaalsContact O-CG 3.27Å; N459-L463 WeakPolarHBondContact O-CG 3.49Å; N459-L463 PolarHBondContact O-N 2.9Å; F460-L463 PolarHBondContact O-N 3.26Å; L463-Q465 VanDerWaalsContact C-N 3.3Å; L463-Q465 PolarHBondContact O-N 2.86Å; L463-S466 PolarHBondContact O-N 2.97Å; L463-S466 VanDerWaalsContact O-N 3.16Å; L463-S466 PolarHBondContact O-OG 3.25Å; L463-I467 WeakPolarHBondContact O-CD1 3.46Å; L463-I467 VanDerWaalsContact O-CG1 3.24Å; L463-I467 WeakPolarHBondContact O-CG1 3.14Å; L463-I467 PolarHBondContact O-N 3.31Å
464	L	89	Confident	87.1	Confident	4 Å²	4	54 Å²	54	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-29	179	-73.6	169.6	0	0	0	113.4	A31 A32 C35 F36 I281 F284 Q285 F460 R461 N462	A31-L464 HydrophobicContact CB-CD2 3.81Å; A32-L464 HydrophobicContact CB-CB 4.02Å; C35-L464 HydrophobicContact CB-CD1 4.33Å; F36-L464 HydrophobicContact CE2-CD1 4Å; I281-L464 HydrophobicContact CG2-CD2 3.47Å; I281-L464 VanDerWaalsContact CG2-CD2 3.47Å; I281-L464 HydrophobicContact CG2-CG 4.36Å; F284-L464 HydrophobicContact CD1-CD1 4.45Å; F284-L464 HydrophobicContact CE1-CD1 4.36Å; Q285-L464 HydrophobicContact CG-CD2 3.98Å; F460-L464 VanDerWaalsContact O-CB 3.31Å; F460-L464 WeakPolarHBondContact O-CB 3.46Å; F460-L464 WeakPolarHBondContact O-CG 3.31Å; F460-L464 PolarHBondContact O-N 3.13Å; R461-L464 PolarHBondContact O-N 2.99Å; N462-L464 VanDerWaalsContact C-N 3.35Å; N462-L464 PolarHBondContact O-N 2.87Å
465	Q	82.7	Confident	86.4	Confident	118 Å²	118	57.9 Å²	57.9	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-74.3	-32.7	172.7	-71.5	173.6	3.8	0	0	112.4	A32 R461 N462 L463 I467	A32-Q465 HydrophobicContact CB-CG 3.98Å; R461-Q465 WeakPolarHBondContact O-CG 3.43Å; R461-Q465 PolarHBondContact O-N 3.05Å; R461-Q465 VanDerWaalsContact O-N 3.15Å; N462-Q465 PolarHBondContact O-N 3.01Å; L463-Q465 VanDerWaalsContact C-N 3.3Å; L463-Q465 PolarHBondContact O-N 2.86Å; Q465-I467 VanDerWaalsContact C-N 3.27Å; Q465-I467 PolarHBondContact O-N 3.27Å
466	S	71.8	Confident	85.5	Confident	84 Å²	84	59.4 Å²	59.4	59%	0.587	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-8	-178.6	70.4	0	0	0	0	115.1	N462 L463 H468	N462-S466 PolarHBondContact O-N 3.25Å; N462-S466 VanDerWaalsContact O-N 3.09Å; L463-S466 PolarHBondContact O-N 2.97Å; L463-S466 VanDerWaalsContact O-N 3.16Å; L463-S466 PolarHBondContact O-OG 3.25Å; S466-H468 VanDerWaalsContact C-N 3.3Å; S466-H468 PolarHBondContact O-N 3.04Å
467	I	63.1	Low	84.4	Confident	97 Å²	97	62.7 Å²	62.7	50%	0.497	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	22.2	-176.7	-61.8	158.5	0	0	0	111.1	I281 L463 Q465	I281-I467 HydrophobicContact CD1-CD1 3.47Å; I281-I467 VanDerWaalsContact CD1-CD1 3.47Å; I281-I467 HydrophobicContact CG1-CD1 4.26Å; I281-I467 HydrophobicContact CG2-CD1 4.17Å; L463-I467 WeakPolarHBondContact O-CD1 3.46Å; L463-I467 VanDerWaalsContact O-CG1 3.24Å; L463-I467 WeakPolarHBondContact O-CG1 3.14Å; L463-I467 PolarHBondContact O-N 3.31Å; Q465-I467 VanDerWaalsContact C-N 3.27Å; Q465-I467 PolarHBondContact O-N 3.27Å
468	H	44	Very low	83.3	Confident	186 Å²	186	68.4 Å²	68.4	86%	0.861	35%	0.347	S	S	*	.			trans	-112.7	0	176.2	-79.3	9.5	0	0	0	112	T30 S466	T30-H468 WeakPolarHBondContact CB-NE2 3.43Å; T30-H468 VanDerWaalsContact CG2-NE2 3.31Å; T30-H468 WeakPolarHBondContact CG2-NE2 3.33Å; S466-H468 VanDerWaalsContact C-N 3.3Å; S466-H468 PolarHBondContact O-N 3.04Å

Retrieved 468 of 468 residues in 511.5 ms (Link to these results)

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