A0A5K4F964_SCHMA Loading...

Coiled-coil domain-containing protein 150

AlphaFold DB , UniProt , Accession A0A5K4F964, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 553 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	37	Very low	39.9	Very low	200 Å²	200	113.8 Å²	113.8	99%	0.985	58%	0.584	S	S	*	*				0	110.1	0	-144.4	175.1	-168.1	0	0	106.3
2	N	39.1	Very low	39.8	Very low	112 Å²	112	114.5 Å²	114.5	60%	0.599	58%	0.58	S	S	*	*			trans	-70.7	129	-161.4	-105.1	-22.8	0	0	0	111.6	C4 E5 Q6	N2-C4 PolarHBondContact O-N 3.05Å; N2-E5 HydrophobicContact CB-CB 4.46Å; N2-E5 HydrophobicContact CB-CG 4.37Å; N2-E5 PolarHBondContact O-N 3.08Å; N2-Q6 PolarHBondContact O-N 3.15Å
3	L	34.6	Very low	40	Very low	154 Å²	154	108 Å²	108	81%	0.806	56%	0.559	S	S	*	*	H	α-helix	trans	-49.4	-31.9	171.4	-101.6	117.6	0	0	0	111.9	A7	L3-A7 WeakPolarHBondContact O-CB 3.44Å; L3-A7 PolarHBondContact O-N 2.85Å
4	C	35.7	Very low	40	Very low	102 Å²	102	102.4 Å²	102.4	69%	0.689	54%	0.54	S	S	*	.	H	α-helix	trans	-67.9	-37	174.3	-76	0	0	0	0	114.4	N2 S8	N2-C4 PolarHBondContact O-N 3.05Å; C4-S8 WeakPolarHBondContact O-CB 3.29Å; C4-S8 PolarHBondContact O-N 3.45Å
5	E	39.4	Very low	39.9	Very low	98 Å²	98	99.6 Å²	99.6	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-72.1	-37.4	177	-81.4	-170.8	119.2	0	0	111.6	N2 S8 R9	N2-E5 HydrophobicContact CB-CB 4.46Å; N2-E5 HydrophobicContact CB-CG 4.37Å; N2-E5 PolarHBondContact O-N 3.08Å; E5-S8 PolarHBondContact O-N 3.21Å; E5-R9 WeakPolarHBondContact O-CB 3.47Å; E5-R9 WeakPolarHBondContact O-CG 3.4Å; E5-R9 PolarHBondContact O-N 3.45Å; E5-R9 IonicContact OE1-NH2 2.69Å
6	Q	44.9	Very low	39.7	Very low	121 Å²	121	101.1 Å²	101.1	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-72.7	-37.9	177.1	-160	162.3	8.6	0	0	111.2	N2 N10	N2-Q6 PolarHBondContact O-N 3.15Å; Q6-N10 VanDerWaalsContact O-CB 3.28Å; Q6-N10 WeakPolarHBondContact O-CB 3.45Å; Q6-N10 PolarHBondContact O-N 2.82Å; Q6-N10 PolarHBondContact O-ND2 3.2Å
7	A	38.6	Very low	39.8	Very low	45 Å²	45	105.2 Å²	105.2	37%	0.372	54%	0.544	S	S	.	.	H	α-helix	trans	-64.4	-39.7	170.9	0	0	0	0	0	112.2	L3 N10 Y11	L3-A7 WeakPolarHBondContact O-CB 3.44Å; L3-A7 PolarHBondContact O-N 2.85Å; A7-N10 PolarHBondContact O-N 3.41Å; A7-Y11 WeakPolarHBondContact O-CB 3.47Å; A7-Y11 PolarHBondContact O-N 3Å
8	S	39.3	Very low	39.8	Very low	51 Å²	51	105.8 Å²	105.8	36%	0.357	55%	0.547	S	S	.	.	H	α-helix	trans	-64.9	-46.7	174.8	176.1	0	0	0	0	112	C4 E5 N10 Y11 F12	C4-S8 WeakPolarHBondContact O-CB 3.29Å; C4-S8 PolarHBondContact O-N 3.45Å; E5-S8 PolarHBondContact O-N 3.21Å; S8-N10 VanDerWaalsContact C-N 3.34Å; S8-N10 PolarHBondContact O-N 2.66Å; S8-Y11 WeakPolarHBondContact O-CB 3.41Å; S8-Y11 PolarHBondContact O-N 2.81Å; S8-F12 WeakPolarHBondContact O-CD2 3.13Å; S8-F12 PolarHBondContact O-N 3.49Å; S8-F12 WeakPolarHBondContact OG-CD2 3.44Å; S8-F12 WeakPolarHBondContact OG-CE2 3.37Å
9	R	46.4	Very low	39.6	Very low	148 Å²	148	104.9 Å²	104.9	56%	0.558	55%	0.551	S	S	*	*	H	α-helix	trans	-65	-37.2	176	-73.7	-179	-152.3	164.7	9	112.5	E5 G13	E5-R9 WeakPolarHBondContact O-CB 3.47Å; E5-R9 WeakPolarHBondContact O-CG 3.4Å; E5-R9 PolarHBondContact O-N 3.45Å; E5-R9 IonicContact OE1-NH2 2.69Å; R9-G13 WeakPolarHBondContact O-CA 3.49Å; R9-G13 PolarHBondContact O-N 3.23Å
10	N	46.4	Very low	39.6	Very low	115 Å²	115	107.7 Å²	107.7	62%	0.615	56%	0.561	S	S	*	*	H	α-helix	trans	-69.1	-36.2	174	-71.1	-14.6	0	0	0	111.8	Q6 A7 S8 G14	Q6-N10 VanDerWaalsContact O-CB 3.28Å; Q6-N10 WeakPolarHBondContact O-CB 3.45Å; Q6-N10 PolarHBondContact O-N 2.82Å; Q6-N10 PolarHBondContact O-ND2 3.2Å; A7-N10 PolarHBondContact O-N 3.41Å; S8-N10 VanDerWaalsContact C-N 3.34Å; S8-N10 PolarHBondContact O-N 2.66Å; N10-G14 PolarHBondContact O-N 3.48Å
11	Y	37.3	Very low	39.4	Very low	106 Å²	106	104.8 Å²	104.8	42%	0.416	56%	0.558	S	S	.	*	H	α-helix	trans	-62.2	-55.4	173.3	176.1	-98.2	0	0	0	111.1	A7 S8 G13 G14 V15 F29	A7-Y11 WeakPolarHBondContact O-CB 3.47Å; A7-Y11 PolarHBondContact O-N 3Å; S8-Y11 WeakPolarHBondContact O-CB 3.41Å; S8-Y11 PolarHBondContact O-N 2.81Å; Y11-G13 PolarHBondContact O-N 2.93Å; Y11-G14 PolarHBondContact O-N 2.93Å; Y11-V15 HydrophobicContact CE2-CG2 4.47Å; Y11-V15 WeakPolarHBondContact O-CB 3.33Å; Y11-V15 VanDerWaalsContact O-CG2 3.22Å; Y11-V15 WeakPolarHBondContact O-CG2 3.44Å; Y11-V15 PolarHBondContact O-N 2.96Å; Y11-F29 HydrophobicContact CD2-CE1 4.11Å; Y11-F29 AromaticContact CD2-CE2 3.94Å; Y11-F29 HydrophobicContact CD2-CE2 3.94Å; Y11-F29 AromaticContact CD2-CZ 3.43Å; Y11-F29 HydrophobicContact CD2-CZ 3.43Å; Y11-F29 VanDerWaalsContact CD2-CZ 3.43Å; Y11-F29 AromaticContact CE2-CE1 3.8Å; Y11-F29 HydrophobicContact CE2-CE1 3.8Å; Y11-F29 HydrophobicContact CE2-CE2 4.14Å; Y11-F29 AromaticContact CE2-CZ 3.58Å; Y11-F29 HydrophobicContact CE2-CZ 3.58Å
12	F	39.6	Very low	39.2	Very low	122 Å²	122	101 Å²	101	54%	0.535	55%	0.55	S	S	.	*	H	α-helix	trans	-69.2	-33.9	-179.4	-72.5	-66.3	0	0	0	112.7	S8 Q16	S8-F12 WeakPolarHBondContact O-CD2 3.13Å; S8-F12 PolarHBondContact O-N 3.49Å; S8-F12 WeakPolarHBondContact OG-CD2 3.44Å; S8-F12 WeakPolarHBondContact OG-CE2 3.37Å; F12-Q16 WeakPolarHBondContact O-CB 3.41Å; F12-Q16 PolarHBondContact O-N 3.47Å
13	G	41.8	Very low	39	Very low	30 Å²	30	101.6 Å²	101.6	31%	0.309	55%	0.554	S	S	.	*	H	α-helix	trans	-70.3	-32.8	174	0	0	0	0	0	113.7	R9 Y11 K17	R9-G13 WeakPolarHBondContact O-CA 3.49Å; R9-G13 PolarHBondContact O-N 3.23Å; Y11-G13 PolarHBondContact O-N 2.93Å; G13-K17 WeakPolarHBondContact O-CG 3.37Å; G13-K17 PolarHBondContact O-N 2.95Å
14	G	39.6	Very low	39.3	Very low	29 Å²	29	102.3 Å²	102.3	30%	0.299	56%	0.558	S	S	.	*	H	α-helix	trans	-74.4	-41.8	174.1	0	0	0	0	0	112.8	N10 Y11 K17 I18	N10-G14 PolarHBondContact O-N 3.48Å; Y11-G14 PolarHBondContact O-N 2.93Å; G14-K17 PolarHBondContact O-N 2.89Å; G14-I18 WeakPolarHBondContact O-CG1 3.32Å; G14-I18 PolarHBondContact O-N 3.31Å; G14-I18 VanDerWaalsContact O-N 3.09Å
15	V	39.6	Very low	39.4	Very low	61 Å²	61	104.9 Å²	104.9	37%	0.37	56%	0.56	S	S	.	*	H	α-helix	trans	-65.5	-38	175.8	173.1	0	0	0	0	111.3	Y11 K17 I18 S19	Y11-V15 HydrophobicContact CE2-CG2 4.47Å; Y11-V15 WeakPolarHBondContact O-CB 3.33Å; Y11-V15 VanDerWaalsContact O-CG2 3.22Å; Y11-V15 WeakPolarHBondContact O-CG2 3.44Å; Y11-V15 PolarHBondContact O-N 2.96Å; V15-K17 PolarHBondContact O-N 3.36Å; V15-I18 PolarHBondContact O-N 2.91Å; V15-S19 PolarHBondContact O-N 3.35Å; V15-S19 PolarHBondContact O-OG 3.39Å
16	Q	35.6	Very low	39.7	Very low	123 Å²	123	103.4 Å²	103.4	58%	0.575	56%	0.559	S	S	*	*	H	α-helix	trans	-63.1	-39.4	172.8	-94.3	-179.2	-22.2	0	0	112.8	F12 S19 Q20	F12-Q16 WeakPolarHBondContact O-CB 3.41Å; F12-Q16 PolarHBondContact O-N 3.47Å; Q16-S19 WeakPolarHBondContact CA-OG 3.41Å; Q16-S19 PolarHBondContact O-N 2.79Å; Q16-S19 PolarHBondContact O-OG 3.32Å; Q16-Q20 WeakPolarHBondContact O-CG 3.46Å; Q16-Q20 PolarHBondContact O-N 2.97Å
17	K	41.9	Very low	39.6	Very low	172 Å²	172	98.6 Å²	98.6	75%	0.748	54%	0.542	S	S	*	.	H	α-helix	trans	-67.9	-34.2	176.7	-78.5	-177.9	176.6	-174.5	0	113.4	G13 G14 V15	G13-K17 WeakPolarHBondContact O-CG 3.37Å; G13-K17 PolarHBondContact O-N 2.95Å; G14-K17 PolarHBondContact O-N 2.89Å; V15-K17 PolarHBondContact O-N 3.36Å
18	I	39.7	Very low	39.9	Very low	115 Å²	115	100.1 Å²	100.1	59%	0.59	55%	0.547	S	S	*	.	H	α-helix	trans	-73.4	-32.4	176.5	-63.3	163.2	0	0	0	110.9	G14 V15 Q20	G14-I18 WeakPolarHBondContact O-CG1 3.32Å; G14-I18 PolarHBondContact O-N 3.31Å; G14-I18 VanDerWaalsContact O-N 3.09Å; V15-I18 PolarHBondContact O-N 2.91Å; I18-Q20 VanDerWaalsContact C-N 3.28Å; I18-Q20 PolarHBondContact O-N 2.87Å
19	S	37.1	Very low	40.2	Very low	90 Å²	90	100.8 Å²	100.8	63%	0.629	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-9.9	177.3	67.8	0	0	0	0	114.9	V15 Q16	V15-S19 PolarHBondContact O-N 3.35Å; V15-S19 PolarHBondContact O-OG 3.39Å; Q16-S19 WeakPolarHBondContact CA-OG 3.41Å; Q16-S19 PolarHBondContact O-N 2.79Å; Q16-S19 PolarHBondContact O-OG 3.32Å
20	Q	38.8	Very low	40.2	Very low	160 Å²	160	97.7 Å²	97.7	75%	0.748	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	4.2	-175.4	-72.7	-175.7	-9.2	0	0	114.1	Q16 I18	Q16-Q20 WeakPolarHBondContact O-CG 3.46Å; Q16-Q20 PolarHBondContact O-N 2.97Å; I18-Q20 VanDerWaalsContact C-N 3.28Å; I18-Q20 PolarHBondContact O-N 2.87Å
21	G	34.5	Very low	40.1	Very low	47 Å²	47	96 Å²	96	49%	0.485	52%	0.524	S	S	.	.			trans	-107.4	120.8	174.5	0	0	0	0	0	111.6	N23	G21-N23 PolarHBondContact O-N 3.25Å
22	S	33.2	Very low	40.7	Very low	119 Å²	119	98 Å²	98	83%	0.832	53%	0.531	S	S	*	.			trans	-69.9	35.4	175.2	57.3	0	0	0	0	114.4
23	N	34.7	Very low	41.2	Very low	125 Å²	125	94.1 Å²	94.1	67%	0.668	52%	0.517	S	S	*	.			trans	-108.4	124.7	-176.5	-73.4	-3	0	0	0	111	G21 E25	G21-N23 PolarHBondContact O-N 3.25Å; N23-E25 PolarHBondContact O-N 3.25Å
24	N	40.9	Very low	42.1	Very low	170 Å²	170	100.4 Å²	100.4	91%	0.909	54%	0.536	S	S	*	.			trans	-62.9	29.7	-175.8	-77	-27.4	0	0	0	116
25	E	38.8	Very low	42.8	Very low	155 Å²	155	103.5 Å²	103.5	72%	0.724	55%	0.545	S	S	*	.			trans	-96.7	137.6	-171.7	-69.6	-177.6	172.7	0	0	112.5	N23 G27	N23-E25 PolarHBondContact O-N 3.25Å; E25-G27 PolarHBondContact O-N 3.11Å
26	P	45.4	Very low	43.7	Very low	68 Å²	68	105.9 Å²	105.9	44%	0.442	56%	0.556	S	S	.	*			trans	-60.7	119.6	173.8	24.1	-31.5	0	0	0	109.8	V28	P26-V28 PolarHBondContact O-N 3.06Å
27	G	42.6	Very low	44.3	Very low	20 Å²	20	100.8 Å²	100.8	21%	0.206	54%	0.536	C	S	.	.			trans	-77.4	109.8	177.8	0	0	0	0	0	110.2	E25 T56	E25-G27 PolarHBondContact O-N 3.11Å; G27-T56 PolarHBondContact N-OG1 3.12Å; G27-T56 VanDerWaalsContact N-OG1 3.15Å; G27-T56 PolarHBondContact O-N 2.73Å; G27-T56 PolarHBondContact O-OG1 3.46Å
28	V	44.8	Very low	44.9	Very low	77 Å²	77	96 Å²	96	47%	0.467	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	110.1	166.8	-175.1	0	0	0	0	108	P26 I30 V53	P26-V28 PolarHBondContact O-N 3.06Å; V28-I30 HydrophobicContact CG1-CD1 4.22Å; V28-I30 HydrophobicContact CG1-CG1 3.83Å; V28-V53 HydrophobicContact CG1-CG1 3.66Å
29	F	45.7	Very low	45.1	Very low	65 Å²	65	92.9 Å²	92.9	29%	0.285	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	123	172.2	-180	-99.9	0	0	0	109.3	Y11 F31 V53 C54	Y11-F29 HydrophobicContact CD2-CE1 4.11Å; Y11-F29 AromaticContact CD2-CE2 3.94Å; Y11-F29 HydrophobicContact CD2-CE2 3.94Å; Y11-F29 AromaticContact CD2-CZ 3.43Å; Y11-F29 HydrophobicContact CD2-CZ 3.43Å; Y11-F29 VanDerWaalsContact CD2-CZ 3.43Å; Y11-F29 AromaticContact CE2-CE1 3.8Å; Y11-F29 HydrophobicContact CE2-CE1 3.8Å; Y11-F29 HydrophobicContact CE2-CE2 4.14Å; Y11-F29 AromaticContact CE2-CZ 3.58Å; Y11-F29 HydrophobicContact CE2-CZ 3.58Å; F29-F31 HydrophobicContact CD1-CB 4.42Å; F29-F31 HydrophobicContact CE1-CB 3.59Å; F29-F31 HydrophobicContact CE1-CG 4.49Å; F29-F31 HydrophobicContact CZ-CB 4.04Å; F29-F31 HydrophobicContact CZ-CD2 4.43Å; F29-V53 CarbonylContact O-C 3.56Å; F29-V53 VanDerWaalsContact O-CA 3.28Å; F29-V53 WeakPolarHBondContact O-CA 3.34Å; F29-C54 HydrophobicContact CB-CB 4.13Å; F29-C54 WeakPolarHBondContact CB-O 3.38Å; F29-C54 HydrophobicContact CD1-CB 4.15Å; F29-C54 PolarHBondContact N-O 3.25Å; F29-C54 PolarHBondContact O-N 3.05Å
30	I	46.3	Very low	45.7	Very low	82 Å²	82	97.2 Å²	97.2	42%	0.421	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	108.5	-179.8	-54.8	179.4	0	0	0	108.4	V28 R32 T51 V53	V28-I30 HydrophobicContact CG1-CD1 4.22Å; V28-I30 HydrophobicContact CG1-CG1 3.83Å; I30-R32 HydrophobicContact CG2-CG 4Å; I30-T51 HydrophobicContact CG2-CG2 3.61Å; I30-V53 HydrophobicContact CG1-CG2 4.49Å
31	F	43.7	Very low	46.2	Very low	81 Å²	81	97 Å²	97	36%	0.355	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	116.6	171.9	-179.7	-100.7	0	0	0	110	F29 V33 T51 I52	F29-F31 HydrophobicContact CD1-CB 4.42Å; F29-F31 HydrophobicContact CE1-CB 3.59Å; F29-F31 HydrophobicContact CE1-CG 4.49Å; F29-F31 HydrophobicContact CZ-CB 4.04Å; F29-F31 HydrophobicContact CZ-CD2 4.43Å; F31-V33 HydrophobicContact CD1-CG2 3.85Å; F31-V33 HydrophobicContact CE1-CG2 3.18Å; F31-V33 HydrophobicContact CZ-CG2 3.86Å; F31-T51 CarbonylContact O-C 3.55Å; F31-T51 WeakPolarHBondContact O-CA 3.4Å; F31-I52 HydrophobicContact CB-CB 4.15Å; F31-I52 HydrophobicContact CD1-CB 4.27Å; F31-I52 HydrophobicContact CD1-CD1 3.78Å; F31-I52 HydrophobicContact CD1-CG1 4.14Å; F31-I52 HydrophobicContact CE1-CD1 4.26Å; F31-I52 PolarHBondContact N-O 3.11Å; F31-I52 PolarHBondContact O-N 2.95Å
32	R	50.2	Low	46.7	Very low	146 Å²	146	99.2 Å²	99.2	55%	0.551	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	114	179.9	-75.8	167.1	-175.9	178	9.5	109.8	I30 K49 L50 T51	I30-R32 HydrophobicContact CG2-CG 4Å; R32-K49 VanDerWaalsContact CD-CE 3.45Å; R32-L50 CarbonylContact C-O 3.6Å; R32-L50 VanDerWaalsContact CA-O 3.31Å; R32-L50 WeakPolarHBondContact CA-O 3.41Å; R32-T51 HydrophobicContact CG-CG2 3.89Å
33	V	51.1	Low	47.3	Very low	41 Å²	41	106 Å²	106	25%	0.248	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.6	165.5	-171.7	0	0	0	0	107.9	F31 L35 K49 L50	F31-V33 HydrophobicContact CD1-CG2 3.85Å; F31-V33 HydrophobicContact CE1-CG2 3.18Å; F31-V33 HydrophobicContact CZ-CG2 3.86Å; V33-L35 HydrophobicContact CG1-CD2 3.78Å; V33-L35 HydrophobicContact CG1-CG 4.03Å; V33-K49 CarbonylContact O-C 3.48Å; V33-K49 VanDerWaalsContact O-CA 3.31Å; V33-K49 WeakPolarHBondContact O-CA 3.41Å; V33-L50 HydrophobicContact CB-CB 4.14Å; V33-L50 HydrophobicContact CG2-CD2 4.3Å; V33-L50 PolarHBondContact N-O 3.46Å; V33-L50 PolarHBondContact O-N 3.38Å
34	K	59.4	Low	47.7	Very low	162 Å²	162	109.3 Å²	109.3	70%	0.704	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	114	167.3	-67.5	-179.6	-179.4	177.9	0	107.5	S48	K34-S48 CarbonylContact C-O 3.51Å; K34-S48 WeakPolarHBondContact CA-O 3.36Å
35	L	54.7	Low	48.1	Very low	95 Å²	95	105.8 Å²	105.8	50%	0.497	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	113.3	172.4	-59.4	171.1	0	0	0	107.1	V33 R47 S48	V33-L35 HydrophobicContact CG1-CD2 3.78Å; V33-L35 HydrophobicContact CG1-CG 4.03Å; L35-R47 CarbonylContact O-C 3.58Å; L35-R47 WeakPolarHBondContact O-CA 3.43Å; L35-S48 PolarHBondContact N-O 3.33Å; L35-S48 PolarHBondContact O-N 2.94Å
36	N	58.8	Low	48.7	Very low	111 Å²	111	104 Å²	104	59%	0.594	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	115	168.7	-64.1	-23.8	0	0	0	106.8	F46 R47	N36-F46 WeakPolarHBondContact CA-O 3.4Å; N36-R47 WeakPolarHBondContact OD1-CG 3.45Å
37	G	49.2	Very low	48.9	Very low	15 Å²	15	110.3 Å²	110.3	16%	0.155	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	141.7	166.2	0	0	0	0	0	109.7	T45 F46	G37-T45 CarbonylContact O-C 3.6Å; G37-T45 VanDerWaalsContact O-CA 3.32Å; G37-T45 WeakPolarHBondContact O-CA 3.38Å; G37-F46 VanDerWaalsContact CA-CZ 3.48Å; G37-F46 PolarHBondContact N-O 2.88Å; G37-F46 WeakPolarHBondContact O-CD1 3.29Å; G37-F46 PolarHBondContact O-N 2.92Å
38	A	52.6	Low	49.2	Very low	72 Å²	72	112.1 Å²	112.1	60%	0.595	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	130.6	164.8	0	0	0	0	0	106.5	L40 T45	A38-L40 PolarHBondContact O-N 2.96Å; A38-T45 HydrophobicContact CB-CG2 4.23Å
39	S	45	Very low	49.3	Very low	50 Å²	50	113.9 Å²	113.9	35%	0.35	55%	0.546	S	S	.	.			trans	-67.5	125.3	162.8	171.3	0	0	0	0	107.3	N41 E42	S39-N41 PolarHBondContact O-N 3.35Å; S39-N41 PolarHBondContact OG-N 3.25Å; S39-E42 PolarHBondContact O-N 3.15Å; S39-E42 PolarHBondContact OG-N 3.09Å
40	L	48.6	Very low	49.6	Very low	181 Å²	181	115.1 Å²	115.1	95%	0.948	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-17.8	175.3	-91	145.9	0	0	0	112.5	A38	A38-L40 PolarHBondContact O-N 2.96Å
41	N	50.2	Low	49.6	Very low	155 Å²	155	113.7 Å²	113.7	83%	0.829	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-7.9	-175.5	-67.4	-17.6	0	0	0	114.2	S39	S39-N41 PolarHBondContact O-N 3.35Å; S39-N41 PolarHBondContact OG-N 3.25Å
42	E	45.7	Very low	49.8	Very low	94 Å²	94	113.7 Å²	113.7	44%	0.439	55%	0.553	S	S	.	*	S	Bend	trans	-132.5	131.7	178.1	-65.2	-178.8	176.6	0	0	109.7	S39 R44	S39-E42 PolarHBondContact O-N 3.15Å; S39-E42 PolarHBondContact OG-N 3.09Å; E42-R44 HydrophobicContact CB-CB 4.38Å; E42-R44 PolarHBondContact O-N 2.7Å
43	R	45.6	Very low	49.6	Very low	261 Å²	261	108.5 Å²	108.5	99%	0.985	54%	0.537	S	S	*	.	S	Bend	trans	-58.7	3.2	173	-73.5	-176.4	177.1	-178.4	-0.1	114
44	R	43.3	Very low	49.6	Very low	194 Å²	194	109.8 Å²	109.8	73%	0.732	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-82.9	116.8	178.2	-70.4	-177.2	174.9	-171.2	-2.4	109.8	E42	E42-R44 HydrophobicContact CB-CB 4.38Å; E42-R44 PolarHBondContact O-N 2.7Å
45	T	49.4	Very low	49.3	Very low	97 Å²	97	103.2 Å²	103.2	60%	0.595	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.1	169.1	56.3	0	0	0	0	108.1	G37 A38	G37-T45 CarbonylContact O-C 3.6Å; G37-T45 VanDerWaalsContact O-CA 3.32Å; G37-T45 WeakPolarHBondContact O-CA 3.38Å; A38-T45 HydrophobicContact CB-CG2 4.23Å
46	F	51	Low	49.2	Very low	117 Å²	117	101.2 Å²	101.2	51%	0.513	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.6	167.2	63.5	-93.7	0	0	0	109.3	N36 G37	N36-F46 WeakPolarHBondContact CA-O 3.4Å; G37-F46 VanDerWaalsContact CA-CZ 3.48Å; G37-F46 PolarHBondContact N-O 2.88Å; G37-F46 WeakPolarHBondContact O-CD1 3.29Å; G37-F46 PolarHBondContact O-N 2.92Å
47	R	50	Low	48.8	Very low	201 Å²	201	98.2 Å²	98.2	76%	0.758	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	103.8	174.8	-67.2	-167.4	172.1	165.6	-1.1	108.6	L35 N36	L35-R47 CarbonylContact O-C 3.58Å; L35-R47 WeakPolarHBondContact O-CA 3.43Å; N36-R47 WeakPolarHBondContact OD1-CG 3.45Å
48	S	48.7	Very low	48.8	Very low	58 Å²	58	99.3 Å²	99.3	41%	0.406	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	140.6	171.5	-52.8	0	0	0	0	109.5	K34 L35	K34-S48 CarbonylContact C-O 3.51Å; K34-S48 WeakPolarHBondContact CA-O 3.36Å; L35-S48 PolarHBondContact N-O 3.33Å; L35-S48 PolarHBondContact O-N 2.94Å
49	K	47.4	Very low	48.7	Very low	114 Å²	114	104.3 Å²	104.3	50%	0.496	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	105.3	178.2	-175.5	-174.1	173.8	-170.5	0	109.4	R32 V33	R32-K49 VanDerWaalsContact CD-CE 3.45Å; V33-K49 CarbonylContact O-C 3.48Å; V33-K49 VanDerWaalsContact O-CA 3.31Å; V33-K49 WeakPolarHBondContact O-CA 3.41Å
50	L	51.3	Low	48.9	Very low	91 Å²	91	108 Å²	108	48%	0.476	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	125.9	168.6	171.5	67.8	0	0	0	108.3	R32 V33 I52	R32-L50 CarbonylContact C-O 3.6Å; R32-L50 VanDerWaalsContact CA-O 3.31Å; R32-L50 WeakPolarHBondContact CA-O 3.41Å; V33-L50 HydrophobicContact CB-CB 4.14Å; V33-L50 HydrophobicContact CG2-CD2 4.3Å; V33-L50 PolarHBondContact N-O 3.46Å; V33-L50 PolarHBondContact O-N 3.38Å; L50-I52 HydrophobicContact CD2-CD1 4.44Å; L50-I52 HydrophobicContact CD2-CG1 4.39Å; L50-I52 HydrophobicContact CG-CG1 4.25Å
51	T	45.9	Very low	49	Very low	51 Å²	51	101.5 Å²	101.5	31%	0.313	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	111.1	175.1	-54	0	0	0	0	108.5	I30 F31 R32 V53	I30-T51 HydrophobicContact CG2-CG2 3.61Å; F31-T51 CarbonylContact O-C 3.55Å; F31-T51 WeakPolarHBondContact O-CA 3.4Å; R32-T51 HydrophobicContact CG-CG2 3.89Å; T51-V53 HydrophobicContact CG2-CG2 3.97Å
52	I	48.8	Very low	48.8	Very low	82 Å²	82	97.2 Å²	97.2	42%	0.421	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	119.7	170.3	-54.2	179.1	0	0	0	106.6	F31 L50	F31-I52 HydrophobicContact CB-CB 4.15Å; F31-I52 HydrophobicContact CD1-CB 4.27Å; F31-I52 HydrophobicContact CD1-CD1 3.78Å; F31-I52 HydrophobicContact CD1-CG1 4.14Å; F31-I52 HydrophobicContact CE1-CD1 4.26Å; F31-I52 PolarHBondContact N-O 3.11Å; F31-I52 PolarHBondContact O-N 2.95Å; L50-I52 HydrophobicContact CD2-CD1 4.44Å; L50-I52 HydrophobicContact CD2-CG1 4.39Å; L50-I52 HydrophobicContact CG-CG1 4.25Å
53	V	46.2	Very low	48.9	Very low	36 Å²	36	96.4 Å²	96.4	22%	0.218	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.4	173.1	-174.2	0	0	0	0	108.5	V28 F29 I30 T51 L80	V28-V53 HydrophobicContact CG1-CG1 3.66Å; F29-V53 CarbonylContact O-C 3.56Å; F29-V53 VanDerWaalsContact O-CA 3.28Å; F29-V53 WeakPolarHBondContact O-CA 3.34Å; I30-V53 HydrophobicContact CG1-CG2 4.49Å; T51-V53 HydrophobicContact CG2-CG2 3.97Å; V53-L80 HydrophobicContact CB-CD1 4.17Å; V53-L80 HydrophobicContact CG1-CD1 3.77Å; V53-L80 HydrophobicContact CG1-CG 4.36Å; V53-L80 HydrophobicContact CG2-CD1 4.09Å
54	C	50.2	Low	48.9	Very low	68 Å²	68	90.8 Å²	90.8	46%	0.459	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	116.8	173.1	-179.2	0	0	0	0	108.4	F29	F29-C54 HydrophobicContact CB-CB 4.13Å; F29-C54 WeakPolarHBondContact CB-O 3.38Å; F29-C54 HydrophobicContact CD1-CB 4.15Å; F29-C54 PolarHBondContact N-O 3.25Å; F29-C54 PolarHBondContact O-N 3.05Å
55	C	52.2	Low	49	Very low	24 Å²	24	85.2 Å²	85.2	16%	0.162	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	140.5	178.5	-65.1	0	0	0	0	110.3	N84	C55-N84 WeakPolarHBondContact CB-ND2 3.42Å; C55-N84 PolarHBondContact SG-ND2 2.7Å
56	T	52.4	Low	48.6	Very low	53 Å²	53	87.9 Å²	87.9	33%	0.325	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-65.8	140.1	168.3	54.9	0	0	0	0	110.5	G27	G27-T56 PolarHBondContact N-OG1 3.12Å; G27-T56 VanDerWaalsContact N-OG1 3.15Å; G27-T56 PolarHBondContact O-N 2.73Å; G27-T56 PolarHBondContact O-OG1 3.46Å
57	G	51.2	Low	48.1	Very low	48 Å²	48	88.3 Å²	88.3	50%	0.495	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-48	156.9	-160.5	0	0	0	0	0	119.3	E59 K60	G57-E59 PolarHBondContact O-N 3.41Å; G57-K60 PolarHBondContact O-N 2.92Å
58	F	48.4	Very low	47.3	Very low	39 Å²	39	87.6 Å²	87.6	17%	0.171	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-50.8	-31.8	-172.4	-171.6	-96.8	0	0	0	114.6	K60 I61 Y62 I103 L106 L107	F58-K60 PolarHBondContact O-N 3.15Å; F58-K60 VanDerWaalsContact O-N 3.1Å; F58-I61 PolarHBondContact O-N 3.35Å; F58-Y62 AromaticContact CE1-CD2 3.68Å; F58-Y62 HydrophobicContact CE1-CD2 3.68Å; F58-Y62 HydrophobicContact CE1-CG 4.26Å; F58-Y62 HydrophobicContact CZ-CD2 4.12Å; F58-Y62 PolarHBondContact O-N 3.18Å; F58-I103 HydrophobicContact CD1-CD1 4.49Å; F58-I103 HydrophobicContact CD1-CG2 3.83Å; F58-I103 HydrophobicContact CE1-CB 4.4Å; F58-I103 HydrophobicContact CE1-CD1 4.44Å; F58-I103 HydrophobicContact CE1-CG1 4.16Å; F58-I103 HydrophobicContact CE1-CG2 3.6Å; F58-I103 HydrophobicContact CZ-CG2 4.37Å; F58-L106 HydrophobicContact CZ-CD2 4.36Å; F58-L107 HydrophobicContact CE2-CD2 4.44Å
59	E	51.1	Low	46.7	Very low	176 Å²	176	88.6 Å²	88.6	82%	0.822	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-55.4	-28	177	-62.5	175.9	-171.6	0	0	113.3	G57	G57-E59 PolarHBondContact O-N 3.41Å
60	K	50.1	Low	46.2	Very low	129 Å²	129	91.8 Å²	91.8	56%	0.561	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-89.3	-14.3	178.3	-63.4	-172.5	176.6	-171.6	0	113.9	G57 F58 F64	G57-K60 PolarHBondContact O-N 2.92Å; F58-K60 PolarHBondContact O-N 3.15Å; F58-K60 VanDerWaalsContact O-N 3.1Å; K60-F64 WeakPolarHBondContact O-CD2 3.43Å
61	I	49.2	Very low	45.4	Very low	43 Å²	43	93 Å²	93	22%	0.221	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-30	-176.1	-59.2	171	0	0	0	110.5	F58 F64 M65	F58-I61 PolarHBondContact O-N 3.35Å; I61-F64 PolarHBondContact O-N 3.34Å; I61-M65 HydrophobicContact CG2-CE 3.72Å; I61-M65 HydrophobicContact CG2-CG 4.1Å; I61-M65 HydrophobicContact CG2-SD 4.15Å; I61-M65 PolarHBondContact O-N 3.08Å
62	Y	46.2	Very low	44.6	Very low	65 Å²	65	92.8 Å²	92.8	26%	0.255	48%	0.483	S	S	.	.	H	α-helix	trans	-49.6	-42.4	179.4	-176.1	-111.6	0	0	0	114.9	F58 F64 M65 K66	F58-Y62 AromaticContact CE1-CD2 3.68Å; F58-Y62 HydrophobicContact CE1-CD2 3.68Å; F58-Y62 HydrophobicContact CE1-CG 4.26Å; F58-Y62 HydrophobicContact CZ-CD2 4.12Å; F58-Y62 PolarHBondContact O-N 3.18Å; Y62-F64 PolarHBondContact O-N 2.74Å; Y62-M65 PolarHBondContact O-N 2.92Å; Y62-K66 PolarHBondContact O-N 3.44Å
63	P	48.3	Very low	44	Very low	77 Å²	77	96.9 Å²	96.9	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-26.5	178	-19.5	32.8	0	0	0	113.7
64	F	45	Very low	43.5	Very low	144 Å²	144	101.7 Å²	101.7	63%	0.632	53%	0.526	S	S	*	.	H	α-helix	trans	-88.7	-17.6	-178	-63	-82.1	0	0	0	113.2	K60 I61 Y62	K60-F64 WeakPolarHBondContact O-CD2 3.43Å; I61-F64 PolarHBondContact O-N 3.34Å; Y62-F64 PolarHBondContact O-N 2.74Å
65	M	45.7	Very low	43	Very low	76 Å²	76	104 Å²	104	37%	0.374	54%	0.538	S	S	.	.	H	α-helix	trans	-89.6	-12.2	175.4	-72.1	-169	171.3	0	0	113.5	I61 Y62 N67	I61-M65 HydrophobicContact CG2-CE 3.72Å; I61-M65 HydrophobicContact CG2-CG 4.1Å; I61-M65 HydrophobicContact CG2-SD 4.15Å; I61-M65 PolarHBondContact O-N 3.08Å; Y62-M65 PolarHBondContact O-N 2.92Å; M65-N67 VanDerWaalsContact C-N 3.27Å; M65-N67 PolarHBondContact O-N 3.15Å
66	K	41.4	Very low	42.4	Very low	154 Å²	154	107 Å²	107	67%	0.67	56%	0.559	S	S	*	*	S	Bend	trans	-74.3	-18.6	-179.1	-152.3	174.6	-174.5	176.9	0	113.1	Y62	Y62-K66 PolarHBondContact O-N 3.44Å
67	N	40.6	Very low	41.9	Very low	126 Å²	126	109.8 Å²	109.8	67%	0.674	57%	0.572	S	S	*	*	S	Bend	trans	-109.3	106.2	176.4	-64.7	-14.7	0	0	0	108.7	M65	M65-N67 VanDerWaalsContact C-N 3.27Å; M65-N67 PolarHBondContact O-N 3.15Å
68	E	33.1	Very low	41.4	Very low	186 Å²	186	109.2 Å²	109.2	87%	0.869	56%	0.557	S	S	*	*			trans	36.6	88	156.1	-63.7	179.1	170	0	0	117
69	V	37	Very low	41.1	Very low	78 Å²	78	111.8 Å²	111.8	47%	0.473	57%	0.572	S	S	.	*			trans	-97.1	87.7	153.4	-174.6	0	0	0	0	107.2	F71	V69-F71 HydrophobicContact CB-CE2 4.38Å; V69-F71 HydrophobicContact CG1-CD1 4.3Å; V69-F71 HydrophobicContact CG1-CD2 4.26Å; V69-F71 HydrophobicContact CG1-CE1 4.14Å; V69-F71 HydrophobicContact CG1-CE2 4.14Å; V69-F71 HydrophobicContact CG1-CG 4.35Å; V69-F71 HydrophobicContact CG1-CZ 4.08Å; V69-F71 WeakPolarHBondContact O-CD2 3.3Å; V69-F71 PolarHBondContact O-N 3.46Å; V69-F71 VanDerWaalsContact O-N 3.07Å
70	E	35.1	Very low	40.7	Very low	182 Å²	182	106.4 Å²	106.4	85%	0.85	55%	0.549	S	S	*	.			trans	-58	108.8	157	-76	-171.3	155.3	0	0	107.3	G72	E70-G72 PolarHBondContact O-N 2.95Å
71	F	34.7	Very low	40.5	Very low	115 Å²	115	101.5 Å²	101.5	50%	0.504	53%	0.531	S	S	.	.			trans	-73.1	72.6	177.4	-81.2	-80.2	0	0	0	110.4	V69 N73 N78 F110	V69-F71 HydrophobicContact CB-CE2 4.38Å; V69-F71 HydrophobicContact CG1-CD1 4.3Å; V69-F71 HydrophobicContact CG1-CD2 4.26Å; V69-F71 HydrophobicContact CG1-CE1 4.14Å; V69-F71 HydrophobicContact CG1-CE2 4.14Å; V69-F71 HydrophobicContact CG1-CG 4.35Å; V69-F71 HydrophobicContact CG1-CZ 4.08Å; V69-F71 WeakPolarHBondContact O-CD2 3.3Å; V69-F71 PolarHBondContact O-N 3.46Å; V69-F71 VanDerWaalsContact O-N 3.07Å; F71-N73 PolarHBondContact O-N 2.95Å; F71-N78 WeakPolarHBondContact CE1-OD1 3.48Å; F71-F110 AromaticContact CZ-CE2 3.94Å; F71-F110 HydrophobicContact CZ-CE2 3.94Å; F71-F110 HydrophobicContact CZ-CZ 4.18Å
72	G	30.3	Very low	40.1	Very low	48 Å²	48	102.5 Å²	102.5	50%	0.495	54%	0.536	S	S	.	.			trans	-75.1	115.9	162.6	0	0	0	0	0	109.6	E70 H74	E70-G72 PolarHBondContact O-N 2.95Å; G72-H74 PolarHBondContact O-CD2 2.94Å; G72-H74 VanDerWaalsContact O-CD2 3.24Å; G72-H74 PolarHBondContact O-N 3.28Å
73	N	35.1	Very low	40.1	Very low	167 Å²	167	106.2 Å²	106.2	89%	0.893	55%	0.551	S	S	*	*	S	Bend	trans	28.2	10.6	157.6	-79	-8.9	0	0	0	122.7	F71 T75	F71-N73 PolarHBondContact O-N 2.95Å; N73-T75 PolarHBondContact O-N 3.04Å
74	H	36.4	Very low	40.1	Very low	137 Å²	137	104.6 Å²	104.6	63%	0.634	54%	0.538	S	S	*	.			trans	-103.7	92.4	-172.1	-69.1	-59.4	0	0	0	110.8	G72 S76 L77	G72-H74 PolarHBondContact O-CD2 2.94Å; G72-H74 VanDerWaalsContact O-CD2 3.24Å; G72-H74 PolarHBondContact O-N 3.28Å; H74-S76 PolarHBondContact O-N 2.97Å; H74-L77 PolarHBondContact O-N 2.98Å
75	T	40.7	Very low	40	Very low	117 Å²	117	98.8 Å²	98.8	72%	0.718	51%	0.513	S	S	*	.	H	α-helix	trans	-48.8	-16.8	173.1	28.1	0	0	0	0	115.4	N73	N73-T75 PolarHBondContact O-N 3.04Å
76	S	38.8	Very low	39.9	Very low	86 Å²	86	97.9 Å²	97.9	60%	0.601	52%	0.515	S	S	*	.	H	α-helix	trans	-81	-22.7	-172.6	44.1	0	0	0	0	115.6	H74	H74-S76 PolarHBondContact O-N 2.97Å
77	L	40.9	Very low	40	Very low	113 Å²	113	97.6 Å²	97.6	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-88.9	-26.4	-179.8	-85.5	152.7	0	0	0	112.9	H74 S81	H74-L77 PolarHBondContact O-N 2.98Å; L77-S81 PolarHBondContact O-OG 3.13Å
78	N	41.7	Very low	40.1	Very low	35 Å²	35	96.5 Å²	96.5	19%	0.187	50%	0.504	C	S	.	.	H	α-helix	trans	-70.2	-33.9	-179.4	-70.8	-15	0	0	0	112.9	F71 S81 L82 L114 I117	F71-N78 WeakPolarHBondContact CE1-OD1 3.48Å; N78-S81 PolarHBondContact O-N 2.94Å; N78-L82 WeakPolarHBondContact O-CB 3.47Å; N78-L82 PolarHBondContact O-N 3.47Å; N78-L114 HydrophobicContact CB-CD2 3.98Å; N78-I117 HydrophobicContact CB-CD1 4.12Å
79	L	41.5	Very low	40.5	Very low	93 Å²	93	93.9 Å²	93.9	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-68.1	-37.3	-177.6	-116.2	142.9	0	0	0	113.2	Y83	L79-Y83 HydrophobicContact CD2-CD2 4.02Å; L79-Y83 HydrophobicContact CD2-CE2 3.97Å; L79-Y83 WeakPolarHBondContact O-CB 3.48Å; L79-Y83 PolarHBondContact O-N 3.1Å; L79-Y83 VanDerWaalsContact O-N 3.1Å
80	L	43.6	Very low	40.6	Very low	64 Å²	64	94.4 Å²	94.4	34%	0.335	51%	0.508	S	S	.	.	H	α-helix	trans	-67.5	-40.4	179.1	-139.4	76.9	0	0	0	111.1	V53 N84	V53-L80 HydrophobicContact CB-CD1 4.17Å; V53-L80 HydrophobicContact CG1-CD1 3.77Å; V53-L80 HydrophobicContact CG1-CG 4.36Å; V53-L80 HydrophobicContact CG2-CD1 4.09Å; L80-N84 WeakPolarHBondContact O-CB 3.48Å; L80-N84 PolarHBondContact O-N 3.49Å; L80-N84 VanDerWaalsContact O-N 3.13Å; L80-N84 PolarHBondContact O-ND2 3.29Å
81	S	45.5	Very low	40.6	Very low	26 Å²	26	89.3 Å²	89.3	18%	0.182	49%	0.493	C	S	.	.	H	α-helix	trans	-72.7	-37.3	-180	-55.8	0	0	0	0	112.1	L77 N78 L85	L77-S81 PolarHBondContact O-OG 3.13Å; N78-S81 PolarHBondContact O-N 2.94Å; S81-L85 VanDerWaalsContact O-CB 3.26Å; S81-L85 WeakPolarHBondContact O-CB 3.39Å; S81-L85 PolarHBondContact O-N 3.38Å
82	L	41.5	Very low	40.5	Very low	64 Å²	64	87 Å²	87	34%	0.335	50%	0.502	S	S	.	.	H	α-helix	trans	-64.9	-42.5	174.8	-143.9	155.5	0	0	0	111.9	N78 S86 L114	N78-L82 WeakPolarHBondContact O-CB 3.47Å; N78-L82 PolarHBondContact O-N 3.47Å; L82-S86 PolarHBondContact O-N 2.97Å; L82-S86 VanDerWaalsContact O-N 3.08Å; L82-S86 PolarHBondContact O-OG 2.96Å; L82-L114 HydrophobicContact CB-CD1 3.66Å; L82-L114 HydrophobicContact CD1-CB 3.63Å; L82-L114 HydrophobicContact CD1-CD1 3.84Å; L82-L114 HydrophobicContact CD1-CD2 3.96Å; L82-L114 HydrophobicContact CD1-CG 3.98Å; L82-L114 HydrophobicContact CG-CB 3.95Å; L82-L114 HydrophobicContact CG-CD1 3.49Å; L82-L114 VanDerWaalsContact CG-CD1 3.49Å; L82-L114 HydrophobicContact CG-CG 4.17Å
83	Y	46.3	Very low	40.6	Very low	142 Å²	142	95.9 Å²	95.9	56%	0.557	52%	0.52	S	S	*	.	H	α-helix	trans	-67.8	-44.6	178.3	-103.8	-91.3	0	0	0	112.4	L79 L85 S86 F87	L79-Y83 HydrophobicContact CD2-CD2 4.02Å; L79-Y83 HydrophobicContact CD2-CE2 3.97Å; L79-Y83 WeakPolarHBondContact O-CB 3.48Å; L79-Y83 PolarHBondContact O-N 3.1Å; L79-Y83 VanDerWaalsContact O-N 3.1Å; Y83-L85 VanDerWaalsContact C-N 3.27Å; Y83-L85 PolarHBondContact O-N 3.43Å; Y83-S86 PolarHBondContact O-N 3.19Å; Y83-S86 PolarHBondContact O-OG 3.39Å; Y83-F87 PolarHBondContact O-N 2.91Å; Y83-F87 VanDerWaalsContact O-N 3.1Å
84	N	46.7	Very low	40.4	Very low	44 Å²	44	94.5 Å²	94.5	24%	0.235	52%	0.52	C	S	.	.	H	α-helix	trans	-65.3	-32.2	179.2	-76.7	-36.5	0	0	0	112.8	C55 L80 Q88	C55-N84 WeakPolarHBondContact CB-ND2 3.42Å; C55-N84 PolarHBondContact SG-ND2 2.7Å; L80-N84 WeakPolarHBondContact O-CB 3.48Å; L80-N84 PolarHBondContact O-N 3.49Å; L80-N84 VanDerWaalsContact O-N 3.13Å; L80-N84 PolarHBondContact O-ND2 3.29Å; N84-Q88 PolarHBondContact O-N 2.97Å
85	L	43.9	Very low	40	Very low	21 Å²	21	90.9 Å²	90.9	11%	0.11	52%	0.521	C	S	.	.	H	α-helix	trans	-75.8	-39.6	178.9	-173.3	140	0	0	0	112.4	S81 Y83 F87 Q88 L89 L107 T111	S81-L85 VanDerWaalsContact O-CB 3.26Å; S81-L85 WeakPolarHBondContact O-CB 3.39Å; S81-L85 PolarHBondContact O-N 3.38Å; Y83-L85 VanDerWaalsContact C-N 3.27Å; Y83-L85 PolarHBondContact O-N 3.43Å; L85-F87 VanDerWaalsContact C-N 3.25Å; L85-F87 PolarHBondContact O-N 3.28Å; L85-Q88 PolarHBondContact O-N 3.5Å; L85-L89 HydrophobicContact CD2-CD1 3.63Å; L85-L89 HydrophobicContact CG-CD1 4.44Å; L85-L89 WeakPolarHBondContact O-CG 3.49Å; L85-L89 PolarHBondContact O-N 3.18Å; L85-L89 VanDerWaalsContact O-N 3.07Å; L85-L107 HydrophobicContact CD1-CB 4.15Å; L85-L107 HydrophobicContact CD1-CD2 3.46Å; L85-L107 VanDerWaalsContact CD1-CD2 3.46Å; L85-L107 HydrophobicContact CD1-CG 4.42Å; L85-L107 HydrophobicContact CG-CD2 4.33Å; L85-T111 HydrophobicContact CD1-CG2 3.41Å; L85-T111 VanDerWaalsContact CD1-CG2 3.41Å; L85-T111 HydrophobicContact CD2-CG2 3.17Å; L85-T111 HydrophobicContact CG-CG2 3.85Å
86	S	43.4	Very low	39.5	Very low	58 Å²	58	91.1 Å²	91.1	41%	0.406	52%	0.516	S	S	.	.	H	α-helix	trans	-63.4	-32.3	171.9	64.9	0	0	0	0	112.5	L82 Y83 A90	L82-S86 PolarHBondContact O-N 2.97Å; L82-S86 VanDerWaalsContact O-N 3.08Å; L82-S86 PolarHBondContact O-OG 2.96Å; Y83-S86 PolarHBondContact O-N 3.19Å; Y83-S86 PolarHBondContact O-OG 3.39Å; S86-A90 WeakPolarHBondContact O-CB 3.34Å; S86-A90 PolarHBondContact O-N 2.9Å
87	F	43.1	Very low	39.4	Very low	147 Å²	147	95.1 Å²	95.1	65%	0.645	53%	0.525	S	S	*	.	H	α-helix	trans	-68.8	-41	174.8	-164.8	-97.7	0	0	0	112.1	Y83 L85 S91	Y83-F87 PolarHBondContact O-N 2.91Å; Y83-F87 VanDerWaalsContact O-N 3.1Å; L85-F87 VanDerWaalsContact C-N 3.25Å; L85-F87 PolarHBondContact O-N 3.28Å; F87-S91 VanDerWaalsContact O-CB 3.25Å; F87-S91 WeakPolarHBondContact O-CB 3.31Å; F87-S91 PolarHBondContact O-N 3Å; F87-S91 VanDerWaalsContact O-N 3.17Å; F87-S91 PolarHBondContact O-OG 3.35Å
88	Q	43.7	Very low	39.4	Very low	104 Å²	104	97.6 Å²	97.6	49%	0.486	54%	0.539	S	S	.	.	H	α-helix	trans	-71.2	-33.8	177.1	-77.2	-171.8	-13.5	0	0	113.6	N84 L85	N84-Q88 PolarHBondContact O-N 2.97Å; L85-Q88 PolarHBondContact O-N 3.5Å
89	L	40.2	Very low	39.6	Very low	130 Å²	130	99.3 Å²	99.3	68%	0.681	55%	0.552	S	S	*	*	H	α-helix	trans	-75.7	-28.8	176.3	-69.7	172.1	0	0	0	113	L85	L85-L89 HydrophobicContact CD2-CD1 3.63Å; L85-L89 HydrophobicContact CG-CD1 4.44Å; L85-L89 WeakPolarHBondContact O-CG 3.49Å; L85-L89 PolarHBondContact O-N 3.18Å; L85-L89 VanDerWaalsContact O-N 3.07Å
90	A	38.8	Very low	40	Very low	90 Å²	90	100.3 Å²	100.3	74%	0.744	55%	0.554	S	S	*	*	H	α-helix	trans	-91.8	-12.3	-178.6	0	0	0	0	0	114.7	S86	S86-A90 WeakPolarHBondContact O-CB 3.34Å; S86-A90 PolarHBondContact O-N 2.9Å
91	S	37.1	Very low	40.5	Very low	74 Å²	74	102.4 Å²	102.4	52%	0.517	57%	0.571	S	S	.	*	S	Bend	trans	-105	15.5	-174.6	58.1	0	0	0	0	115.5	F87 R93	F87-S91 VanDerWaalsContact O-CB 3.25Å; F87-S91 WeakPolarHBondContact O-CB 3.31Å; F87-S91 PolarHBondContact O-N 3Å; F87-S91 VanDerWaalsContact O-N 3.17Å; F87-S91 PolarHBondContact O-OG 3.35Å; S91-R93 PolarHBondContact O-N 2.93Å
92	G	32.5	Very low	40.9	Very low	68 Å²	68	107.2 Å²	107.2	70%	0.701	59%	0.591	S	S	*	*			trans	-78.5	108.2	177.5	0	0	0	0	0	114.6
93	R	32.4	Very low	41.4	Very low	233 Å²	233	105.6 Å²	105.6	88%	0.879	58%	0.582	S	S	*	*			trans	-75.1	142.8	143.8	-83.6	-176.3	179.2	-177.9	0.3	108.2	S91 G95	S91-R93 PolarHBondContact O-N 2.93Å; R93-G95 PolarHBondContact O-N 3.3Å
94	P	29.2	Very low	41.7	Very low	138 Å²	138	105.1 Å²	105.1	90%	0.896	58%	0.58	S	S	*	*	S	Bend	trans	-68.5	122	-178.6	28.5	-32	0	0	0	110
95	G	29.4	Very low	42	Very low	62 Å²	62	106 Å²	106	64%	0.639	59%	0.59	S	S	*	*			trans	125.9	127.6	168.9	0	0	0	0	0	114.3	R93	R93-G95 PolarHBondContact O-N 3.3Å
96	I	29.5	Very low	42.5	Very low	121 Å²	121	108.9 Å²	108.9	62%	0.621	61%	0.605	S	S	*	*	S	Bend	trans	85.1	73.4	164.1	-45.4	159.5	0	0	0	114.8
97	H	36.5	Very low	43	Very low	170 Å²	170	107.7 Å²	107.7	79%	0.787	59%	0.594	S	S	*	*				162.4	116.6	121.4	-86.7	-66.4	0	0	0	108.1	P99	H97-P99 WeakPolarHBondContact O-CD 3.44Å
98	N	40.9	Very low	43.5	Very low	166 Å²	166	104.8 Å²	104.8	89%	0.888	59%	0.585	S	S	*	*			trans	-61	114	168.8	-79.1	-14.7	0	0	0	107.4	E100	N98-E100 PolarHBondContact O-N 3.2Å
99	P	46.8	Very low	44.1	Very low	70 Å²	70	109.1 Å²	109.1	46%	0.455	60%	0.597	S	S	.	*			trans	-59.3	138.4	164.9	26.5	-30.8	0	0	0	107.5	H97 Y104	H97-P99 WeakPolarHBondContact O-CD 3.44Å; P99-Y104 HydrophobicContact CG-CD2 3.99Å; P99-Y104 HydrophobicContact CG-CG 4.47Å
100	E	49.7	Very low	44.6	Very low	115 Å²	115	105 Å²	105	54%	0.537	57%	0.573	S	S	.	*			trans	-50.1	137	173.4	-80.1	-178.9	156.2	0	0	109.3	N98 E102 I103 Y104	N98-E100 PolarHBondContact O-N 3.2Å; E100-E102 PolarHBondContact O-N 3.46Å; E100-I103 HydrophobicContact CB-CB 4.42Å; E100-I103 HydrophobicContact CB-CD1 4.05Å; E100-I103 HydrophobicContact CB-CG1 4.09Å; E100-I103 WeakPolarHBondContact O-CA 3.45Å; E100-I103 WeakPolarHBondContact O-CB 3.28Å; E100-I103 PolarHBondContact O-N 3.09Å; E100-Y104 PolarHBondContact O-N 2.87Å
101	P	53.2	Low	45.3	Very low	107 Å²	107	102.5 Å²	102.5	70%	0.695	55%	0.549	S	S	*	.	H	α-helix	trans	-53.5	-31.2	-176.9	-24.8	31.7	0	0	0	113.3	S105	P101-S105 VanDerWaalsContact O-CB 3.29Å; P101-S105 WeakPolarHBondContact O-CB 3.48Å; P101-S105 PolarHBondContact O-N 2.94Å; P101-S105 PolarHBondContact O-OG 3.29Å
102	E	53.5	Low	45.9	Very low	128 Å²	128	101.4 Å²	101.4	60%	0.598	55%	0.545	S	S	*	.	H	α-helix	trans	-68.2	-42.7	176.3	-65.2	179.1	178.7	0	0	112	E100 S105 L106	E100-E102 PolarHBondContact O-N 3.46Å; E102-S105 WeakPolarHBondContact CA-OG 3.47Å; E102-S105 PolarHBondContact O-OG 2.93Å; E102-L106 VanDerWaalsContact O-CB 3.27Å; E102-L106 WeakPolarHBondContact O-CB 3.46Å; E102-L106 PolarHBondContact O-N 3.06Å
103	I	52.6	Low	46.9	Very low	30 Å²	30	103.8 Å²	103.8	15%	0.154	54%	0.538	C	S	.	.	H	α-helix	trans	-67.5	-43.2	176.4	-62.6	176.8	0	0	0	110	F58 E100 L106 L107	F58-I103 HydrophobicContact CD1-CD1 4.49Å; F58-I103 HydrophobicContact CD1-CG2 3.83Å; F58-I103 HydrophobicContact CE1-CB 4.4Å; F58-I103 HydrophobicContact CE1-CD1 4.44Å; F58-I103 HydrophobicContact CE1-CG1 4.16Å; F58-I103 HydrophobicContact CE1-CG2 3.6Å; F58-I103 HydrophobicContact CZ-CG2 4.37Å; E100-I103 HydrophobicContact CB-CB 4.42Å; E100-I103 HydrophobicContact CB-CD1 4.05Å; E100-I103 HydrophobicContact CB-CG1 4.09Å; E100-I103 WeakPolarHBondContact O-CA 3.45Å; E100-I103 WeakPolarHBondContact O-CB 3.28Å; E100-I103 PolarHBondContact O-N 3.09Å; I103-L106 PolarHBondContact O-N 3.42Å; I103-L107 HydrophobicContact CG2-CD1 3.72Å; I103-L107 HydrophobicContact CG2-CG 4.41Å; I103-L107 VanDerWaalsContact O-CB 3.31Å; I103-L107 WeakPolarHBondContact O-CB 3.38Å; I103-L107 WeakPolarHBondContact O-CD1 3.47Å; I103-L107 WeakPolarHBondContact O-CG 3.38Å; I103-L107 PolarHBondContact O-N 2.87Å
104	Y	52.3	Low	47.6	Very low	131 Å²	131	93.3 Å²	93.3	51%	0.514	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-42.2	178.2	-171.7	-104.1	0	0	0	112.7	P99 E100 L107 L108	P99-Y104 HydrophobicContact CG-CD2 3.99Å; P99-Y104 HydrophobicContact CG-CG 4.47Å; E100-Y104 PolarHBondContact O-N 2.87Å; Y104-L107 PolarHBondContact O-N 3.48Å; Y104-L108 HydrophobicContact CD1-CD1 3.67Å; Y104-L108 HydrophobicContact CE1-CD1 3.29Å; Y104-L108 HydrophobicContact CE1-CG 4.26Å; Y104-L108 WeakPolarHBondContact O-CB 3.44Å; Y104-L108 PolarHBondContact O-N 3.29Å
105	S	54	Low	48.5	Very low	63 Å²	63	92 Å²	92	44%	0.441	49%	0.489	S	S	.	.	H	α-helix	trans	-70.9	-36.9	178	59.6	0	0	0	0	113.1	P101 E102 L108 R109	P101-S105 VanDerWaalsContact O-CB 3.29Å; P101-S105 WeakPolarHBondContact O-CB 3.48Å; P101-S105 PolarHBondContact O-N 2.94Å; P101-S105 PolarHBondContact O-OG 3.29Å; E102-S105 WeakPolarHBondContact CA-OG 3.47Å; E102-S105 PolarHBondContact O-OG 2.93Å; S105-L108 PolarHBondContact O-N 2.89Å; S105-R109 PolarHBondContact O-N 3.15Å
106	L	53.7	Low	49.3	Very low	82 Å²	82	95.5 Å²	95.5	43%	0.429	49%	0.493	S	S	.	.	H	α-helix	trans	-65.2	-44.8	173.4	-165.1	77.2	0	0	0	110.8	F58 E102 I103 L108 R109 F110	F58-L106 HydrophobicContact CZ-CD2 4.36Å; E102-L106 VanDerWaalsContact O-CB 3.27Å; E102-L106 WeakPolarHBondContact O-CB 3.46Å; E102-L106 PolarHBondContact O-N 3.06Å; I103-L106 PolarHBondContact O-N 3.42Å; L106-L108 PolarHBondContact O-N 3.1Å; L106-R109 PolarHBondContact O-N 3.25Å; L106-F110 WeakPolarHBondContact O-CB 3.41Å; L106-F110 PolarHBondContact O-N 3.31Å
107	L	54.6	Low	50.1	Low	32 Å²	32	93.1 Å²	93.1	17%	0.168	48%	0.48	C	S	.	.	H	α-helix	trans	-58.6	-46.1	174.3	-76	162.5	0	0	0	111.1	F58 L85 I103 Y104 F110 T111	F58-L107 HydrophobicContact CE2-CD2 4.44Å; L85-L107 HydrophobicContact CD1-CB 4.15Å; L85-L107 HydrophobicContact CD1-CD2 3.46Å; L85-L107 VanDerWaalsContact CD1-CD2 3.46Å; L85-L107 HydrophobicContact CD1-CG 4.42Å; L85-L107 HydrophobicContact CG-CD2 4.33Å; I103-L107 HydrophobicContact CG2-CD1 3.72Å; I103-L107 HydrophobicContact CG2-CG 4.41Å; I103-L107 VanDerWaalsContact O-CB 3.31Å; I103-L107 WeakPolarHBondContact O-CB 3.38Å; I103-L107 WeakPolarHBondContact O-CD1 3.47Å; I103-L107 WeakPolarHBondContact O-CG 3.38Å; I103-L107 PolarHBondContact O-N 2.87Å; Y104-L107 PolarHBondContact O-N 3.48Å; L107-F110 CarbonylContact O-C 3.57Å; L107-F110 WeakPolarHBondContact O-CB 3.15Å; L107-F110 PolarHBondContact O-N 3.4Å; L107-T111 WeakPolarHBondContact O-CG2 3.25Å; L107-T111 PolarHBondContact O-N 2.88Å
108	L	52.5	Low	50.3	Low	87 Å²	87	91.1 Å²	91.1	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-61.4	-45.6	176.8	-87.3	166.1	0	0	0	112.9	Y104 S105 L106 F110 T111 A112	Y104-L108 HydrophobicContact CD1-CD1 3.67Å; Y104-L108 HydrophobicContact CE1-CD1 3.29Å; Y104-L108 HydrophobicContact CE1-CG 4.26Å; Y104-L108 WeakPolarHBondContact O-CB 3.44Å; Y104-L108 PolarHBondContact O-N 3.29Å; S105-L108 PolarHBondContact O-N 2.89Å; L106-L108 PolarHBondContact O-N 3.1Å; L108-F110 VanDerWaalsContact C-N 3.29Å; L108-F110 PolarHBondContact O-N 3.48Å; L108-T111 WeakPolarHBondContact CA-OG1 3.39Å; L108-T111 PolarHBondContact O-N 3.18Å; L108-T111 PolarHBondContact O-OG1 3.39Å; L108-A112 PolarHBondContact O-N 2.87Å
109	R	56.2	Low	50.3	Low	194 Å²	194	89.3 Å²	89.3	73%	0.732	47%	0.471	S	S	*	.	H	α-helix	trans	-59.6	-42.6	174	-97.7	-177.5	172.9	163.8	-1.3	111.7	S105 L106 A112 Q113	S105-R109 PolarHBondContact O-N 3.15Å; L106-R109 PolarHBondContact O-N 3.25Å; R109-A112 PolarHBondContact O-N 3.1Å; R109-Q113 WeakPolarHBondContact O-CG 3.43Å; R109-Q113 PolarHBondContact O-N 3.44Å
110	F	52.3	Low	49.7	Very low	44 Å²	44	90.2 Å²	90.2	19%	0.193	48%	0.479	C	S	.	.	H	α-helix	trans	-63.8	-43.5	177.6	-148.6	-93.8	0	0	0	110.7	F71 L106 L107 L108 A112 Q113 L114	F71-F110 AromaticContact CZ-CE2 3.94Å; F71-F110 HydrophobicContact CZ-CE2 3.94Å; F71-F110 HydrophobicContact CZ-CZ 4.18Å; L106-F110 WeakPolarHBondContact O-CB 3.41Å; L106-F110 PolarHBondContact O-N 3.31Å; L107-F110 CarbonylContact O-C 3.57Å; L107-F110 WeakPolarHBondContact O-CB 3.15Å; L107-F110 PolarHBondContact O-N 3.4Å; L108-F110 VanDerWaalsContact C-N 3.29Å; L108-F110 PolarHBondContact O-N 3.48Å; F110-A112 VanDerWaalsContact C-N 3.34Å; F110-A112 PolarHBondContact O-N 3.18Å; F110-Q113 PolarHBondContact O-N 2.97Å; F110-L114 HydrophobicContact CD1-CD1 3.62Å; F110-L114 HydrophobicContact CD1-CG 4.16Å; F110-L114 HydrophobicContact CE1-CD1 3.73Å; F110-L114 HydrophobicContact CE1-CD2 4.28Å; F110-L114 HydrophobicContact CE1-CG 4.21Å; F110-L114 VanDerWaalsContact O-CG 3.25Å; F110-L114 WeakPolarHBondContact O-CG 3.41Å; F110-L114 PolarHBondContact O-N 3.39Å; F110-L114 VanDerWaalsContact O-N 3.11Å
111	T	51.8	Low	49.1	Very low	37 Å²	37	89.9 Å²	89.9	23%	0.227	49%	0.486	C	S	.	.	H	α-helix	trans	-58.7	-43.6	175	64	0	0	0	0	113.1	L85 L107 L108 Q113 L114 T115	L85-T111 HydrophobicContact CD1-CG2 3.41Å; L85-T111 VanDerWaalsContact CD1-CG2 3.41Å; L85-T111 HydrophobicContact CD2-CG2 3.17Å; L85-T111 HydrophobicContact CG-CG2 3.85Å; L107-T111 WeakPolarHBondContact O-CG2 3.25Å; L107-T111 PolarHBondContact O-N 2.88Å; L108-T111 WeakPolarHBondContact CA-OG1 3.39Å; L108-T111 PolarHBondContact O-N 3.18Å; L108-T111 PolarHBondContact O-OG1 3.39Å; T111-Q113 VanDerWaalsContact C-N 3.3Å; T111-Q113 PolarHBondContact O-N 2.93Å; T111-L114 PolarHBondContact O-N 3.38Å; T111-L114 VanDerWaalsContact O-N 3.13Å; T111-T115 PolarHBondContact O-N 3.35Å; T111-T115 PolarHBondContact O-OG1 2.97Å; T111-T115 VanDerWaalsContact O-OG1 3.09Å
112	A	51.4	Low	48.5	Very low	52 Å²	52	90.4 Å²	90.4	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-35.4	-177.8	0	0	0	0	0	111.9	L108 R109 F110 T115	L108-A112 PolarHBondContact O-N 2.87Å; R109-A112 PolarHBondContact O-N 3.1Å; F110-A112 VanDerWaalsContact C-N 3.34Å; F110-A112 PolarHBondContact O-N 3.18Å; A112-T115 VanDerWaalsContact C-OG1 3.3Å; A112-T115 VanDerWaalsContact CA-OG1 3.31Å; A112-T115 WeakPolarHBondContact CA-OG1 3.46Å; A112-T115 PolarHBondContact O-OG1 2.91Å
113	Q	51.7	Low	47.8	Very low	118 Å²	118	89.5 Å²	89.5	55%	0.551	48%	0.484	S	S	*	.	H	α-helix	trans	-70.7	-33.7	174.5	-71.2	176.8	-24.2	0	0	112	R109 F110 T111 N116	R109-Q113 WeakPolarHBondContact O-CG 3.43Å; R109-Q113 PolarHBondContact O-N 3.44Å; F110-Q113 PolarHBondContact O-N 2.97Å; T111-Q113 VanDerWaalsContact C-N 3.3Å; T111-Q113 PolarHBondContact O-N 2.93Å; Q113-N116 PolarHBondContact O-N 3.35Å
114	L	47.6	Very low	47.5	Very low	12 Å²	12	95.5 Å²	95.5	6%	0.063	52%	0.517	C	S	.	.	H	α-helix	trans	-77.1	-29	178.9	-65.9	179	0	0	0	113.2	N78 L82 F110 T111 N116 I117	N78-L114 HydrophobicContact CB-CD2 3.98Å; L82-L114 HydrophobicContact CB-CD1 3.66Å; L82-L114 HydrophobicContact CD1-CB 3.63Å; L82-L114 HydrophobicContact CD1-CD1 3.84Å; L82-L114 HydrophobicContact CD1-CD2 3.96Å; L82-L114 HydrophobicContact CD1-CG 3.98Å; L82-L114 HydrophobicContact CG-CB 3.95Å; L82-L114 HydrophobicContact CG-CD1 3.49Å; L82-L114 VanDerWaalsContact CG-CD1 3.49Å; L82-L114 HydrophobicContact CG-CG 4.17Å; F110-L114 HydrophobicContact CD1-CD1 3.62Å; F110-L114 HydrophobicContact CD1-CG 4.16Å; F110-L114 HydrophobicContact CE1-CD1 3.73Å; F110-L114 HydrophobicContact CE1-CD2 4.28Å; F110-L114 HydrophobicContact CE1-CG 4.21Å; F110-L114 VanDerWaalsContact O-CG 3.25Å; F110-L114 WeakPolarHBondContact O-CG 3.41Å; F110-L114 PolarHBondContact O-N 3.39Å; F110-L114 VanDerWaalsContact O-N 3.11Å; T111-L114 PolarHBondContact O-N 3.38Å; T111-L114 VanDerWaalsContact O-N 3.13Å; L114-N116 PolarHBondContact O-N 3.39Å; L114-I117 HydrophobicContact CD2-CD1 3.6Å; L114-I117 WeakPolarHBondContact O-CB 3.48Å; L114-I117 PolarHBondContact O-N 3.42Å
115	T	48	Very low	47.2	Very low	112 Å²	112	93.6 Å²	93.6	69%	0.687	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.1	172.3	27	0	0	0	0	113.6	T111 A112 I117	T111-T115 PolarHBondContact O-N 3.35Å; T111-T115 PolarHBondContact O-OG1 2.97Å; T111-T115 VanDerWaalsContact O-OG1 3.09Å; A112-T115 VanDerWaalsContact C-OG1 3.3Å; A112-T115 VanDerWaalsContact CA-OG1 3.31Å; A112-T115 WeakPolarHBondContact CA-OG1 3.46Å; A112-T115 PolarHBondContact O-OG1 2.91Å; T115-I117 VanDerWaalsContact C-N 3.3Å
116	N	47.6	Very low	46.8	Very low	135 Å²	135	98 Å²	98	72%	0.722	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-7.3	174.7	-67.5	-18.6	0	0	0	113.1	Q113 L114 T118	Q113-N116 PolarHBondContact O-N 3.35Å; L114-N116 PolarHBondContact O-N 3.39Å; N116-T118 PolarHBondContact O-N 3.49Å
117	I	46	Very low	46.3	Very low	70 Å²	70	97.9 Å²	97.9	36%	0.359	53%	0.534	S	S	.	.			trans	-85.5	95.9	176.7	-55.1	-178.5	0	0	0	108.2	N78 L114 T115 N119	N78-I117 HydrophobicContact CB-CD1 4.12Å; L114-I117 HydrophobicContact CD2-CD1 3.6Å; L114-I117 WeakPolarHBondContact O-CB 3.48Å; L114-I117 PolarHBondContact O-N 3.42Å; T115-I117 VanDerWaalsContact C-N 3.3Å; I117-N119 PolarHBondContact O-N 3.14Å; I117-N119 VanDerWaalsContact O-N 3.15Å
118	T	40.4	Very low	45.8	Very low	128 Å²	128	97.7 Å²	97.7	79%	0.785	54%	0.537	S	S	*	.			trans	-69.1	108.4	167.1	51.7	0	0	0	0	108.5	N116 S120	N116-T118 PolarHBondContact O-N 3.49Å; T118-S120 PolarHBondContact O-N 3.28Å
119	N	41	Very low	45.7	Very low	129 Å²	129	98.2 Å²	98.2	69%	0.69	54%	0.54	S	S	*	.			trans	-59.3	108.1	167.7	-73.9	-39	0	0	0	107.9	I117 P121	I117-N119 PolarHBondContact O-N 3.14Å; I117-N119 VanDerWaalsContact O-N 3.15Å; N119-P121 WeakPolarHBondContact O-CD 3.35Å
120	S	34	Very low	45.8	Very low	89 Å²	89	94 Å²	94	62%	0.622	53%	0.531	S	S	*	.			trans	-61.8	124.8	164.6	50.8	0	0	0	0	107	T118 V122	T118-S120 PolarHBondContact O-N 3.28Å; S120-V122 PolarHBondContact O-N 3.5Å
121	P	37.2	Very low	46.1	Very low	108 Å²	108	97.6 Å²	97.6	70%	0.701	55%	0.552	S	S	*	*			trans	-59.7	102.9	172	23.6	-30.6	0	0	0	107.8	N119 M123	N119-P121 WeakPolarHBondContact O-CD 3.35Å; P121-M123 HydrophobicContact CB-CG 3.98Å; P121-M123 PolarHBondContact O-N 3.16Å
122	V	41	Very low	46.2	Very low	117 Å²	117	98 Å²	98	71%	0.709	56%	0.559	S	S	*	*			trans	-76.5	71.6	167.6	-173.2	0	0	0	0	106.3	S120 N124	S120-V122 PolarHBondContact O-N 3.5Å; V122-N124 PolarHBondContact O-N 3.42Å
123	M	37	Very low	46.9	Very low	110 Å²	110	100.6 Å²	100.6	54%	0.542	56%	0.562	S	S	.	*			trans	-75.8	112.8	167.4	-69.7	-83.8	-76.6	0	0	105.1	P121 D125 A128	P121-M123 HydrophobicContact CB-CG 3.98Å; P121-M123 PolarHBondContact O-N 3.16Å; M123-D125 HydrophobicContact CB-CB 4.44Å; M123-D125 PolarHBondContact O-N 2.84Å; M123-A128 HydrophobicContact CB-CB 3.48Å; M123-A128 VanDerWaalsContact CB-CB 3.48Å; M123-A128 HydrophobicContact CG-CB 4.4Å
124	N	46.4	Very low	47.5	Very low	155 Å²	155	103.5 Å²	103.5	83%	0.829	57%	0.568	S	S	*	*			trans	-68.8	28.5	171.7	-80.6	-12.2	0	0	0	112.3	V122	V122-N124 PolarHBondContact O-N 3.42Å
125	D	46.6	Very low	48.3	Very low	91 Å²	91	105.5 Å²	105.5	49%	0.487	59%	0.586	S	S	.	*			trans	-92.4	122.7	172.8	-158.4	-8.3	0	0	0	106.2	M123 C127 A128 L129	M123-D125 HydrophobicContact CB-CB 4.44Å; M123-D125 PolarHBondContact O-N 2.84Å; D125-C127 PolarHBondContact O-N 3Å; D125-A128 HydrophobicContact CB-CB 4.25Å; D125-A128 WeakPolarHBondContact O-CA 3.31Å; D125-A128 WeakPolarHBondContact O-CB 3.46Å; D125-A128 PolarHBondContact O-N 3.2Å; D125-L129 PolarHBondContact O-N 3.05Å
126	E	46	Very low	49.4	Very low	157 Å²	157	108.1 Å²	108.1	73%	0.734	58%	0.584	S	S	*	*	H	α-helix	trans	-53.4	-32.2	-177.6	-153.1	168.9	-161.4	0	0	110.8	L130	E126-L130 WeakPolarHBondContact O-CB 3.36Å; E126-L130 WeakPolarHBondContact O-CG 3.46Å; E126-L130 PolarHBondContact O-N 2.81Å
127	C	43.1	Very low	50.4	Low	79 Å²	79	107.3 Å²	107.3	53%	0.534	58%	0.576	S	S	.	*	H	α-helix	trans	-64.1	-36.1	172.8	-72.7	0	0	0	0	114.2	D125 L131	D125-C127 PolarHBondContact O-N 3Å; C127-L131 WeakPolarHBondContact O-CB 3.44Å; C127-L131 WeakPolarHBondContact O-CG 3.44Å; C127-L131 PolarHBondContact O-N 3.44Å
128	A	44.9	Very low	51.4	Low	28 Å²	28	108 Å²	108	23%	0.231	58%	0.583	C	S	.	*	H	α-helix	trans	-77.4	-35	179.8	0	0	0	0	0	112.1	M123 D125 L131 A132	M123-A128 HydrophobicContact CB-CB 3.48Å; M123-A128 VanDerWaalsContact CB-CB 3.48Å; M123-A128 HydrophobicContact CG-CB 4.4Å; D125-A128 HydrophobicContact CB-CB 4.25Å; D125-A128 WeakPolarHBondContact O-CA 3.31Å; D125-A128 WeakPolarHBondContact O-CB 3.46Å; D125-A128 PolarHBondContact O-N 3.2Å; A128-L131 PolarHBondContact O-N 3.48Å; A128-A132 WeakPolarHBondContact O-CB 3.49Å; A128-A132 PolarHBondContact O-N 3.49Å
129	L	48.8	Very low	52.8	Low	98 Å²	98	107.8 Å²	107.8	51%	0.513	57%	0.573	S	S	.	*	H	α-helix	trans	-62.1	-46.5	169.4	-78.7	165.5	0	0	0	111	D125 L131 A132 E133	D125-L129 PolarHBondContact O-N 3.05Å; L129-L131 PolarHBondContact O-N 3.04Å; L129-A132 PolarHBondContact O-N 3.49Å; L129-E133 WeakPolarHBondContact O-CB 3.41Å; L129-E133 PolarHBondContact O-N 3.49Å
130	L	58.8	Low	54.2	Low	104 Å²	104	104.9 Å²	104.9	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-60.1	-42.1	174.7	-82.3	162.2	0	0	0	112.5	E126 E133 R134	E126-L130 WeakPolarHBondContact O-CB 3.36Å; E126-L130 WeakPolarHBondContact O-CG 3.46Å; E126-L130 PolarHBondContact O-N 2.81Å; L130-E133 PolarHBondContact O-N 3.41Å; L130-R134 WeakPolarHBondContact O-CB 3.24Å; L130-R134 PolarHBondContact O-N 3.5Å
131	L	58.3	Low	56	Low	120 Å²	120	105 Å²	105	63%	0.628	56%	0.556	S	S	*	*	H	α-helix	trans	-66.4	-40	176.8	-79.4	168.1	0	0	0	112.6	C127 A128 L129 R134 A135	C127-L131 WeakPolarHBondContact O-CB 3.44Å; C127-L131 WeakPolarHBondContact O-CG 3.44Å; C127-L131 PolarHBondContact O-N 3.44Å; A128-L131 PolarHBondContact O-N 3.48Å; L129-L131 PolarHBondContact O-N 3.04Å; L131-R134 PolarHBondContact O-N 3.02Å; L131-A135 WeakPolarHBondContact O-CB 3.43Å; L131-A135 PolarHBondContact O-N 3.28Å
132	A	54.6	Low	57.5	Low	45 Å²	45	104.6 Å²	104.6	37%	0.372	55%	0.547	S	S	.	.	H	α-helix	trans	-70.9	-32	177.1	0	0	0	0	0	112.6	A128 L129 R136	A128-A132 WeakPolarHBondContact O-CB 3.49Å; A128-A132 PolarHBondContact O-N 3.49Å; L129-A132 PolarHBondContact O-N 3.49Å; A132-R136 WeakPolarHBondContact O-CG 3.39Å; A132-R136 PolarHBondContact O-N 2.8Å; A132-R136 PolarHBondContact O-NE 2.85Å
133	E	65.5	Low	59	Low	108 Å²	108	104.3 Å²	104.3	51%	0.505	54%	0.538	S	S	.	.	H	α-helix	trans	-68.5	-47.5	171.1	-168.8	164.5	-151.8	0	0	110.9	L129 L130 A135 R136 E137	L129-E133 WeakPolarHBondContact O-CB 3.41Å; L129-E133 PolarHBondContact O-N 3.49Å; L130-E133 PolarHBondContact O-N 3.41Å; E133-A135 VanDerWaalsContact C-N 3.33Å; E133-A135 PolarHBondContact O-N 2.96Å; E133-R136 PolarHBondContact O-N 3.24Å; E133-R136 VanDerWaalsContact O-N 3.11Å; E133-E137 PolarHBondContact O-N 3.34Å
134	R	64.1	Low	60.7	Low	178 Å²	178	104.6 Å²	104.6	67%	0.672	54%	0.538	S	S	*	.	H	α-helix	trans	-58.4	-42.5	174.1	-121.4	-178.4	179.6	157.5	0.6	112.6	L130 L131 R136 E137 T138	L130-R134 WeakPolarHBondContact O-CB 3.24Å; L130-R134 PolarHBondContact O-N 3.5Å; L131-R134 PolarHBondContact O-N 3.02Å; R134-R136 VanDerWaalsContact C-N 3.31Å; R134-R136 PolarHBondContact O-N 2.97Å; R134-E137 PolarHBondContact O-N 3.29Å; R134-T138 WeakPolarHBondContact O-CB 3.37Å; R134-T138 PolarHBondContact O-N 2.93Å; R134-T138 PolarHBondContact O-OG1 3.34Å
135	A	66.1	Low	61.9	Low	54 Å²	54	101 Å²	101	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-62.2	-40.2	177.5	0	0	0	0	0	111.6	L131 E133 T138 Q139	L131-A135 WeakPolarHBondContact O-CB 3.43Å; L131-A135 PolarHBondContact O-N 3.28Å; E133-A135 VanDerWaalsContact C-N 3.33Å; E133-A135 PolarHBondContact O-N 2.96Å; A135-T138 PolarHBondContact O-N 3.29Å; A135-Q139 VanDerWaalsContact O-CB 3.32Å; A135-Q139 WeakPolarHBondContact O-CB 3.38Å; A135-Q139 PolarHBondContact O-N 3.48Å
136	R	69.5	Low	62.9	Low	167 Å²	167	99.8 Å²	99.8	63%	0.63	51%	0.511	S	S	*	.	H	α-helix	trans	-67.6	-43.2	175.9	-77.2	-177	-77.4	172.7	-0.7	112.7	A132 E133 R134 Q139 S140	A132-R136 WeakPolarHBondContact O-CG 3.39Å; A132-R136 PolarHBondContact O-N 2.8Å; A132-R136 PolarHBondContact O-NE 2.85Å; E133-R136 PolarHBondContact O-N 3.24Å; E133-R136 VanDerWaalsContact O-N 3.11Å; R134-R136 VanDerWaalsContact C-N 3.31Å; R134-R136 PolarHBondContact O-N 2.97Å; R136-Q139 PolarHBondContact O-N 3.25Å; R136-S140 WeakPolarHBondContact O-CB 3.3Å; R136-S140 PolarHBondContact O-N 3.31Å
137	E	68.9	Low	63.9	Low	119 Å²	119	97 Å²	97	56%	0.556	50%	0.501	S	S	*	.	H	α-helix	trans	-60.9	-46.8	173.1	-82.2	-174.1	149.8	0	0	111.5	E133 R134 Q139 S140 I141	E133-E137 PolarHBondContact O-N 3.34Å; R134-E137 PolarHBondContact O-N 3.29Å; E137-Q139 VanDerWaalsContact C-N 3.27Å; E137-Q139 PolarHBondContact O-N 3.4Å; E137-S140 PolarHBondContact O-N 2.96Å; E137-I141 VanDerWaalsContact O-CG1 3.3Å; E137-I141 WeakPolarHBondContact O-CG1 3.26Å; E137-I141 PolarHBondContact O-N 3.04Å
138	T	67.6	Low	64.7	Low	83 Å²	83	99.2 Å²	99.2	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-61.5	-40.4	-179.5	-45.9	0	0	0	0	110.6	R134 A135 L142	R134-T138 WeakPolarHBondContact O-CB 3.37Å; R134-T138 PolarHBondContact O-N 2.93Å; R134-T138 PolarHBondContact O-OG1 3.34Å; A135-T138 PolarHBondContact O-N 3.29Å; T138-L142 WeakPolarHBondContact O-CB 3.27Å; T138-L142 PolarHBondContact O-N 2.91Å
139	Q	68.7	Low	65.2	Low	125 Å²	125	105.3 Å²	105.3	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-69.2	-38.9	177.4	-165.7	157.2	-4.8	0	0	112.3	A135 R136 E137 L142 E143	A135-Q139 VanDerWaalsContact O-CB 3.32Å; A135-Q139 WeakPolarHBondContact O-CB 3.38Å; A135-Q139 PolarHBondContact O-N 3.48Å; R136-Q139 PolarHBondContact O-N 3.25Å; E137-Q139 VanDerWaalsContact C-N 3.27Å; E137-Q139 PolarHBondContact O-N 3.4Å; Q139-L142 PolarHBondContact O-N 3.48Å; Q139-E143 WeakPolarHBondContact O-CB 3.48Å; Q139-E143 WeakPolarHBondContact O-CG 3.27Å; Q139-E143 PolarHBondContact O-N 2.89Å
140	S	70.9	Confident	65.5	Low	68 Å²	68	108.6 Å²	108.6	48%	0.476	54%	0.537	S	S	.	.	H	α-helix	trans	-64	-42.5	173.8	-179.7	0	0	0	0	112.4	R136 E137 E143 Q144	R136-S140 WeakPolarHBondContact O-CB 3.3Å; R136-S140 PolarHBondContact O-N 3.31Å; E137-S140 PolarHBondContact O-N 2.96Å; S140-E143 PolarHBondContact O-N 3.06Å; S140-Q144 PolarHBondContact O-N 2.93Å
141	I	73	Confident	64.9	Low	91 Å²	91	108.1 Å²	108.1	47%	0.467	54%	0.539	S	S	.	.	H	α-helix	trans	-64.5	-42.4	175.5	-67.2	165.4	0	0	0	110.1	E137 E143 Q144 I145	E137-I141 VanDerWaalsContact O-CG1 3.3Å; E137-I141 WeakPolarHBondContact O-CG1 3.26Å; E137-I141 PolarHBondContact O-N 3.04Å; I141-E143 PolarHBondContact O-N 3.48Å; I141-Q144 WeakPolarHBondContact O-CB 3.43Å; I141-Q144 PolarHBondContact O-N 3.46Å; I141-I145 HydrophobicContact CG2-CD1 3.77Å; I141-I145 HydrophobicContact CG2-CG1 4.38Å; I141-I145 VanDerWaalsContact O-CG1 3.3Å; I141-I145 WeakPolarHBondContact O-CG1 3.49Å; I141-I145 PolarHBondContact O-N 3.4Å
142	L	68.7	Low	63.7	Low	100 Å²	100	105.7 Å²	105.7	52%	0.524	54%	0.543	S	S	.	.	H	α-helix	trans	-62.8	-42.4	177.5	-146.3	99.8	0	0	0	111.4	T138 Q139 Q144 I145 I146	T138-L142 WeakPolarHBondContact O-CB 3.27Å; T138-L142 PolarHBondContact O-N 2.91Å; Q139-L142 PolarHBondContact O-N 3.48Å; L142-Q144 VanDerWaalsContact C-N 3.35Å; L142-I145 PolarHBondContact O-N 2.85Å; L142-I146 HydrophobicContact CD2-CD1 3.95Å; L142-I146 HydrophobicContact CG-CD1 4.32Å; L142-I146 WeakPolarHBondContact O-CB 3.27Å; L142-I146 WeakPolarHBondContact O-CD1 3.42Å; L142-I146 WeakPolarHBondContact O-CG1 3.49Å; L142-I146 PolarHBondContact O-N 2.86Å
143	E	71.2	Confident	62.9	Low	110 Å²	110	109 Å²	109	51%	0.514	56%	0.559	S	S	.	*	H	α-helix	trans	-63.7	-38.6	174.2	-77.1	177.2	-176.9	0	0	112.1	Q139 S140 I141 I146 N147	Q139-E143 WeakPolarHBondContact O-CB 3.48Å; Q139-E143 WeakPolarHBondContact O-CG 3.27Å; Q139-E143 PolarHBondContact O-N 2.89Å; S140-E143 PolarHBondContact O-N 3.06Å; I141-E143 PolarHBondContact O-N 3.48Å; E143-I146 PolarHBondContact O-N 3.27Å; E143-N147 VanDerWaalsContact O-CB 3.3Å; E143-N147 WeakPolarHBondContact O-CB 3.23Å; E143-N147 PolarHBondContact O-N 2.97Å; E143-N147 PolarHBondContact O-ND2 3.45Å
144	Q	73.3	Confident	61.2	Low	117 Å²	117	110.1 Å²	110.1	55%	0.547	57%	0.573	S	S	.	*	H	α-helix	trans	-62.8	-48.1	173.8	-121.2	177	-3	0	0	111.7	S140 I141 L142 I146 N147 E148	S140-Q144 PolarHBondContact O-N 2.93Å; I141-Q144 WeakPolarHBondContact O-CB 3.43Å; I141-Q144 PolarHBondContact O-N 3.46Å; L142-Q144 VanDerWaalsContact C-N 3.35Å; Q144-I146 VanDerWaalsContact C-N 3.34Å; Q144-I146 PolarHBondContact O-N 2.97Å; Q144-N147 PolarHBondContact O-N 3.5Å; Q144-E148 WeakPolarHBondContact O-CB 3.28Å; Q144-E148 WeakPolarHBondContact O-CG 3.45Å; Q144-E148 PolarHBondContact O-N 3.5Å
145	I	70.6	Confident	59.9	Low	78 Å²	78	109.7 Å²	109.7	40%	0.4	58%	0.583	S	S	.	*	H	α-helix	trans	-63.2	-41.3	177.9	-66.9	167.6	0	0	0	110.9	I141 L142 N147 E148 Q149	I141-I145 HydrophobicContact CG2-CD1 3.77Å; I141-I145 HydrophobicContact CG2-CG1 4.38Å; I141-I145 VanDerWaalsContact O-CG1 3.3Å; I141-I145 WeakPolarHBondContact O-CG1 3.49Å; I141-I145 PolarHBondContact O-N 3.4Å; L142-I145 PolarHBondContact O-N 2.85Å; I145-N147 VanDerWaalsContact C-N 3.33Å; I145-E148 PolarHBondContact O-N 2.85Å; I145-Q149 WeakPolarHBondContact O-CB 3.47Å; I145-Q149 WeakPolarHBondContact O-CG 3.42Å; I145-Q149 PolarHBondContact O-N 3.33Å
146	I	68.6	Low	58.3	Low	67 Å²	67	113.5 Å²	113.5	34%	0.344	60%	0.596	S	S	.	*	H	α-helix	trans	-65	-38.9	176.1	-70.9	165.9	0	0	0	110.7	L142 E143 Q144 K150	L142-I146 HydrophobicContact CD2-CD1 3.95Å; L142-I146 HydrophobicContact CG-CD1 4.32Å; L142-I146 WeakPolarHBondContact O-CB 3.27Å; L142-I146 WeakPolarHBondContact O-CD1 3.42Å; L142-I146 WeakPolarHBondContact O-CG1 3.49Å; L142-I146 PolarHBondContact O-N 2.86Å; E143-I146 PolarHBondContact O-N 3.27Å; Q144-I146 VanDerWaalsContact C-N 3.34Å; Q144-I146 PolarHBondContact O-N 2.97Å; I146-K150 HydrophobicContact CG2-CD 4.1Å; I146-K150 WeakPolarHBondContact O-CB 3.39Å; I146-K150 WeakPolarHBondContact O-CG 3.48Å; I146-K150 PolarHBondContact O-N 3.44Å
147	N	65.9	Low	56.7	Low	97 Å²	97	113 Å²	113	52%	0.519	61%	0.606	S	S	.	*	H	α-helix	trans	-68.7	-43.7	176.1	-75.8	-22.6	0	0	0	111.4	E143 Q144 I145 Q149 K150 T151	E143-N147 VanDerWaalsContact O-CB 3.3Å; E143-N147 WeakPolarHBondContact O-CB 3.23Å; E143-N147 PolarHBondContact O-N 2.97Å; E143-N147 PolarHBondContact O-ND2 3.45Å; Q144-N147 PolarHBondContact O-N 3.5Å; I145-N147 VanDerWaalsContact C-N 3.33Å; N147-Q149 VanDerWaalsContact C-N 3.31Å; N147-Q149 PolarHBondContact O-N 3.39Å; N147-K150 PolarHBondContact O-N 3.23Å; N147-K150 VanDerWaalsContact O-N 3.12Å; N147-T151 PolarHBondContact O-N 3.4Å; N147-T151 PolarHBondContact O-OG1 2.85Å
148	E	60.4	Low	54.9	Low	127 Å²	127	110.3 Å²	110.3	59%	0.593	61%	0.611	S	S	*	*	H	α-helix	trans	-62.3	-36.6	175.7	-75.2	177	178.9	0	0	112.2	Q144 I145 T151	Q144-E148 WeakPolarHBondContact O-CB 3.28Å; Q144-E148 WeakPolarHBondContact O-CG 3.45Å; Q144-E148 PolarHBondContact O-N 3.5Å; I145-E148 PolarHBondContact O-N 2.85Å; E148-T151 CarbonylContact O-C 3.49Å
149	Q	56	Low	53.3	Low	156 Å²	156	112.6 Å²	112.6	73%	0.729	63%	0.625	S	S	*	*	H	α-helix	trans	-74.3	-28	173.6	-73.7	-174.7	-4.3	0	0	113.5	I145 N147	I145-Q149 WeakPolarHBondContact O-CB 3.47Å; I145-Q149 WeakPolarHBondContact O-CG 3.42Å; I145-Q149 PolarHBondContact O-N 3.33Å; N147-Q149 VanDerWaalsContact C-N 3.31Å; N147-Q149 PolarHBondContact O-N 3.39Å
150	K	54.1	Low	51.8	Low	167 Å²	167	114.3 Å²	114.3	73%	0.726	64%	0.637	S	S	*	*	H	α-helix	trans	-81.5	-31.8	175.5	-79.7	178.8	178.2	176.7	0	112.9	I146 N147 G152	I146-K150 HydrophobicContact CG2-CD 4.1Å; I146-K150 WeakPolarHBondContact O-CB 3.39Å; I146-K150 WeakPolarHBondContact O-CG 3.48Å; I146-K150 PolarHBondContact O-N 3.44Å; N147-K150 PolarHBondContact O-N 3.23Å; N147-K150 VanDerWaalsContact O-N 3.12Å; K150-G152 PolarHBondContact O-N 2.98Å; K150-G152 VanDerWaalsContact O-N 3.15Å
151	T	47	Very low	50.1	Low	93 Å²	93	118.1 Å²	118.1	57%	0.571	65%	0.652	S	S	*	*	S	Bend	trans	-86.3	69.3	167.6	53.4	0	0	0	0	109.3	N147 E148 T153	N147-T151 PolarHBondContact O-N 3.4Å; N147-T151 PolarHBondContact O-OG1 2.85Å; E148-T151 CarbonylContact O-C 3.49Å; T151-T153 VanDerWaalsContact C-N 3.35Å; T151-T153 PolarHBondContact O-N 2.88Å; T151-T153 PolarHBondContact O-OG1 3.38Å
152	G	33.3	Very low	48.5	Very low	70 Å²	70	125 Å²	125	72%	0.722	67%	0.672	S	S	*	*			trans	-55.9	96.9	173.2	0	0	0	0	0	110.7	K150	K150-G152 PolarHBondContact O-N 2.98Å; K150-G152 VanDerWaalsContact O-N 3.15Å
153	T	37	Very low	47.5	Very low	114 Å²	114	127.4 Å²	127.4	70%	0.699	69%	0.685	S	S	*	*			trans	-121.4	96.9	164.3	-15.9	0	0	0	0	107.3	T151 L155	T151-T153 VanDerWaalsContact C-N 3.35Å; T151-T153 PolarHBondContact O-N 2.88Å; T151-T153 PolarHBondContact O-OG1 3.38Å; T153-L155 PolarHBondContact O-N 2.85Å
154	T	30.8	Very low	46.4	Very low	131 Å²	131	124.6 Å²	124.6	80%	0.804	68%	0.676	S	S	*	*			trans	-25.4	112.5	158.5	6.8	0	0	0	0	113.2
155	L	35.9	Very low	45.3	Very low	169 Å²	169	125.1 Å²	125.1	89%	0.885	68%	0.683	S	S	*	*			trans	-117	79.4	161.2	-96.4	151.1	0	0	0	108.4	T153	T153-L155 PolarHBondContact O-N 2.85Å
156	N	32	Very low	44.7	Very low	134 Å²	134	125.1 Å²	125.1	72%	0.717	69%	0.689	S	S	*	*			trans	-82.9	147	151.1	-92.5	-15.7	0	0	0	108.3
157	N	37.1	Very low	44.2	Very low	156 Å²	156	125.2 Å²	125.2	83%	0.834	70%	0.696	S	S	*	*			trans	114.1	96.7	172.9	-58.5	-13.4	0	0	0	109.3
158	G	30.1	Very low	43.9	Very low	64 Å²	64	125.8 Å²	125.8	66%	0.66	70%	0.699	S	S	*	*			cis	81.2	120.2	46.4	0	0	0	0	0	108.2
159	T	34.1	Very low	44.2	Very low	131 Å²	131	124.9 Å²	124.9	80%	0.804	70%	0.697	S	S	*	*			trans	81.9	94.4	175.6	71.1	0	0	0	0	116.4
160	N	37.4	Very low	45	Very low	160 Å²	160	123.5 Å²	123.5	86%	0.856	69%	0.689	S	S	*	*				-179.9	54.4	129.2	-82.5	-25.4	0	0	0	110.1	R162	N160-R162 PolarHBondContact O-N 3.45Å
161	L	34.6	Very low	45.8	Very low	148 Å²	148	120.4 Å²	120.4	78%	0.775	68%	0.68	S	S	*	*			trans	-78.9	97.6	161.7	-93.5	100.5	0	0	0	108.4	T164	L161-T164 HydrophobicContact CG-CG2 4.33Å
162	R	41.5	Very low	47.1	Very low	235 Å²	235	122.6 Å²	122.6	89%	0.887	68%	0.681	S	S	*	*	S	Bend	trans	-158.4	10.3	154.6	-119.4	173.8	-179.5	-167.7	-1.1	117.2	N160	N160-R162 PolarHBondContact O-N 3.45Å
163	N	46.1	Very low	49.2	Very low	151 Å²	151	124.9 Å²	124.9	81%	0.807	67%	0.673	S	S	*	*	S	Bend	trans	-127.1	21.1	172.2	-82.9	-14.1	0	0	0	113.4	D165	N163-D165 PolarHBondContact O-N 3.43Å
164	T	48.6	Very low	51.1	Low	52 Å²	52	124.8 Å²	124.8	32%	0.319	67%	0.665	S	S	.	*	H	α-helix	trans	-72.8	-23.8	-167.9	40.2	0	0	0	0	115.3	L161 S166 S167 L168	L161-T164 HydrophobicContact CG-CG2 4.33Å; T164-S166 PolarHBondContact O-N 3.49Å; T164-S167 PolarHBondContact O-N 3.32Å; T164-S167 PolarHBondContact O-OG 2.88Å; T164-S167 VanDerWaalsContact O-OG 3.08Å; T164-L168 VanDerWaalsContact O-CB 3.3Å; T164-L168 WeakPolarHBondContact O-CB 3.3Å; T164-L168 PolarHBondContact O-N 3.38Å
165	D	50.9	Low	53.3	Low	128 Å²	128	122.9 Å²	122.9	68%	0.684	65%	0.648	S	S	*	*	H	α-helix	trans	-72	-34.1	-170.6	-67.9	-19.8	0	0	0	113.8	N163 L169	N163-D165 PolarHBondContact O-N 3.43Å; D165-L169 WeakPolarHBondContact O-CB 3.46Å; D165-L169 PolarHBondContact O-N 3.3Å; D165-L169 VanDerWaalsContact O-N 3.1Å
166	S	57.9	Low	55.4	Low	78 Å²	78	120.8 Å²	120.8	55%	0.545	63%	0.634	S	S	.	*	H	α-helix	trans	-72.1	-39.4	176.8	176	0	0	0	0	112.2	T164 K170	T164-S166 PolarHBondContact O-N 3.49Å; S166-K170 WeakPolarHBondContact O-CG 3.39Å; S166-K170 PolarHBondContact O-N 3.32Å
167	S	58.3	Low	57.8	Low	69 Å²	69	119.6 Å²	119.6	48%	0.483	62%	0.624	S	S	.	*	H	α-helix	trans	-72.9	-34.8	176	47.7	0	0	0	0	112.1	T164 L171	T164-S167 PolarHBondContact O-N 3.32Å; T164-S167 PolarHBondContact O-OG 2.88Å; T164-S167 VanDerWaalsContact O-OG 3.08Å; S167-L171 VanDerWaalsContact O-CB 3.28Å; S167-L171 WeakPolarHBondContact O-CB 3.47Å; S167-L171 PolarHBondContact O-N 2.97Å
168	L	58.2	Low	59.8	Low	109 Å²	109	117.9 Å²	117.9	57%	0.571	62%	0.615	S	S	*	*	H	α-helix	trans	-67.8	-39.1	176	-129.5	115.4	0	0	0	112.3	T164 L171 K172	T164-L168 VanDerWaalsContact O-CB 3.3Å; T164-L168 WeakPolarHBondContact O-CB 3.3Å; T164-L168 PolarHBondContact O-N 3.38Å; L168-L171 PolarHBondContact O-N 2.89Å; L168-K172 WeakPolarHBondContact O-CB 3.34Å; L168-K172 PolarHBondContact O-N 3.24Å
169	L	68.1	Low	62.1	Low	108 Å²	108	118.3 Å²	118.3	57%	0.565	61%	0.607	S	S	*	*	H	α-helix	trans	-63.7	-49.2	175.5	-103.6	146.5	0	0	0	111.5	D165 L171 K172 E173	D165-L169 WeakPolarHBondContact O-CB 3.46Å; D165-L169 PolarHBondContact O-N 3.3Å; D165-L169 VanDerWaalsContact O-N 3.1Å; L169-L171 PolarHBondContact O-N 3.46Å; L169-K172 PolarHBondContact O-N 2.98Å; L169-K172 VanDerWaalsContact O-N 3.11Å; L169-E173 PolarHBondContact O-N 2.86Å
170	K	73.3	Confident	64.5	Low	126 Å²	126	118 Å²	118	55%	0.548	60%	0.596	S	S	.	*	H	α-helix	trans	-60.1	-35.5	174.3	-73.9	-178	178.6	-176.1	0	112.5	S166 H174	S166-K170 WeakPolarHBondContact O-CG 3.39Å; S166-K170 PolarHBondContact O-N 3.32Å; K170-H174 WeakPolarHBondContact O-CB 3.46Å; K170-H174 PolarHBondContact O-N 3.46Å; K170-H174 PolarHBondContact O-ND1 3.32Å
171	L	69.6	Low	66.6	Low	103 Å²	103	113.7 Å²	113.7	54%	0.539	57%	0.574	S	S	.	*	H	α-helix	trans	-68.2	-41.5	175.8	-174.9	66.1	0	0	0	111.2	S167 L168 L169 H174 I175	S167-L171 VanDerWaalsContact O-CB 3.28Å; S167-L171 WeakPolarHBondContact O-CB 3.47Å; S167-L171 PolarHBondContact O-N 2.97Å; L168-L171 PolarHBondContact O-N 2.89Å; L169-L171 PolarHBondContact O-N 3.46Å; L171-H174 PolarHBondContact O-N 3.27Å; L171-I175 HydrophobicContact CD1-CD1 4.47Å; L171-I175 HydrophobicContact CG-CD1 3.98Å; L171-I175 WeakPolarHBondContact O-CB 3.47Å; L171-I175 VanDerWaalsContact O-CG1 3.22Å; L171-I175 WeakPolarHBondContact O-CG1 3.47Å; L171-I175 PolarHBondContact O-N 3.13Å
172	K	74.8	Confident	68.7	Low	138 Å²	138	112.4 Å²	112.4	60%	0.6	57%	0.567	S	S	*	*	H	α-helix	trans	-66.1	-40.4	178.4	-167.8	178.1	179.2	-177.6	0	112.1	L168 L169 I175 Q176	L168-K172 WeakPolarHBondContact O-CB 3.34Å; L168-K172 PolarHBondContact O-N 3.24Å; L169-K172 PolarHBondContact O-N 2.98Å; L169-K172 VanDerWaalsContact O-N 3.11Å; K172-I175 PolarHBondContact O-N 3.47Å; K172-Q176 PolarHBondContact O-N 3.43Å
173	E	77	Confident	70.5	Confident	119 Å²	119	103 Å²	103	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-61.5	-48.9	172.8	-74.2	176	167.9	0	0	111.1	L169 I175 Q176 E177	L169-E173 PolarHBondContact O-N 2.86Å; E173-I175 VanDerWaalsContact C-N 3.31Å; E173-I175 PolarHBondContact O-N 3.33Å; E173-Q176 PolarHBondContact O-N 3.02Å; E173-Q176 VanDerWaalsContact O-N 3.15Å; E173-E177 PolarHBondContact O-N 2.96Å
174	H	77.7	Confident	72.4	Confident	112 Å²	112	100.9 Å²	100.9	52%	0.519	53%	0.526	S	S	.	.	H	α-helix	trans	-60.7	-37.9	175.2	-78.1	121.8	0	0	0	112.7	K170 L171 E177 L178	K170-H174 WeakPolarHBondContact O-CB 3.46Å; K170-H174 PolarHBondContact O-N 3.46Å; K170-H174 PolarHBondContact O-ND1 3.32Å; L171-H174 PolarHBondContact O-N 3.27Å; H174-E177 PolarHBondContact O-N 3.44Å; H174-L178 WeakPolarHBondContact O-CB 3.48Å; H174-L178 WeakPolarHBondContact O-CD1 3.3Å; H174-L178 WeakPolarHBondContact O-CG 3.33Å; H174-L178 PolarHBondContact O-N 2.9Å
175	I	76.8	Confident	73.9	Confident	90 Å²	90	101.8 Å²	101.8	46%	0.462	53%	0.532	S	S	.	.	H	α-helix	trans	-64.9	-40.5	176.2	-72.5	166.3	0	0	0	110.9	L171 K172 E173 S179	L171-I175 HydrophobicContact CD1-CD1 4.47Å; L171-I175 HydrophobicContact CG-CD1 3.98Å; L171-I175 WeakPolarHBondContact O-CB 3.47Å; L171-I175 VanDerWaalsContact O-CG1 3.22Å; L171-I175 WeakPolarHBondContact O-CG1 3.47Å; L171-I175 PolarHBondContact O-N 3.13Å; K172-I175 PolarHBondContact O-N 3.47Å; E173-I175 VanDerWaalsContact C-N 3.31Å; E173-I175 PolarHBondContact O-N 3.33Å; I175-S179 WeakPolarHBondContact O-CB 3.41Å; I175-S179 PolarHBondContact O-N 2.94Å; I175-S179 PolarHBondContact O-OG 3.36Å
176	Q	80	Confident	75.2	Confident	126 Å²	126	102 Å²	102	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-66.5	-44.1	175.6	-79.5	-175.7	-32.2	0	0	111.7	K172 E173 S179 Q180	K172-Q176 PolarHBondContact O-N 3.43Å; E173-Q176 PolarHBondContact O-N 3.02Å; E173-Q176 VanDerWaalsContact O-N 3.15Å; Q176-S179 PolarHBondContact O-N 2.83Å; Q176-Q180 PolarHBondContact O-N 2.96Å
177	E	82.5	Confident	76.4	Confident	109 Å²	109	105.1 Å²	105.1	51%	0.509	53%	0.534	S	S	.	.	H	α-helix	trans	-62.6	-44.7	176.2	-170.7	178.3	-176.6	0	0	111.4	E173 H174 S179 Q180 N181	E173-E177 PolarHBondContact O-N 2.96Å; H174-E177 PolarHBondContact O-N 3.44Å; E177-S179 VanDerWaalsContact C-N 3.33Å; E177-S179 PolarHBondContact O-N 3.2Å; E177-Q180 PolarHBondContact O-N 3.4Å; E177-N181 WeakPolarHBondContact O-CB 3.48Å; E177-N181 VanDerWaalsContact O-CG 3.28Å; E177-N181 PolarHBondContact O-N 3.41Å; E177-N181 PolarHBondContact O-ND2 3.48Å
178	L	78.7	Confident	77.6	Confident	120 Å²	120	108.1 Å²	108.1	63%	0.628	54%	0.541	S	S	*	.	H	α-helix	trans	-59.9	-41.6	173.3	-85.3	157.4	0	0	0	111.7	H174 N181 L182	H174-L178 WeakPolarHBondContact O-CB 3.48Å; H174-L178 WeakPolarHBondContact O-CD1 3.3Å; H174-L178 WeakPolarHBondContact O-CG 3.33Å; H174-L178 PolarHBondContact O-N 2.9Å; L178-N181 PolarHBondContact O-N 2.83Å; L178-L182 WeakPolarHBondContact O-CB 3.32Å; L178-L182 PolarHBondContact O-N 3.38Å
179	S	79	Confident	78.6	Confident	72 Å²	72	108.1 Å²	108.1	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-67.2	-39.1	178.3	-60.2	0	0	0	0	111.8	I175 Q176 E177 L182 G183	I175-S179 WeakPolarHBondContact O-CB 3.41Å; I175-S179 PolarHBondContact O-N 2.94Å; I175-S179 PolarHBondContact O-OG 3.36Å; Q176-S179 PolarHBondContact O-N 2.83Å; E177-S179 VanDerWaalsContact C-N 3.33Å; E177-S179 PolarHBondContact O-N 3.2Å; S179-L182 PolarHBondContact O-N 2.91Å; S179-G183 PolarHBondContact O-N 3.02Å
180	Q	82.8	Confident	79	Confident	124 Å²	124	106 Å²	106	58%	0.579	54%	0.535	S	S	*	.	H	α-helix	trans	-68.9	-41.9	176.5	-167.4	177.5	14.6	0	0	111.6	Q176 E177 L182 G183 K184	Q176-Q180 PolarHBondContact O-N 2.96Å; E177-Q180 PolarHBondContact O-N 3.4Å; Q180-L182 VanDerWaalsContact C-N 3.33Å; Q180-G183 PolarHBondContact O-N 2.95Å; Q180-K184 PolarHBondContact O-N 3.15Å
181	N	82.4	Confident	79.5	Confident	70 Å²	70	105.7 Å²	105.7	37%	0.374	54%	0.535	S	S	.	.	H	α-helix	trans	-66.7	-35.4	174.6	-71.1	-20.6	0	0	0	111.5	E177 L178 K184 T185	E177-N181 WeakPolarHBondContact O-CB 3.48Å; E177-N181 VanDerWaalsContact O-CG 3.28Å; E177-N181 PolarHBondContact O-N 3.41Å; E177-N181 PolarHBondContact O-ND2 3.48Å; L178-N181 PolarHBondContact O-N 2.83Å; N181-K184 PolarHBondContact O-N 3.33Å; N181-T185 WeakPolarHBondContact O-CB 3.43Å; N181-T185 VanDerWaalsContact O-CG2 3.3Å; N181-T185 WeakPolarHBondContact O-CG2 3.28Å; N181-T185 PolarHBondContact O-N 3.44Å; N181-T185 PolarHBondContact O-OG1 3.44Å
182	L	78.6	Confident	79.9	Confident	122 Å²	122	103.4 Å²	103.4	64%	0.639	53%	0.532	S	S	*	.	H	α-helix	trans	-64.2	-41	172.8	-171	69.6	0	0	0	111.2	L178 S179 Q180 T185 H186	L178-L182 WeakPolarHBondContact O-CB 3.32Å; L178-L182 PolarHBondContact O-N 3.38Å; S179-L182 PolarHBondContact O-N 2.91Å; Q180-L182 VanDerWaalsContact C-N 3.33Å; L182-T185 WeakPolarHBondContact CA-OG1 3.36Å; L182-T185 PolarHBondContact O-N 2.95Å; L182-T185 PolarHBondContact O-OG1 2.99Å; L182-H186 WeakPolarHBondContact O-CB 3.46Å; L182-H186 PolarHBondContact O-N 2.98Å
183	G	80.4	Confident	80	Confident	36 Å²	36	99.4 Å²	99.4	37%	0.371	52%	0.519	S	S	.	.	H	α-helix	trans	-60.6	-49.6	173.9	0	0	0	0	0	112.5	S179 Q180 T185 H186 E187	S179-G183 PolarHBondContact O-N 3.02Å; Q180-G183 PolarHBondContact O-N 2.95Å; G183-T185 PolarHBondContact O-N 3.39Å; G183-H186 PolarHBondContact O-N 2.81Å; G183-E187 PolarHBondContact O-N 3.38Å
184	K	84.9	Confident	80.1	Confident	107 Å²	107	98.1 Å²	98.1	47%	0.465	52%	0.516	S	S	.	.	H	α-helix	trans	-60.2	-46	176.6	-72.2	178.7	179.7	175.6	0	112.4	Q180 N181 H186 E187 E188	Q180-K184 PolarHBondContact O-N 3.15Å; N181-K184 PolarHBondContact O-N 3.33Å; K184-H186 VanDerWaalsContact C-N 3.27Å; K184-H186 PolarHBondContact O-N 2.97Å; K184-E187 PolarHBondContact O-N 3.45Å; K184-E188 WeakPolarHBondContact O-CG 3.41Å; K184-E188 PolarHBondContact O-N 3.01Å
185	T	79.4	Confident	80.2	Confident	72 Å²	72	96 Å²	96	44%	0.442	51%	0.506	S	S	.	.	H	α-helix	trans	-66.3	-29.7	178.6	51.8	0	0	0	0	112.4	N181 L182 G183 L189	N181-T185 WeakPolarHBondContact O-CB 3.43Å; N181-T185 VanDerWaalsContact O-CG2 3.3Å; N181-T185 WeakPolarHBondContact O-CG2 3.28Å; N181-T185 PolarHBondContact O-N 3.44Å; N181-T185 PolarHBondContact O-OG1 3.44Å; L182-T185 WeakPolarHBondContact CA-OG1 3.36Å; L182-T185 PolarHBondContact O-N 2.95Å; L182-T185 PolarHBondContact O-OG1 2.99Å; G183-T185 PolarHBondContact O-N 3.39Å; T185-L189 VanDerWaalsContact O-CB 3.25Å; T185-L189 WeakPolarHBondContact O-CB 3.42Å; T185-L189 PolarHBondContact O-N 3.4Å
186	H	79.2	Confident	80.1	Confident	132 Å²	132	100 Å²	100	61%	0.611	52%	0.515	S	S	*	.	H	α-helix	trans	-69.5	-42.1	173	-168.4	67.6	0	0	0	112.4	L182 G183 K184 L189 S190	L182-H186 WeakPolarHBondContact O-CB 3.46Å; L182-H186 PolarHBondContact O-N 2.98Å; G183-H186 PolarHBondContact O-N 2.81Å; K184-H186 VanDerWaalsContact C-N 3.27Å; K184-H186 PolarHBondContact O-N 2.97Å; H186-L189 PolarHBondContact O-N 3.48Å; H186-S190 PolarHBondContact O-N 3.23Å
187	E	83.6	Confident	80	Confident	143 Å²	143	97.1 Å²	97.1	67%	0.668	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-44.4	173.7	-74.4	-179.9	176.2	0	0	111.9	G183 K184 L189 S190 H191	G183-E187 PolarHBondContact O-N 3.38Å; K184-E187 PolarHBondContact O-N 3.45Å; E187-L189 VanDerWaalsContact C-N 3.32Å; E187-L189 PolarHBondContact O-N 3.45Å; E187-S190 PolarHBondContact O-N 3.46Å; E187-H191 PolarHBondContact O-N 3.33Å
188	E	83.4	Confident	79.9	Confident	132 Å²	132	97.8 Å²	97.8	62%	0.617	51%	0.507	S	S	*	.	H	α-helix	trans	-60.1	-41.5	174.6	-73.1	173.7	-176.1	0	0	111.6	K184 H191 A192	K184-E188 WeakPolarHBondContact O-CG 3.41Å; K184-E188 PolarHBondContact O-N 3.01Å; E188-H191 PolarHBondContact O-N 3.39Å; E188-A192 VanDerWaalsContact O-CB 3.28Å; E188-A192 WeakPolarHBondContact O-CB 3.5Å; E188-A192 PolarHBondContact O-N 3.5Å
189	L	78.3	Confident	79.8	Confident	109 Å²	109	96.9 Å²	96.9	57%	0.571	50%	0.502	S	S	*	.	H	α-helix	trans	-65.9	-39.3	176.1	-175	67.5	0	0	0	112	T185 H186 E187 T193	T185-L189 VanDerWaalsContact O-CB 3.25Å; T185-L189 WeakPolarHBondContact O-CB 3.42Å; T185-L189 PolarHBondContact O-N 3.4Å; H186-L189 PolarHBondContact O-N 3.48Å; E187-L189 VanDerWaalsContact C-N 3.32Å; E187-L189 PolarHBondContact O-N 3.45Å; L189-T193 WeakPolarHBondContact O-CB 3.38Å; L189-T193 PolarHBondContact O-N 3.41Å; L189-T193 PolarHBondContact O-OG1 3.44Å
190	S	77.6	Confident	79.4	Confident	63 Å²	63	96.3 Å²	96.3	44%	0.441	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-48.2	175.2	-168.2	0	0	0	0	110.8	H186 E187 A192 T193 D194	H186-S190 PolarHBondContact O-N 3.23Å; E187-S190 PolarHBondContact O-N 3.46Å; S190-A192 PolarHBondContact O-N 3.38Å; S190-T193 WeakPolarHBondContact O-CB 3.43Å; S190-T193 PolarHBondContact O-N 2.65Å; S190-T193 VanDerWaalsContact O-N 3.15Å; S190-D194 PolarHBondContact O-N 2.87Å
191	H	82.6	Confident	79.2	Confident	120 Å²	120	97 Å²	97	56%	0.556	50%	0.499	S	S	*	.	H	α-helix	trans	-62.3	-43.2	177.4	-175	-75.5	0	0	0	112	E187 E188 T193 D194 E195	E187-H191 PolarHBondContact O-N 3.33Å; E188-H191 PolarHBondContact O-N 3.39Å; H191-T193 VanDerWaalsContact C-N 3.27Å; H191-T193 PolarHBondContact O-N 2.66Å; H191-D194 PolarHBondContact O-N 2.93Å; H191-E195 PolarHBondContact O-N 3.05Å
192	A	77.4	Confident	78.8	Confident	56 Å²	56	96.3 Å²	96.3	46%	0.463	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-35.3	175.4	0	0	0	0	0	112.1	E188 S190 R196	E188-A192 VanDerWaalsContact O-CB 3.28Å; E188-A192 WeakPolarHBondContact O-CB 3.5Å; E188-A192 PolarHBondContact O-N 3.5Å; S190-A192 PolarHBondContact O-N 3.38Å; A192-R196 VanDerWaalsContact O-CB 3.28Å; A192-R196 WeakPolarHBondContact O-CB 3.47Å; A192-R196 PolarHBondContact O-N 3.44Å
193	T	77.3	Confident	78.6	Confident	54 Å²	54	97.9 Å²	97.9	33%	0.331	50%	0.502	S	S	.	.	H	α-helix	trans	-68	-43.2	176	-58.4	0	0	0	0	111.4	L189 S190 H191 R196 V197	L189-T193 WeakPolarHBondContact O-CB 3.38Å; L189-T193 PolarHBondContact O-N 3.41Å; L189-T193 PolarHBondContact O-OG1 3.44Å; S190-T193 WeakPolarHBondContact O-CB 3.43Å; S190-T193 PolarHBondContact O-N 2.65Å; S190-T193 VanDerWaalsContact O-N 3.15Å; H191-T193 VanDerWaalsContact C-N 3.27Å; H191-T193 PolarHBondContact O-N 2.66Å; T193-R196 WeakPolarHBondContact O-CB 3.33Å; T193-R196 PolarHBondContact O-N 2.83Å; T193-V197 WeakPolarHBondContact O-CG2 3.41Å; T193-V197 PolarHBondContact O-N 3.29Å
194	D	79.9	Confident	78.2	Confident	92 Å²	92	100.9 Å²	100.9	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-44.7	176.9	-75.9	-18.8	0	0	0	112.1	S190 H191 R196 V197 K198	S190-D194 PolarHBondContact O-N 2.87Å; H191-D194 PolarHBondContact O-N 2.93Å; D194-R196 VanDerWaalsContact C-N 3.35Å; D194-R196 PolarHBondContact O-N 3.21Å; D194-V197 PolarHBondContact O-N 2.8Å; D194-K198 WeakPolarHBondContact O-CG 3.5Å; D194-K198 PolarHBondContact O-N 2.87Å
195	E	78.5	Confident	77.7	Confident	66 Å²	66	101 Å²	101	31%	0.308	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-39.2	174.9	-72	-56.7	126	0	0	111.7	H191 V197 K198 L199	H191-E195 PolarHBondContact O-N 3.05Å; E195-V197 VanDerWaalsContact C-N 3.32Å; E195-V197 PolarHBondContact O-N 3.32Å; E195-K198 PolarHBondContact O-N 3.19Å; E195-K198 IonicContact OE1-NZ 3.61Å; E195-K198 PolarHBondContact OE1-NZ 3.03Å; E195-L199 WeakPolarHBondContact O-CB 3.44Å; E195-L199 WeakPolarHBondContact O-CG 3.48Å; E195-L199 PolarHBondContact O-N 3.23Å
196	R	75.5	Confident	77.5	Confident	174 Å²	174	101 Å²	101	66%	0.657	52%	0.517	S	S	*	.	H	α-helix	trans	-60.9	-40.7	173.5	-169.1	-175.8	72.5	173.5	1.2	111.9	A192 T193 D194 S200	A192-R196 VanDerWaalsContact O-CB 3.28Å; A192-R196 WeakPolarHBondContact O-CB 3.47Å; A192-R196 PolarHBondContact O-N 3.44Å; T193-R196 WeakPolarHBondContact O-CB 3.33Å; T193-R196 PolarHBondContact O-N 2.83Å; D194-R196 VanDerWaalsContact C-N 3.35Å; D194-R196 PolarHBondContact O-N 3.21Å; R196-S200 VanDerWaalsContact O-CB 3.31Å; R196-S200 WeakPolarHBondContact O-CB 3.43Å; R196-S200 PolarHBondContact O-N 2.83Å
197	V	77.8	Confident	77.1	Confident	66 Å²	66	97.2 Å²	97.2	40%	0.4	50%	0.499	S	S	.	.	H	α-helix	trans	-66.5	-41.6	176.3	171.4	0	0	0	0	111.1	T193 D194 E195 S200 K201	T193-V197 WeakPolarHBondContact O-CG2 3.41Å; T193-V197 PolarHBondContact O-N 3.29Å; D194-V197 PolarHBondContact O-N 2.8Å; E195-V197 VanDerWaalsContact C-N 3.32Å; E195-V197 PolarHBondContact O-N 3.32Å; V197-S200 PolarHBondContact O-N 2.9Å; V197-K201 WeakPolarHBondContact O-CG 3.17Å; V197-K201 PolarHBondContact O-N 3.49Å
198	K	81.2	Confident	76.8	Confident	124 Å²	124	96 Å²	96	54%	0.539	49%	0.494	S	S	.	.	H	α-helix	trans	-61.9	-47.6	175.2	-71.6	177.2	-167.2	164.9	0	111.9	D194 E195 S200 K201 A202	D194-K198 WeakPolarHBondContact O-CG 3.5Å; D194-K198 PolarHBondContact O-N 2.87Å; E195-K198 PolarHBondContact O-N 3.19Å; E195-K198 IonicContact OE1-NZ 3.61Å; E195-K198 PolarHBondContact OE1-NZ 3.03Å; K198-S200 VanDerWaalsContact C-N 3.33Å; K198-S200 PolarHBondContact O-N 3.5Å; K198-K201 PolarHBondContact O-N 3.2Å; K198-A202 PolarHBondContact O-N 2.84Å
199	L	76.3	Confident	76.7	Confident	100 Å²	100	95.2 Å²	95.2	52%	0.524	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-39.9	177.2	-72.3	173.7	0	0	0	111.8	E195 A202 W203	E195-L199 WeakPolarHBondContact O-CB 3.44Å; E195-L199 WeakPolarHBondContact O-CG 3.48Å; E195-L199 PolarHBondContact O-N 3.23Å; L199-A202 PolarHBondContact O-N 2.86Å; L199-W203 WeakPolarHBondContact O-CB 3.33Å; L199-W203 PolarHBondContact O-N 3.18Å
200	S	70.1	Confident	76.4	Confident	60 Å²	60	96 Å²	96	42%	0.42	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-41.6	175.7	-179.2	0	0	0	0	112.2	R196 V197 K198 W203 L204	R196-S200 VanDerWaalsContact O-CB 3.31Å; R196-S200 WeakPolarHBondContact O-CB 3.43Å; R196-S200 PolarHBondContact O-N 2.83Å; V197-S200 PolarHBondContact O-N 2.9Å; K198-S200 VanDerWaalsContact C-N 3.33Å; K198-S200 PolarHBondContact O-N 3.5Å; S200-W203 PolarHBondContact O-N 3.07Å; S200-L204 WeakPolarHBondContact O-CG 3.31Å; S200-L204 PolarHBondContact O-N 3.49Å
201	K	77.8	Confident	76.4	Confident	138 Å²	138	97.4 Å²	97.4	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-64	-43.9	174.1	-73.6	179.6	-179.4	-179.9	0	112.3	V197 K198 W203 L204 L205	V197-K201 WeakPolarHBondContact O-CG 3.17Å; V197-K201 PolarHBondContact O-N 3.49Å; K198-K201 PolarHBondContact O-N 3.2Å; K201-W203 VanDerWaalsContact C-N 3.3Å; K201-W203 PolarHBondContact O-N 3.05Å; K201-L204 PolarHBondContact O-N 3.35Å; K201-L205 PolarHBondContact O-N 2.86Å; K201-L205 VanDerWaalsContact O-N 3.09Å
202	A	74.5	Confident	76.3	Confident	57 Å²	57	95.2 Å²	95.2	47%	0.471	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-37.1	176.6	0	0	0	0	0	112	K198 L199 S206	K198-A202 PolarHBondContact O-N 2.84Å; L199-A202 PolarHBondContact O-N 2.86Å; A202-S206 WeakPolarHBondContact O-CB 3.45Å; A202-S206 PolarHBondContact O-N 2.86Å
203	W	74.8	Confident	76.2	Confident	155 Å²	155	94.8 Å²	94.8	59%	0.587	48%	0.479	S	S	*	.	H	α-helix	trans	-66.2	-42	175.2	-174.2	76.1	0	0	0	112.1	L199 S200 K201 S206 E207	L199-W203 WeakPolarHBondContact O-CB 3.33Å; L199-W203 PolarHBondContact O-N 3.18Å; S200-W203 PolarHBondContact O-N 3.07Å; K201-W203 VanDerWaalsContact C-N 3.3Å; K201-W203 PolarHBondContact O-N 3.05Å; W203-S206 PolarHBondContact O-N 3.26Å; W203-E207 WeakPolarHBondContact O-CB 3.41Å; W203-E207 PolarHBondContact O-N 2.69Å
204	L	72.4	Confident	76.1	Confident	99 Å²	99	95.8 Å²	95.8	52%	0.518	48%	0.483	S	S	.	.	H	α-helix	trans	-62.7	-43	176.1	-72.8	171.6	0	0	0	112.4	S200 K201 E207 E208	S200-L204 WeakPolarHBondContact O-CG 3.31Å; S200-L204 PolarHBondContact O-N 3.49Å; K201-L204 PolarHBondContact O-N 3.35Å; L204-E207 PolarHBondContact O-N 2.8Å; L204-E208 PolarHBondContact O-N 2.68Å
205	L	74.8	Confident	76.2	Confident	108 Å²	108	97.9 Å²	97.9	57%	0.565	49%	0.49	S	S	*	.	H	α-helix	trans	-62.9	-42.3	175.2	-70.7	170.4	0	0	0	111.9	K201 E207 E208 D209	K201-L205 PolarHBondContact O-N 2.86Å; K201-L205 VanDerWaalsContact O-N 3.09Å; L205-E207 VanDerWaalsContact C-N 3.3Å; L205-E207 PolarHBondContact O-N 3.45Å; L205-E208 PolarHBondContact O-N 3.49Å; L205-D209 PolarHBondContact O-N 3.26Å
206	S	74.3	Confident	76.5	Confident	73 Å²	73	101.6 Å²	101.6	51%	0.51	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-35.8	175.3	-178.5	0	0	0	0	112.5	A202 W203 R210	A202-S206 WeakPolarHBondContact O-CB 3.45Å; A202-S206 PolarHBondContact O-N 2.86Å; W203-S206 PolarHBondContact O-N 3.26Å; S206-R210 WeakPolarHBondContact O-CB 3.49Å; S206-R210 PolarHBondContact O-N 3.24Å
207	E	70.4	Confident	76.7	Confident	52 Å²	52	98 Å²	98	24%	0.243	50%	0.498	C	S	.	.	H	α-helix	trans	-70.4	-37.8	176.2	-172.9	65.9	-178.9	0	0	111.7	W203 L204 L205 R210 I211	W203-E207 WeakPolarHBondContact O-CB 3.41Å; W203-E207 PolarHBondContact O-N 2.69Å; L204-E207 PolarHBondContact O-N 2.8Å; L205-E207 VanDerWaalsContact C-N 3.3Å; L205-E207 PolarHBondContact O-N 3.45Å; E207-R210 WeakPolarHBondContact O-CB 3.42Å; E207-R210 PolarHBondContact O-N 2.95Å; E207-R210 IonicContact OE1-CZ 2.84Å; E207-R210 IonicContact OE1-NE 3.1Å; E207-R210 IonicContact OE1-NH2 2.66Å; E207-R210 PolarHBondContact OE1-NH2 2.93Å; E207-R210 IonicContact OE2-CZ 3.18Å; E207-R210 IonicContact OE2-NE 3.29Å; E207-R210 PolarHBondContact OE2-NE 3.19Å; E207-R210 IonicContact OE2-NH2 3.74Å; E207-R210 PolarHBondContact OE2-NH2 3.44Å; E207-I211 HydrophobicContact CG-CD1 4.35Å; E207-I211 VanDerWaalsContact O-CG1 3.27Å; E207-I211 WeakPolarHBondContact O-CG1 3.31Å; E207-I211 PolarHBondContact O-N 2.92Å
208	E	78.1	Confident	76.8	Confident	119 Å²	119	97.1 Å²	97.1	56%	0.556	50%	0.498	S	S	*	.	H	α-helix	trans	-63.3	-47.3	172.6	-167.1	167.6	-165.5	0	0	111.1	L204 L205 R210 I211 D212	L204-E208 PolarHBondContact O-N 2.68Å; L205-E208 PolarHBondContact O-N 3.49Å; E208-R210 VanDerWaalsContact C-N 3.25Å; E208-R210 PolarHBondContact O-N 3.16Å; E208-I211 PolarHBondContact O-N 3.07Å; E208-I211 VanDerWaalsContact O-N 3.1Å; E208-D212 PolarHBondContact O-N 2.78Å
209	D	80	Confident	77	Confident	114 Å²	114	97.5 Å²	97.5	61%	0.61	50%	0.5	S	S	*	.	H	α-helix	trans	-57.9	-37.8	173.4	-75	-25.6	0	0	0	112.1	L205 A213	L205-D209 PolarHBondContact O-N 3.26Å; D209-A213 WeakPolarHBondContact O-CB 3.34Å; D209-A213 PolarHBondContact O-N 2.85Å
210	R	72.1	Confident	77.3	Confident	126 Å²	126	96.2 Å²	96.2	48%	0.475	50%	0.496	S	S	.	.	H	α-helix	trans	-69.5	-38.3	177.4	-167.5	-176.4	73.1	77.1	4	111.7	S206 E207 E208 N214	S206-R210 WeakPolarHBondContact O-CB 3.49Å; S206-R210 PolarHBondContact O-N 3.24Å; E207-R210 WeakPolarHBondContact O-CB 3.42Å; E207-R210 PolarHBondContact O-N 2.95Å; E207-R210 IonicContact OE1-CZ 2.84Å; E207-R210 IonicContact OE1-NE 3.1Å; E207-R210 IonicContact OE1-NH2 2.66Å; E207-R210 PolarHBondContact OE1-NH2 2.93Å; E207-R210 IonicContact OE2-CZ 3.18Å; E207-R210 IonicContact OE2-NE 3.29Å; E207-R210 PolarHBondContact OE2-NE 3.19Å; E207-R210 IonicContact OE2-NH2 3.74Å; E207-R210 PolarHBondContact OE2-NH2 3.44Å; E208-R210 VanDerWaalsContact C-N 3.25Å; E208-R210 PolarHBondContact O-N 3.16Å; R210-N214 PolarHBondContact NH1-ND2 2.99Å; R210-N214 WeakPolarHBondContact O-CB 3.36Å; R210-N214 VanDerWaalsContact O-CG 3.23Å; R210-N214 PolarHBondContact O-N 2.89Å; R210-N214 PolarHBondContact O-ND2 3.39Å
211	I	77.6	Confident	77.7	Confident	92 Å²	92	99 Å²	99	47%	0.472	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-47.7	174.8	-70.5	165.1	0	0	0	109.6	E207 E208 A213 N214 E215	E207-I211 HydrophobicContact CG-CD1 4.35Å; E207-I211 VanDerWaalsContact O-CG1 3.27Å; E207-I211 WeakPolarHBondContact O-CG1 3.31Å; E207-I211 PolarHBondContact O-N 2.92Å; E208-I211 PolarHBondContact O-N 3.07Å; E208-I211 VanDerWaalsContact O-N 3.1Å; I211-A213 VanDerWaalsContact C-N 3.32Å; I211-A213 PolarHBondContact O-N 3.28Å; I211-N214 PolarHBondContact O-N 2.94Å; I211-N214 VanDerWaalsContact O-N 3.11Å; I211-E215 PolarHBondContact O-N 2.9Å
212	D	80.9	Confident	78	Confident	74 Å²	74	97.9 Å²	97.9	40%	0.396	50%	0.502	S	S	.	.	H	α-helix	trans	-58.9	-41.8	176.5	-86.2	10.4	0	0	0	112.4	E208 E215 K216	E208-D212 PolarHBondContact O-N 2.78Å; D212-E215 PolarHBondContact O-N 3.48Å; D212-K216 WeakPolarHBondContact O-CG 3.46Å; D212-K216 PolarHBondContact O-N 2.98Å
213	A	76.2	Confident	78.5	Confident	47 Å²	47	99.9 Å²	99.9	39%	0.388	50%	0.502	S	S	.	.	H	α-helix	trans	-65	-41	175.6	0	0	0	0	0	111.9	D209 I211 K216 L217	D209-A213 WeakPolarHBondContact O-CB 3.34Å; D209-A213 PolarHBondContact O-N 2.85Å; I211-A213 VanDerWaalsContact C-N 3.32Å; I211-A213 PolarHBondContact O-N 3.28Å; A213-K216 PolarHBondContact O-N 2.92Å; A213-L217 WeakPolarHBondContact O-CB 3.22Å; A213-L217 WeakPolarHBondContact O-CG 3.26Å; A213-L217 PolarHBondContact O-N 3.44Å
214	N	75.5	Confident	78.8	Confident	76 Å²	76	98 Å²	98	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-67.9	-37.2	176.8	-73.4	-37.6	0	0	0	112.1	R210 I211 L217 A218	R210-N214 PolarHBondContact NH1-ND2 2.99Å; R210-N214 WeakPolarHBondContact O-CB 3.36Å; R210-N214 VanDerWaalsContact O-CG 3.23Å; R210-N214 PolarHBondContact O-N 2.89Å; R210-N214 PolarHBondContact O-ND2 3.39Å; I211-N214 PolarHBondContact O-N 2.94Å; I211-N214 VanDerWaalsContact O-N 3.11Å; N214-L217 PolarHBondContact O-N 3.47Å; N214-A218 WeakPolarHBondContact O-CB 3.48Å; N214-A218 PolarHBondContact O-N 3.34Å
215	E	82.1	Confident	79.4	Confident	136 Å²	136	99 Å²	99	64%	0.636	50%	0.504	S	S	*	.	H	α-helix	trans	-65.7	-43.6	175.2	-170.8	177.3	175.1	0	0	111.1	I211 D212 L217 A218 K219	I211-E215 PolarHBondContact O-N 2.9Å; D212-E215 PolarHBondContact O-N 3.48Å; E215-L217 VanDerWaalsContact C-N 3.35Å; E215-L217 PolarHBondContact O-N 2.92Å; E215-A218 PolarHBondContact O-N 3.42Å; E215-K219 WeakPolarHBondContact O-CB 3.34Å; E215-K219 PolarHBondContact O-N 2.89Å
216	K	85	Confident	79.9	Confident	144 Å²	144	98.7 Å²	98.7	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-59.8	-43.9	172.7	-73.3	171.6	-173	165.4	0	111.6	D212 A213 K219 T220	D212-K216 WeakPolarHBondContact O-CG 3.46Å; D212-K216 PolarHBondContact O-N 2.98Å; A213-K216 PolarHBondContact O-N 2.92Å; K216-K219 PolarHBondContact O-N 2.92Å; K216-T220 WeakPolarHBondContact O-CG2 3.49Å; K216-T220 PolarHBondContact O-N 3.18Å; K216-T220 PolarHBondContact O-OG1 2.89Å
217	L	78.9	Confident	80.4	Confident	97 Å²	97	99.5 Å²	99.5	51%	0.508	50%	0.502	S	S	.	.	H	α-helix	trans	-61.4	-48.8	176.1	-78	171.8	0	0	0	111.7	A213 N214 E215 K219 T220 E221	A213-L217 WeakPolarHBondContact O-CB 3.22Å; A213-L217 WeakPolarHBondContact O-CG 3.26Å; A213-L217 PolarHBondContact O-N 3.44Å; N214-L217 PolarHBondContact O-N 3.47Å; E215-L217 VanDerWaalsContact C-N 3.35Å; E215-L217 PolarHBondContact O-N 2.92Å; L217-K219 VanDerWaalsContact C-N 3.28Å; L217-K219 PolarHBondContact O-N 2.84Å; L217-T220 WeakPolarHBondContact CA-OG1 3.46Å; L217-T220 PolarHBondContact O-N 2.93Å; L217-T220 VanDerWaalsContact O-N 3.11Å; L217-T220 PolarHBondContact O-OG1 3.32Å; L217-E221 WeakPolarHBondContact O-CG 3.45Å; L217-E221 PolarHBondContact O-N 3.19Å
218	A	80.1	Confident	81.1	Confident	49 Å²	49	99.8 Å²	99.8	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-58.7	-39.7	177.5	0	0	0	0	0	112	N214 E215 E221 L222	N214-A218 WeakPolarHBondContact O-CB 3.48Å; N214-A218 PolarHBondContact O-N 3.34Å; E215-A218 PolarHBondContact O-N 3.42Å; A218-E221 PolarHBondContact O-N 2.97Å; A218-L222 WeakPolarHBondContact O-CG 3.4Å; A218-L222 PolarHBondContact O-N 2.87Å; A218-L222 VanDerWaalsContact O-N 3.07Å
219	K	84.1	Confident	81.5	Confident	132 Å²	132	98.3 Å²	98.3	57%	0.574	50%	0.503	S	S	*	.	H	α-helix	trans	-63.8	-45.6	174.3	-172.3	177.9	177.1	-178.8	0	112.1	E215 K216 L217 E221 L222 E223	E215-K219 WeakPolarHBondContact O-CB 3.34Å; E215-K219 PolarHBondContact O-N 2.89Å; K216-K219 PolarHBondContact O-N 2.92Å; L217-K219 VanDerWaalsContact C-N 3.28Å; L217-K219 PolarHBondContact O-N 2.84Å; K219-E221 VanDerWaalsContact C-N 3.32Å; K219-E221 PolarHBondContact O-N 2.96Å; K219-L222 PolarHBondContact O-N 3.32Å; K219-E223 WeakPolarHBondContact CE-OE1 3.43Å; K219-E223 WeakPolarHBondContact O-CG 3.21Å; K219-E223 PolarHBondContact O-N 3.49Å
220	T	83.4	Confident	81.9	Confident	72 Å²	72	97.8 Å²	97.8	44%	0.442	50%	0.495	S	S	.	.	H	α-helix	trans	-65.8	-33.2	177	59.2	0	0	0	0	112.9	K216 L217 E223 L224	K216-T220 WeakPolarHBondContact O-CG2 3.49Å; K216-T220 PolarHBondContact O-N 3.18Å; K216-T220 PolarHBondContact O-OG1 2.89Å; L217-T220 WeakPolarHBondContact CA-OG1 3.46Å; L217-T220 PolarHBondContact O-N 2.93Å; L217-T220 VanDerWaalsContact O-N 3.11Å; L217-T220 PolarHBondContact O-OG1 3.32Å; T220-E223 PolarHBondContact O-N 3.39Å; T220-L224 WeakPolarHBondContact O-CB 3.49Å; T220-L224 PolarHBondContact O-N 3.35Å
221	E	78.8	Confident	82.6	Confident	118 Å²	118	96.8 Å²	96.8	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-66.7	-40.2	174.5	-75.1	-175	166.6	0	0	111.8	L217 A218 K219 L224 Q225	L217-E221 WeakPolarHBondContact O-CG 3.45Å; L217-E221 PolarHBondContact O-N 3.19Å; A218-E221 PolarHBondContact O-N 2.97Å; K219-E221 VanDerWaalsContact C-N 3.32Å; K219-E221 PolarHBondContact O-N 2.96Å; E221-L224 PolarHBondContact O-N 3.34Å; E221-Q225 WeakPolarHBondContact O-CG 3.33Å; E221-Q225 PolarHBondContact O-N 3.45Å
222	L	83.5	Confident	83.1	Confident	115 Å²	115	94.7 Å²	94.7	60%	0.602	49%	0.486	S	S	*	.	H	α-helix	trans	-64.1	-44.6	173.7	-74.5	172.1	0	0	0	111.8	A218 K219 L224 Q225 E226	A218-L222 WeakPolarHBondContact O-CG 3.4Å; A218-L222 PolarHBondContact O-N 2.87Å; A218-L222 VanDerWaalsContact O-N 3.07Å; K219-L222 PolarHBondContact O-N 3.32Å; L222-L224 VanDerWaalsContact C-N 3.33Å; L222-L224 PolarHBondContact O-N 3.47Å; L222-Q225 PolarHBondContact O-N 3.38Å; L222-E226 PolarHBondContact O-N 3.44Å
223	E	85.3	Confident	83.4	Confident	100 Å²	100	97.2 Å²	97.2	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-60.8	-41.5	175.7	-72	173.7	-172.6	0	0	111.4	K219 T220 Q225 E226 V227	K219-E223 WeakPolarHBondContact CE-OE1 3.43Å; K219-E223 WeakPolarHBondContact O-CG 3.21Å; K219-E223 PolarHBondContact O-N 3.49Å; T220-E223 PolarHBondContact O-N 3.39Å; E223-Q225 PolarHBondContact O-N 3Å; E223-E226 PolarHBondContact O-N 3.11Å; E223-V227 WeakPolarHBondContact O-CG2 3.33Å; E223-V227 PolarHBondContact O-N 2.86Å
224	L	81.7	Confident	83.9	Confident	114 Å²	114	99.9 Å²	99.9	60%	0.597	50%	0.503	S	S	*	.	H	α-helix	trans	-63.2	-40.9	176.1	-178	64.8	0	0	0	112.1	T220 E221 L222 V227 T228	T220-L224 WeakPolarHBondContact O-CB 3.49Å; T220-L224 PolarHBondContact O-N 3.35Å; E221-L224 PolarHBondContact O-N 3.34Å; L222-L224 VanDerWaalsContact C-N 3.33Å; L222-L224 PolarHBondContact O-N 3.47Å; L224-V227 PolarHBondContact O-N 3.04Å; L224-T228 WeakPolarHBondContact O-CB 3.39Å; L224-T228 PolarHBondContact O-N 3.42Å; L224-T228 PolarHBondContact O-OG1 3.1Å
225	Q	84.6	Confident	84.4	Confident	120 Å²	120	100.5 Å²	100.5	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-64.2	-41.4	175.7	-73.4	178.8	13.2	0	0	111.6	E221 L222 E223 T228 L229	E221-Q225 WeakPolarHBondContact O-CG 3.33Å; E221-Q225 PolarHBondContact O-N 3.45Å; L222-Q225 PolarHBondContact O-N 3.38Å; E223-Q225 PolarHBondContact O-N 3Å; Q225-T228 PolarHBondContact O-N 2.93Å; Q225-L229 WeakPolarHBondContact O-CG 3.42Å; Q225-L229 PolarHBondContact O-N 3.41Å
226	E	85.1	Confident	84.7	Confident	103 Å²	103	98 Å²	98	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-63.4	-45.6	176.6	-167.6	-174	163.3	0	0	111.7	L222 E223 T228 L229 K230	L222-E226 PolarHBondContact O-N 3.44Å; E223-E226 PolarHBondContact O-N 3.11Å; E226-T228 VanDerWaalsContact C-N 3.3Å; E226-T228 PolarHBondContact O-N 3.42Å; E226-L229 PolarHBondContact O-N 2.96Å; E226-K230 WeakPolarHBondContact O-CG 3.36Å; E226-K230 PolarHBondContact O-N 3.09Å; E226-K230 WeakPolarHBondContact OE1-CE 3.48Å; E226-K230 IonicContact OE1-NZ 3.62Å; E226-K230 PolarHBondContact OE1-NZ 2.87Å
227	V	84.5	Confident	84.8	Confident	89 Å²	89	96.1 Å²	96.1	54%	0.539	49%	0.49	S	S	.	.	H	α-helix	trans	-61	-41.2	175.8	172	0	0	0	0	110.9	E223 L224 L229 K230 N231	E223-V227 WeakPolarHBondContact O-CG2 3.33Å; E223-V227 PolarHBondContact O-N 2.86Å; L224-V227 PolarHBondContact O-N 3.04Å; V227-L229 VanDerWaalsContact C-N 3.34Å; V227-L229 PolarHBondContact O-N 3.2Å; V227-K230 PolarHBondContact O-N 2.96Å; V227-N231 WeakPolarHBondContact O-CB 3.49Å; V227-N231 PolarHBondContact O-N 3.36Å
228	T	85.1	Confident	85.1	Confident	59 Å²	59	95.4 Å²	95.4	36%	0.362	49%	0.492	S	S	.	.	H	α-helix	trans	-62.6	-41	177.5	-58.4	0	0	0	0	111.6	L224 Q225 E226 N231 K232	L224-T228 WeakPolarHBondContact O-CB 3.39Å; L224-T228 PolarHBondContact O-N 3.42Å; L224-T228 PolarHBondContact O-OG1 3.1Å; Q225-T228 PolarHBondContact O-N 2.93Å; E226-T228 VanDerWaalsContact C-N 3.3Å; E226-T228 PolarHBondContact O-N 3.42Å; T228-N231 PolarHBondContact O-N 3.27Å; T228-K232 WeakPolarHBondContact O-CG 3.31Å; T228-K232 PolarHBondContact O-N 2.95Å; T228-K232 VanDerWaalsContact O-N 3.12Å
229	L	86.1	Confident	85.4	Confident	87 Å²	87	97 Å²	97	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-66.2	-45	175.3	-73.6	170.3	0	0	0	111.9	Q225 E226 V227 N231 K232 Q233	Q225-L229 WeakPolarHBondContact O-CG 3.42Å; Q225-L229 PolarHBondContact O-N 3.41Å; E226-L229 PolarHBondContact O-N 2.96Å; V227-L229 VanDerWaalsContact C-N 3.34Å; V227-L229 PolarHBondContact O-N 3.2Å; L229-N231 VanDerWaalsContact C-N 3.3Å; L229-N231 PolarHBondContact O-N 3.46Å; L229-K232 PolarHBondContact O-N 3.13Å; L229-Q233 WeakPolarHBondContact O-CG 3.34Å; L229-Q233 PolarHBondContact O-N 3.02Å
230	K	89.4	Confident	85.7	Confident	104 Å²	104	97 Å²	97	45%	0.452	49%	0.491	S	S	.	.	H	α-helix	trans	-60.9	-39.3	175.9	-73.9	177.6	-176.5	165.5	0	111.9	E226 V227 Q233 L234	E226-K230 WeakPolarHBondContact O-CG 3.36Å; E226-K230 PolarHBondContact O-N 3.09Å; E226-K230 WeakPolarHBondContact OE1-CE 3.48Å; E226-K230 IonicContact OE1-NZ 3.62Å; E226-K230 PolarHBondContact OE1-NZ 2.87Å; V227-K230 PolarHBondContact O-N 2.96Å; K230-Q233 PolarHBondContact O-N 3.42Å; K230-L234 WeakPolarHBondContact O-CG 3.47Å; K230-L234 PolarHBondContact O-N 2.84Å
231	N	86.6	Confident	85.8	Confident	105 Å²	105	96.4 Å²	96.4	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-65.5	-41.3	177.4	-162	7.6	0	0	0	111.8	V227 T228 L229 Q233 L234 Q235	V227-N231 WeakPolarHBondContact O-CB 3.49Å; V227-N231 PolarHBondContact O-N 3.36Å; T228-N231 PolarHBondContact O-N 3.27Å; L229-N231 VanDerWaalsContact C-N 3.3Å; L229-N231 PolarHBondContact O-N 3.46Å; N231-Q233 VanDerWaalsContact C-N 3.34Å; N231-Q233 PolarHBondContact O-N 2.99Å; N231-L234 PolarHBondContact O-N 2.87Å; N231-Q235 PolarHBondContact O-N 3.38Å
232	K	88.1	Confident	86.3	Confident	47 Å²	47	94.6 Å²	94.6	20%	0.204	49%	0.491	C	S	.	.	H	α-helix	trans	-61.8	-40.2	173	-71.2	173.8	-173	173.1	0	112.2	T228 L229 Q235 L236 N533	T228-K232 WeakPolarHBondContact O-CG 3.31Å; T228-K232 PolarHBondContact O-N 2.95Å; T228-K232 VanDerWaalsContact O-N 3.12Å; L229-K232 PolarHBondContact O-N 3.13Å; K232-Q235 PolarHBondContact O-N 3.39Å; K232-L236 PolarHBondContact O-N 3.31Å; K232-L236 VanDerWaalsContact O-N 3.14Å; K232-N533 WeakPolarHBondContact CE-O 3.31Å; K232-N533 PolarHBondContact NZ-O 3.4Å; K232-N533 PolarHBondContact NZ-OD1 3.31Å
233	Q	87.4	Confident	86.5	Confident	127 Å²	127	94.6 Å²	94.6	59%	0.593	49%	0.488	S	S	*	.	H	α-helix	trans	-64.4	-44.5	175.6	-72.2	176.5	-13.9	0	0	112.1	L229 K230 N231 Q235 L236 I237	L229-Q233 WeakPolarHBondContact O-CG 3.34Å; L229-Q233 PolarHBondContact O-N 3.02Å; K230-Q233 PolarHBondContact O-N 3.42Å; N231-Q233 VanDerWaalsContact C-N 3.34Å; N231-Q233 PolarHBondContact O-N 2.99Å; Q233-Q235 VanDerWaalsContact C-N 3.29Å; Q233-Q235 PolarHBondContact O-N 2.9Å; Q233-L236 PolarHBondContact O-N 2.83Å; Q233-I237 WeakPolarHBondContact O-CG1 3.35Å; Q233-I237 PolarHBondContact O-N 3.31Å
234	L	86.8	Confident	86.5	Confident	104 Å²	104	92.7 Å²	92.7	55%	0.545	49%	0.489	S	S	.	.	H	α-helix	trans	-60	-40.5	175.1	-76.3	172.2	0	0	0	111.6	K230 N231 L236 I237 C238	K230-L234 WeakPolarHBondContact O-CG 3.47Å; K230-L234 PolarHBondContact O-N 2.84Å; N231-L234 PolarHBondContact O-N 2.87Å; L234-L236 VanDerWaalsContact C-N 3.34Å; L234-L236 PolarHBondContact O-N 3.37Å; L234-I237 PolarHBondContact O-N 3Å; L234-C238 PolarHBondContact O-N 2.84Å; L234-C238 PolarHBondContact O-SG 3.48Å; L234-C238 VanDerWaalsContact O-SG 3.35Å
235	Q	86.8	Confident	86.8	Confident	88 Å²	88	89.7 Å²	89.7	41%	0.411	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-42.4	176.4	-167.8	170.6	16.9	0	0	112.2	N231 K232 Q233 C238 E239	N231-Q235 PolarHBondContact O-N 3.38Å; K232-Q235 PolarHBondContact O-N 3.39Å; Q233-Q235 VanDerWaalsContact C-N 3.29Å; Q233-Q235 PolarHBondContact O-N 2.9Å; Q235-C238 WeakPolarHBondContact O-CB 3.48Å; Q235-C238 PolarHBondContact O-N 3.33Å; Q235-E239 WeakPolarHBondContact O-CG 3.39Å; Q235-E239 PolarHBondContact O-N 3.21Å
236	L	88.1	Confident	87.1	Confident	84 Å²	84	90.4 Å²	90.4	44%	0.44	48%	0.482	S	S	.	.	H	α-helix	trans	-67.8	-34.8	176.9	-170.9	136.8	0	0	0	112.5	K232 Q233 L234 E239 K240	K232-L236 PolarHBondContact O-N 3.31Å; K232-L236 VanDerWaalsContact O-N 3.14Å; Q233-L236 PolarHBondContact O-N 2.83Å; L234-L236 VanDerWaalsContact C-N 3.34Å; L234-L236 PolarHBondContact O-N 3.37Å; L236-E239 PolarHBondContact O-N 3.38Å; L236-K240 HydrophobicContact CD2-CD 4.12Å; L236-K240 WeakPolarHBondContact O-CG 3.49Å; L236-K240 PolarHBondContact O-N 3.14Å
237	I	85.5	Confident	87.2	Confident	105 Å²	105	90.9 Å²	90.9	54%	0.538	48%	0.484	S	S	.	.	H	α-helix	trans	-65.4	-43	172.8	-67.9	167.7	0	0	0	110.4	Q233 L234 K240 A241	Q233-I237 WeakPolarHBondContact O-CG1 3.35Å; Q233-I237 PolarHBondContact O-N 3.31Å; L234-I237 PolarHBondContact O-N 3Å; I237-K240 PolarHBondContact O-N 3.02Å; I237-A241 WeakPolarHBondContact O-CB 3.43Å; I237-A241 PolarHBondContact O-N 2.89Å
238	C	85.2	Confident	87.4	Confident	81 Å²	81	90.3 Å²	90.3	55%	0.547	48%	0.483	S	S	.	.	H	α-helix	trans	-61	-44.7	175.3	-71.6	0	0	0	0	111.6	L234 Q235 K240 A241 T242	L234-C238 PolarHBondContact O-N 2.84Å; L234-C238 PolarHBondContact O-SG 3.48Å; L234-C238 VanDerWaalsContact O-SG 3.35Å; Q235-C238 WeakPolarHBondContact O-CB 3.48Å; Q235-C238 PolarHBondContact O-N 3.33Å; C238-K240 PolarHBondContact O-N 3.41Å; C238-A241 PolarHBondContact O-N 2.96Å; C238-T242 WeakPolarHBondContact O-CG2 3.41Å; C238-T242 PolarHBondContact O-N 2.81Å
239	E	88	Confident	87.7	Confident	84 Å²	84	91.8 Å²	91.8	39%	0.393	49%	0.488	S	S	.	.	H	α-helix	trans	-57.6	-50.1	175.8	-72.3	167.3	-169.1	0	0	110.7	Q235 L236 A241 T242 E243 K534	Q235-E239 WeakPolarHBondContact O-CG 3.39Å; Q235-E239 PolarHBondContact O-N 3.21Å; L236-E239 PolarHBondContact O-N 3.38Å; E239-A241 PolarHBondContact O-N 3.37Å; E239-T242 PolarHBondContact O-N 2.98Å; E239-T242 VanDerWaalsContact O-N 3.14Å; E239-T242 PolarHBondContact O-OG1 2.98Å; E239-E243 PolarHBondContact O-N 3.14Å; E239-E243 VanDerWaalsContact O-N 3.1Å; E239-K534 IonicContact OE1-NZ 3.88Å; E239-K534 PolarHBondContact OE1-NZ 3.49Å
240	K	90	Very high	87.8	Confident	131 Å²	131	93 Å²	93	57%	0.57	49%	0.492	S	S	*	.	H	α-helix	trans	-61	-38.6	175.2	-73.8	-177.3	175.2	-176.6	0	113.7	L236 I237 C238 T242 E243 A244	L236-K240 HydrophobicContact CD2-CD 4.12Å; L236-K240 WeakPolarHBondContact O-CG 3.49Å; L236-K240 PolarHBondContact O-N 3.14Å; I237-K240 PolarHBondContact O-N 3.02Å; C238-K240 PolarHBondContact O-N 3.41Å; K240-T242 VanDerWaalsContact C-N 3.3Å; K240-T242 PolarHBondContact O-N 2.84Å; K240-E243 PolarHBondContact O-N 3.39Å; K240-A244 WeakPolarHBondContact O-CB 3.48Å; K240-A244 PolarHBondContact O-N 3.49Å
241	A	86.2	Confident	87.8	Confident	60 Å²	60	92.7 Å²	92.7	50%	0.496	50%	0.495	S	S	.	.	H	α-helix	trans	-64	-37.7	176.8	0	0	0	0	0	111.4	I237 C238 E239 A244 A245	I237-A241 WeakPolarHBondContact O-CB 3.43Å; I237-A241 PolarHBondContact O-N 2.89Å; C238-A241 PolarHBondContact O-N 2.96Å; E239-A241 PolarHBondContact O-N 3.37Å; A241-A244 PolarHBondContact O-N 3.3Å; A241-A245 WeakPolarHBondContact O-CB 3.39Å; A241-A245 PolarHBondContact O-N 3.36Å
242	T	88.6	Confident	88	Confident	80 Å²	80	92.6 Å²	92.6	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-68.3	-36.3	175	64.5	0	0	0	0	112.7	C238 E239 K240 A245 K246	C238-T242 WeakPolarHBondContact O-CG2 3.41Å; C238-T242 PolarHBondContact O-N 2.81Å; E239-T242 PolarHBondContact O-N 2.98Å; E239-T242 VanDerWaalsContact O-N 3.14Å; E239-T242 PolarHBondContact O-OG1 2.98Å; K240-T242 VanDerWaalsContact C-N 3.3Å; K240-T242 PolarHBondContact O-N 2.84Å; T242-A245 PolarHBondContact O-N 3.45Å; T242-K246 WeakPolarHBondContact O-CG 3.27Å; T242-K246 PolarHBondContact O-N 2.9Å; T242-K246 VanDerWaalsContact O-N 3.09Å
243	E	87.2	Confident	88.1	Confident	115 Å²	115	98.1 Å²	98.1	54%	0.537	51%	0.51	S	S	.	.	H	α-helix	trans	-66.7	-44.6	173.6	-70.6	178.6	172.4	0	0	111.8	E239 K240 A245 K246 H247	E239-E243 PolarHBondContact O-N 3.14Å; E239-E243 VanDerWaalsContact O-N 3.1Å; K240-E243 PolarHBondContact O-N 3.39Å; E243-A245 VanDerWaalsContact C-N 3.29Å; E243-A245 PolarHBondContact O-N 2.94Å; E243-K246 WeakPolarHBondContact O-CB 3.49Å; E243-K246 PolarHBondContact O-N 3.41Å; E243-K246 VanDerWaalsContact O-N 3.15Å; E243-H247 PolarHBondContact O-CD2 3.29Å; E243-H247 PolarHBondContact O-N 3.35Å
244	A	86.4	Confident	88.1	Confident	60 Å²	60	94.6 Å²	94.6	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-60.5	-39.1	174.9	0	0	0	0	0	112	K240 A241 H247 S248	K240-A244 WeakPolarHBondContact O-CB 3.48Å; K240-A244 PolarHBondContact O-N 3.49Å; A241-A244 PolarHBondContact O-N 3.3Å; A244-H247 PolarHBondContact O-N 3.08Å; A244-S248 WeakPolarHBondContact O-CB 3.4Å; A244-S248 PolarHBondContact O-N 3.49Å
245	A	87.3	Confident	88.4	Confident	50 Å²	50	93.3 Å²	93.3	41%	0.413	49%	0.493	S	S	.	.	H	α-helix	trans	-63.2	-40.8	174.6	0	0	0	0	0	112.2	A241 T242 E243 S248 I249	A241-A245 WeakPolarHBondContact O-CB 3.39Å; A241-A245 PolarHBondContact O-N 3.36Å; T242-A245 PolarHBondContact O-N 3.45Å; E243-A245 VanDerWaalsContact C-N 3.29Å; E243-A245 PolarHBondContact O-N 2.94Å; A245-S248 WeakPolarHBondContact O-CB 3.38Å; A245-S248 PolarHBondContact O-N 3.38Å; A245-I249 WeakPolarHBondContact O-CG1 3.45Å; A245-I249 PolarHBondContact O-N 2.88Å; A245-I249 VanDerWaalsContact O-N 3.08Å
246	K	90.5	Very high	88.6	Confident	135 Å²	135	92.5 Å²	92.5	59%	0.587	49%	0.492	S	S	*	.	H	α-helix	trans	-61.1	-47.1	174.1	-71.2	172.8	-176.9	175.1	0	111.4	T242 E243 S248 I249 E250	T242-K246 WeakPolarHBondContact O-CG 3.27Å; T242-K246 PolarHBondContact O-N 2.9Å; T242-K246 VanDerWaalsContact O-N 3.09Å; E243-K246 WeakPolarHBondContact O-CB 3.49Å; E243-K246 PolarHBondContact O-N 3.41Å; E243-K246 VanDerWaalsContact O-N 3.15Å; K246-S248 VanDerWaalsContact C-N 3.31Å; K246-S248 PolarHBondContact O-N 2.92Å; K246-I249 PolarHBondContact O-N 3.27Å; K246-I249 VanDerWaalsContact O-N 3.16Å; K246-E250 PolarHBondContact O-N 3.16Å; K246-E250 VanDerWaalsContact O-N 3.08Å
247	H	88.3	Confident	88.6	Confident	114 Å²	114	94.5 Å²	94.5	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-37.2	176.1	-76.6	-54.4	0	0	0	112.9	E243 A244 I249 E250 L251	E243-H247 PolarHBondContact O-CD2 3.29Å; E243-H247 PolarHBondContact O-N 3.35Å; A244-H247 PolarHBondContact O-N 3.08Å; H247-I249 VanDerWaalsContact C-N 3.31Å; H247-I249 PolarHBondContact O-N 3.08Å; H247-E250 IonicContact ND1-OE2 3.85Å; H247-E250 PolarHBondContact ND1-OE2 3.45Å; H247-E250 PolarHBondContact O-N 2.81Å; H247-L251 WeakPolarHBondContact O-CG 3.46Å; H247-L251 PolarHBondContact O-N 2.96Å
248	S	88.3	Confident	88.8	Confident	76 Å²	76	94.1 Å²	94.1	53%	0.531	50%	0.499	S	S	.	.	H	α-helix	trans	-61.8	-39.3	174.6	-171.7	0	0	0	0	112.1	A244 A245 K246 L251 Q252	A244-S248 WeakPolarHBondContact O-CB 3.4Å; A244-S248 PolarHBondContact O-N 3.49Å; A245-S248 WeakPolarHBondContact O-CB 3.38Å; A245-S248 PolarHBondContact O-N 3.38Å; K246-S248 VanDerWaalsContact C-N 3.31Å; K246-S248 PolarHBondContact O-N 2.92Å; S248-L251 PolarHBondContact O-N 3.27Å; S248-Q252 WeakPolarHBondContact O-CB 3.4Å; S248-Q252 PolarHBondContact O-N 3.06Å
249	I	90.6	Very high	89	Confident	91 Å²	91	94.1 Å²	94.1	47%	0.467	49%	0.493	S	S	.	.	H	α-helix	trans	-67.1	-40.4	176.5	-66.9	166	0	0	0	110.7	A245 K246 H247 Q252 R253	A245-I249 WeakPolarHBondContact O-CG1 3.45Å; A245-I249 PolarHBondContact O-N 2.88Å; A245-I249 VanDerWaalsContact O-N 3.08Å; K246-I249 PolarHBondContact O-N 3.27Å; K246-I249 VanDerWaalsContact O-N 3.16Å; H247-I249 VanDerWaalsContact C-N 3.31Å; H247-I249 PolarHBondContact O-N 3.08Å; I249-Q252 PolarHBondContact O-N 3.44Å; I249-R253 WeakPolarHBondContact O-CG 3.48Å; I249-R253 PolarHBondContact O-N 2.99Å
250	E	87.9	Confident	89.2	Confident	112 Å²	112	94.8 Å²	94.8	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-42.7	176	-70.3	174.7	170.4	0	0	112.2	K246 H247 R253 S254	K246-E250 PolarHBondContact O-N 3.16Å; K246-E250 VanDerWaalsContact O-N 3.08Å; H247-E250 IonicContact ND1-OE2 3.85Å; H247-E250 PolarHBondContact ND1-OE2 3.45Å; H247-E250 PolarHBondContact O-N 2.81Å; E250-R253 PolarHBondContact O-N 2.87Å; E250-S254 PolarHBondContact O-N 3.2Å
251	L	89.4	Confident	89.1	Confident	98 Å²	98	95.2 Å²	95.2	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-41.5	174.5	-75.9	172.3	0	0	0	111.7	H247 S248 R253 S254 N255	H247-L251 WeakPolarHBondContact O-CG 3.46Å; H247-L251 PolarHBondContact O-N 2.96Å; S248-L251 PolarHBondContact O-N 3.27Å; L251-R253 PolarHBondContact O-N 2.95Å; L251-S254 PolarHBondContact O-N 3.31Å; L251-N255 WeakPolarHBondContact O-CB 3.48Å; L251-N255 PolarHBondContact O-N 3.35Å
252	Q	91.3	Very high	89.1	Confident	102 Å²	102	95.2 Å²	95.2	48%	0.477	50%	0.495	S	S	.	.	H	α-helix	trans	-59.6	-47.2	175.2	-175	61.7	31.4	0	0	111	S248 I249 S254 N255 D256	S248-Q252 WeakPolarHBondContact O-CB 3.4Å; S248-Q252 PolarHBondContact O-N 3.06Å; I249-Q252 PolarHBondContact O-N 3.44Å; Q252-S254 VanDerWaalsContact C-N 3.29Å; Q252-S254 PolarHBondContact O-N 3.11Å; Q252-N255 WeakPolarHBondContact O-CB 3.45Å; Q252-N255 PolarHBondContact O-N 3.32Å; Q252-N255 VanDerWaalsContact O-N 3.11Å; Q252-D256 PolarHBondContact NE2-OD1 3.29Å; Q252-D256 PolarHBondContact O-N 3.22Å
253	R	90.8	Very high	89.1	Confident	163 Å²	163	95.3 Å²	95.3	62%	0.615	50%	0.495	S	S	*	.	H	α-helix	trans	-59.1	-40.1	175.9	-71.6	173.5	179	171.7	-0.2	112.3	I249 E250 L251 M257	I249-R253 WeakPolarHBondContact O-CG 3.48Å; I249-R253 PolarHBondContact O-N 2.99Å; E250-R253 PolarHBondContact O-N 2.87Å; L251-R253 PolarHBondContact O-N 2.95Å; R253-M257 WeakPolarHBondContact O-CG 3.43Å; R253-M257 PolarHBondContact O-N 3.29Å; R253-M257 VanDerWaalsContact O-N 3.1Å
254	S	88	Confident	89.3	Confident	54 Å²	54	95.2 Å²	95.2	38%	0.378	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-38.9	176.3	-168.1	0	0	0	0	112	E250 L251 Q252 M257 L258	E250-S254 PolarHBondContact O-N 3.2Å; L251-S254 PolarHBondContact O-N 3.31Å; Q252-S254 VanDerWaalsContact C-N 3.29Å; Q252-S254 PolarHBondContact O-N 3.11Å; S254-M257 PolarHBondContact O-N 2.86Å; S254-L258 PolarHBondContact O-N 2.86Å
255	N	92	Very high	89.4	Confident	77 Å²	77	96.3 Å²	96.3	41%	0.412	49%	0.492	S	S	.	.	H	α-helix	trans	-68.3	-40.1	177.8	-163.3	15.4	0	0	0	111.4	L251 Q252 M257 L258 N259	L251-N255 WeakPolarHBondContact O-CB 3.48Å; L251-N255 PolarHBondContact O-N 3.35Å; Q252-N255 WeakPolarHBondContact O-CB 3.45Å; Q252-N255 PolarHBondContact O-N 3.32Å; Q252-N255 VanDerWaalsContact O-N 3.11Å; N255-M257 VanDerWaalsContact C-N 3.32Å; N255-M257 PolarHBondContact O-N 3.47Å; N255-L258 WeakPolarHBondContact O-CB 3.38Å; N255-L258 PolarHBondContact O-N 3Å; N255-N259 WeakPolarHBondContact O-CB 3.28Å; N255-N259 PolarHBondContact O-N 2.82Å; N255-N259 PolarHBondContact O-ND2 3.33Å
256	D	90.6	Very high	89.5	Confident	71 Å²	71	101.5 Å²	101.5	38%	0.38	51%	0.505	S	S	.	.	H	α-helix	trans	-62.1	-41.2	175	-63.3	-21.8	0	0	0	111.1	Q252 N259 N260	Q252-D256 PolarHBondContact NE2-OD1 3.29Å; Q252-D256 PolarHBondContact O-N 3.22Å; D256-N259 PolarHBondContact O-N 3.01Å; D256-N260 VanDerWaalsContact O-CG 3.3Å; D256-N260 PolarHBondContact O-N 3.15Å; D256-N260 PolarHBondContact O-ND2 3.42Å
257	M	88.7	Confident	89.5	Confident	125 Å²	125	102.1 Å²	102.1	62%	0.616	51%	0.508	S	S	*	.	H	α-helix	trans	-62.2	-42.4	173.1	-75	-170.2	-72	0	0	112.6	R253 S254 N255 N260 Y261	R253-M257 WeakPolarHBondContact O-CG 3.43Å; R253-M257 PolarHBondContact O-N 3.29Å; R253-M257 VanDerWaalsContact O-N 3.1Å; S254-M257 PolarHBondContact O-N 2.86Å; N255-M257 VanDerWaalsContact C-N 3.32Å; N255-M257 PolarHBondContact O-N 3.47Å; M257-N260 PolarHBondContact O-N 3.41Å; M257-Y261 PolarHBondContact O-N 2.85Å
258	L	88.8	Confident	89.7	Confident	97 Å²	97	102.5 Å²	102.5	51%	0.508	51%	0.508	S	S	.	.	H	α-helix	trans	-64	-42.9	175.9	-84.2	159.5	0	0	0	111.9	S254 N255 N260 Y261 C262	S254-L258 PolarHBondContact O-N 2.86Å; N255-L258 WeakPolarHBondContact O-CB 3.38Å; N255-L258 PolarHBondContact O-N 3Å; L258-N260 VanDerWaalsContact C-N 3.32Å; L258-N260 PolarHBondContact O-N 2.86Å; L258-Y261 WeakPolarHBondContact O-CB 3.35Å; L258-Y261 PolarHBondContact O-N 3.31Å; L258-C262 PolarHBondContact O-N 2.84Å; L258-C262 PolarHBondContact O-SG 2.96Å
259	N	91	Very high	89.8	Confident	81 Å²	81	104.6 Å²	104.6	43%	0.433	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-43.6	176.3	-78.3	-34.2	0	0	0	111.3	N255 D256 Y261 C262 T263	N255-N259 WeakPolarHBondContact O-CB 3.28Å; N255-N259 PolarHBondContact O-N 2.82Å; N255-N259 PolarHBondContact O-ND2 3.33Å; D256-N259 PolarHBondContact O-N 3.01Å; N259-Y261 VanDerWaalsContact C-N 3.34Å; N259-Y261 PolarHBondContact O-N 3.36Å; N259-C262 PolarHBondContact O-N 3.35Å; N259-T263 WeakPolarHBondContact O-CG2 3.28Å; N259-T263 PolarHBondContact O-N 3.42Å; N259-T263 PolarHBondContact O-OG1 2.94Å
260	N	90.6	Very high	89.8	Confident	99 Å²	99	101.9 Å²	101.9	53%	0.529	51%	0.507	S	S	.	.	H	α-helix	trans	-58.2	-47.6	174.4	-70.5	-17.5	0	0	0	111	D256 M257 L258 C262 T263 E264	D256-N260 VanDerWaalsContact O-CG 3.3Å; D256-N260 PolarHBondContact O-N 3.15Å; D256-N260 PolarHBondContact O-ND2 3.42Å; M257-N260 PolarHBondContact O-N 3.41Å; L258-N260 VanDerWaalsContact C-N 3.32Å; L258-N260 PolarHBondContact O-N 2.86Å; N260-C262 VanDerWaalsContact C-N 3.35Å; N260-C262 PolarHBondContact O-N 2.93Å; N260-T263 WeakPolarHBondContact CA-OG1 3.36Å; N260-T263 PolarHBondContact O-N 3.43Å; N260-T263 VanDerWaalsContact O-N 3.13Å; N260-T263 PolarHBondContact O-OG1 3.35Å; N260-E264 PolarHBondContact O-N 3.25Å
261	Y	87.9	Confident	90	Very high	139 Å²	139	100.4 Å²	100.4	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-60.5	-41.7	176.6	-172.4	-106	0	0	0	112.8	M257 L258 N259 T263 E264 L265	M257-Y261 PolarHBondContact O-N 2.85Å; L258-Y261 WeakPolarHBondContact O-CB 3.35Å; L258-Y261 PolarHBondContact O-N 3.31Å; N259-Y261 VanDerWaalsContact C-N 3.34Å; N259-Y261 PolarHBondContact O-N 3.36Å; Y261-T263 VanDerWaalsContact C-N 3.34Å; Y261-T263 PolarHBondContact O-N 2.94Å; Y261-E264 PolarHBondContact O-N 2.99Å; Y261-L265 HydrophobicContact CD1-CD1 3.71Å; Y261-L265 HydrophobicContact CD1-CG 4.49Å; Y261-L265 HydrophobicContact CE1-CD1 3.38Å; Y261-L265 HydrophobicContact CE1-CG 4.16Å; Y261-L265 PolarHBondContact O-N 3.44Å
262	C	86.6	Confident	90	Very high	61 Å²	61	100.7 Å²	100.7	41%	0.412	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-36.5	174.7	-72.8	0	0	0	0	112.7	L258 N259 N260 L265 K266	L258-C262 PolarHBondContact O-N 2.84Å; L258-C262 PolarHBondContact O-SG 2.96Å; N259-C262 PolarHBondContact O-N 3.35Å; N260-C262 VanDerWaalsContact C-N 3.35Å; N260-C262 PolarHBondContact O-N 2.93Å; C262-L265 PolarHBondContact O-N 2.94Å; C262-K266 WeakPolarHBondContact O-CG 3.32Å; C262-K266 PolarHBondContact O-N 2.91Å
263	T	89.9	Confident	90	Very high	82 Å²	82	101 Å²	101	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-66.9	-39.8	174.8	56.6	0	0	0	0	112.1	N259 N260 Y261 K266 K267	N259-T263 WeakPolarHBondContact O-CG2 3.28Å; N259-T263 PolarHBondContact O-N 3.42Å; N259-T263 PolarHBondContact O-OG1 2.94Å; N260-T263 WeakPolarHBondContact CA-OG1 3.36Å; N260-T263 PolarHBondContact O-N 3.43Å; N260-T263 VanDerWaalsContact O-N 3.13Å; N260-T263 PolarHBondContact O-OG1 3.35Å; Y261-T263 VanDerWaalsContact C-N 3.34Å; Y261-T263 PolarHBondContact O-N 2.94Å; T263-K266 PolarHBondContact O-N 3.34Å; T263-K267 PolarHBondContact O-N 3.41Å
264	E	90.5	Very high	90	Very high	112 Å²	112	98.5 Å²	98.5	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-62.3	-43.4	173.7	-71.3	-175.8	174.5	0	0	111.7	N260 Y261 K267 K268	N260-E264 PolarHBondContact O-N 3.25Å; Y261-E264 PolarHBondContact O-N 2.99Å; E264-K267 WeakPolarHBondContact O-CB 3.37Å; E264-K267 PolarHBondContact O-N 2.85Å; E264-K268 WeakPolarHBondContact O-CG 3.45Å; E264-K268 PolarHBondContact O-N 3.04Å
265	L	87.9	Confident	90	Very high	83 Å²	83	100.9 Å²	100.9	44%	0.435	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-43	175.3	-81.5	167.5	0	0	0	112.4	Y261 C262 K267 K268 L269	Y261-L265 HydrophobicContact CD1-CD1 3.71Å; Y261-L265 HydrophobicContact CD1-CG 4.49Å; Y261-L265 HydrophobicContact CE1-CD1 3.38Å; Y261-L265 HydrophobicContact CE1-CG 4.16Å; Y261-L265 PolarHBondContact O-N 3.44Å; C262-L265 PolarHBondContact O-N 2.94Å; L265-K267 VanDerWaalsContact C-N 3.31Å; L265-K267 PolarHBondContact O-N 3.37Å; L265-K268 PolarHBondContact O-N 2.97Å; L265-L269 WeakPolarHBondContact O-CB 3.35Å; L265-L269 PolarHBondContact O-N 3.29Å
266	K	90.2	Very high	89.9	Confident	160 Å²	160	101.9 Å²	101.9	70%	0.696	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-40.4	175.3	-79.3	-178.2	179.8	-179.7	0	111.8	C262 T263 L269 G270	C262-K266 WeakPolarHBondContact O-CG 3.32Å; C262-K266 PolarHBondContact O-N 2.91Å; T263-K266 PolarHBondContact O-N 3.34Å; K266-L269 PolarHBondContact O-N 3.23Å; K266-G270 PolarHBondContact O-N 2.91Å
267	K	91.2	Very high	89.8	Confident	147 Å²	147	102.2 Å²	102.2	64%	0.639	51%	0.513	S	S	*	.	H	α-helix	trans	-61.7	-50.3	175.4	-171.4	-178.5	177.3	-176.2	0	110.8	T263 E264 L265 L269 G270 D271	T263-K267 PolarHBondContact O-N 3.41Å; E264-K267 WeakPolarHBondContact O-CB 3.37Å; E264-K267 PolarHBondContact O-N 2.85Å; L265-K267 VanDerWaalsContact C-N 3.31Å; L265-K267 PolarHBondContact O-N 3.37Å; K267-L269 VanDerWaalsContact C-N 3.27Å; K267-L269 PolarHBondContact O-N 3.49Å; K267-G270 WeakPolarHBondContact O-CA 3.33Å; K267-G270 PolarHBondContact O-N 3.29Å; K267-D271 VanDerWaalsContact O-CG 3.3Å; K267-D271 PolarHBondContact O-N 3.37Å
268	K	91.9	Very high	89.8	Confident	122 Å²	122	103.7 Å²	103.7	53%	0.53	51%	0.511	S	S	.	.	H	α-helix	trans	-57.5	-38.9	175.9	-71.1	-178.4	-178.7	-178.3	0	112.4	E264 L265 D271 L272	E264-K268 WeakPolarHBondContact O-CG 3.45Å; E264-K268 PolarHBondContact O-N 3.04Å; L265-K268 PolarHBondContact O-N 2.97Å; K268-D271 PolarHBondContact O-N 3.47Å; K268-L272 WeakPolarHBondContact O-CG 3.4Å; K268-L272 PolarHBondContact O-N 2.67Å
269	L	89.3	Confident	89.7	Confident	120 Å²	120	104 Å²	104	63%	0.628	51%	0.511	S	S	*	.	H	α-helix	trans	-66.3	-39.6	175.7	-175.1	65.1	0	0	0	112	L265 K266 K267 L272 H273	L265-L269 WeakPolarHBondContact O-CB 3.35Å; L265-L269 PolarHBondContact O-N 3.29Å; K266-L269 PolarHBondContact O-N 3.23Å; K267-L269 VanDerWaalsContact C-N 3.27Å; K267-L269 PolarHBondContact O-N 3.49Å; L269-L272 PolarHBondContact O-N 3.47Å; L269-H273 WeakPolarHBondContact O-CB 3.34Å; L269-H273 PolarHBondContact O-N 3.15Å
270	G	91.7	Very high	89.4	Confident	34 Å²	34	103.5 Å²	103.5	35%	0.351	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-47.2	173.3	0	0	0	0	0	112.1	K266 K267 L272 H273 E274	K266-G270 PolarHBondContact O-N 2.91Å; K267-G270 WeakPolarHBondContact O-CA 3.33Å; K267-G270 PolarHBondContact O-N 3.29Å; G270-L272 VanDerWaalsContact C-N 3.33Å; G270-L272 PolarHBondContact O-N 3.1Å; G270-H273 PolarHBondContact O-N 3.09Å; G270-H273 VanDerWaalsContact O-N 3.1Å; G270-E274 PolarHBondContact O-N 3.36Å
271	D	91.2	Very high	89.2	Confident	82 Å²	82	103.4 Å²	103.4	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-58.2	-45	177.7	-62	-24.4	0	0	0	111.1	K267 K268 H273 E274 E275	K267-D271 VanDerWaalsContact O-CG 3.3Å; K267-D271 PolarHBondContact O-N 3.37Å; K268-D271 PolarHBondContact O-N 3.47Å; D271-H273 PolarHBondContact O-N 3.14Å; D271-E274 PolarHBondContact O-N 2.65Å; D271-E275 PolarHBondContact O-N 3.41Å
272	L	89.7	Confident	89.2	Confident	104 Å²	104	105 Å²	105	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-36.5	175.9	-74.2	172.3	0	0	0	112.7	K268 L269 G270 E275 L276	K268-L272 WeakPolarHBondContact O-CG 3.4Å; K268-L272 PolarHBondContact O-N 2.67Å; L269-L272 PolarHBondContact O-N 3.47Å; G270-L272 VanDerWaalsContact C-N 3.33Å; G270-L272 PolarHBondContact O-N 3.1Å; L272-E275 PolarHBondContact O-N 3.19Å; L272-L276 WeakPolarHBondContact O-CB 3.36Å; L272-L276 PolarHBondContact O-N 3Å
273	H	91.1	Very high	89.1	Confident	109 Å²	109	107 Å²	107	51%	0.505	52%	0.524	S	S	.	.	H	α-helix	trans	-68.7	-40	177.3	-170.5	71.8	0	0	0	111.7	L269 G270 D271 L276 N277	L269-H273 WeakPolarHBondContact O-CB 3.34Å; L269-H273 PolarHBondContact O-N 3.15Å; G270-H273 PolarHBondContact O-N 3.09Å; G270-H273 VanDerWaalsContact O-N 3.1Å; D271-H273 PolarHBondContact O-N 3.14Å; H273-L276 PolarHBondContact O-N 3.37Å; H273-N277 PolarHBondContact NE2-ND2 3.1Å; H273-N277 PolarHBondContact O-N 2.85Å
274	E	90.8	Very high	89	Confident	109 Å²	109	107.9 Å²	107.9	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-63.9	-40.1	171.9	-73.5	-171.5	177.8	0	0	112.3	G270 D271 L276 N277 R278	G270-E274 PolarHBondContact O-N 3.36Å; D271-E274 PolarHBondContact O-N 2.65Å; E274-L276 VanDerWaalsContact C-N 3.35Å; E274-N277 PolarHBondContact O-N 3.33Å; E274-R278 WeakPolarHBondContact O-CB 3.44Å; E274-R278 WeakPolarHBondContact O-CG 3.38Å; E274-R278 PolarHBondContact O-N 2.93Å; E274-R278 PolarHBondContact O-NE 2.94Å; E274-R278 IonicContact OE2-NH2 2.65Å; E274-R278 PolarHBondContact OE2-NH2 2.87Å
275	E	89.2	Confident	88.7	Confident	105 Å²	105	108.2 Å²	108.2	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-44.1	174.6	-172.4	171	-162.8	0	0	111.3	D271 L272 N277 R278 M279	D271-E275 PolarHBondContact O-N 3.41Å; L272-E275 PolarHBondContact O-N 3.19Å; E275-N277 PolarHBondContact O-N 3.39Å; E275-R278 PolarHBondContact O-N 3.04Å; E275-M279 WeakPolarHBondContact O-CG 3.46Å; E275-M279 PolarHBondContact O-N 3.46Å
276	L	88.9	Confident	88.5	Confident	98 Å²	98	108.9 Å²	108.9	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-60.8	-44.2	175.1	-174.5	65.1	0	0	0	112	L272 H273 E274 M279 S280	L272-L276 WeakPolarHBondContact O-CB 3.36Å; L272-L276 PolarHBondContact O-N 3Å; H273-L276 PolarHBondContact O-N 3.37Å; E274-L276 VanDerWaalsContact C-N 3.35Å; L276-M279 HydrophobicContact CD1-CE 4.08Å; L276-M279 PolarHBondContact O-N 3.38Å; L276-S280 WeakPolarHBondContact O-CB 3.46Å; L276-S280 PolarHBondContact O-N 2.92Å
277	N	89	Confident	88.2	Confident	78 Å²	78	104.3 Å²	104.3	42%	0.417	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-42.3	176.7	-78.9	-22	0	0	0	111.9	H273 E274 E275 M279 S280 I281	H273-N277 PolarHBondContact NE2-ND2 3.1Å; H273-N277 PolarHBondContact O-N 2.85Å; E274-N277 PolarHBondContact O-N 3.33Å; E275-N277 PolarHBondContact O-N 3.39Å; N277-M279 VanDerWaalsContact C-N 3.33Å; N277-M279 PolarHBondContact O-N 2.67Å; N277-S280 WeakPolarHBondContact O-CB 3.46Å; N277-S280 PolarHBondContact O-N 2.68Å; N277-I281 WeakPolarHBondContact O-CG1 3.42Å; N277-I281 PolarHBondContact O-N 3.28Å
278	R	88.7	Confident	87.8	Confident	155 Å²	155	105.2 Å²	105.2	59%	0.585	52%	0.516	S	S	*	.	H	α-helix	trans	-59.4	-43.9	174	-78.7	-177	-89.5	-136.7	-8.2	111.8	E274 E275 R282	E274-R278 WeakPolarHBondContact O-CB 3.44Å; E274-R278 WeakPolarHBondContact O-CG 3.38Å; E274-R278 PolarHBondContact O-N 2.93Å; E274-R278 PolarHBondContact O-NE 2.94Å; E274-R278 IonicContact OE2-NH2 2.65Å; E274-R278 PolarHBondContact OE2-NH2 2.87Å; E275-R278 PolarHBondContact O-N 3.04Å; R278-R282 WeakPolarHBondContact O-CB 3.45Å; R278-R282 PolarHBondContact O-N 2.9Å; R278-R282 VanDerWaalsContact O-N 3.09Å
279	M	86.3	Confident	87.4	Confident	103 Å²	103	103.7 Å²	103.7	51%	0.507	51%	0.51	S	S	.	.	H	α-helix	trans	-64.8	-39.4	175.5	-71.5	-167.1	-62.7	0	0	112.2	E275 L276 N277 R282 N283	E275-M279 WeakPolarHBondContact O-CG 3.46Å; E275-M279 PolarHBondContact O-N 3.46Å; L276-M279 HydrophobicContact CD1-CE 4.08Å; L276-M279 PolarHBondContact O-N 3.38Å; N277-M279 VanDerWaalsContact C-N 3.33Å; N277-M279 PolarHBondContact O-N 2.67Å; M279-R282 PolarHBondContact O-N 3.44Å; M279-N283 WeakPolarHBondContact O-CB 3.14Å; M279-N283 PolarHBondContact O-N 2.96Å
280	S	86	Confident	87.1	Confident	72 Å²	72	103 Å²	103	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-62.1	-47.2	177.3	-170.1	0	0	0	0	111.9	L276 N277 N283 E284	L276-S280 WeakPolarHBondContact O-CB 3.46Å; L276-S280 PolarHBondContact O-N 2.92Å; N277-S280 WeakPolarHBondContact O-CB 3.46Å; N277-S280 PolarHBondContact O-N 2.68Å; S280-N283 WeakPolarHBondContact O-CB 3.47Å; S280-N283 PolarHBondContact O-N 3.5Å; S280-E284 PolarHBondContact O-N 3.1Å
281	I	86.6	Confident	86.8	Confident	97 Å²	97	107.6 Å²	107.6	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-60.1	-48.2	176.8	-66.4	166.2	0	0	0	110.3	N277 N283 E284 E285	N277-I281 WeakPolarHBondContact O-CG1 3.42Å; N277-I281 PolarHBondContact O-N 3.28Å; I281-N283 PolarHBondContact O-N 3.18Å; I281-E284 WeakPolarHBondContact O-CB 3.36Å; I281-E284 PolarHBondContact O-N 3.45Å; I281-E284 VanDerWaalsContact O-N 3.1Å; I281-E285 WeakPolarHBondContact O-CG 3.48Å; I281-E285 PolarHBondContact O-N 3.04Å
282	R	86.4	Confident	86.4	Confident	173 Å²	173	108.7 Å²	108.7	65%	0.653	53%	0.525	S	S	*	.	H	α-helix	trans	-59	-38	177	-176.1	179.7	-76.3	172.1	-4.6	111.9	R278 M279 E285 L286	R278-R282 WeakPolarHBondContact O-CB 3.45Å; R278-R282 PolarHBondContact O-N 2.9Å; R278-R282 VanDerWaalsContact O-N 3.09Å; M279-R282 PolarHBondContact O-N 3.44Å; R282-E285 PolarHBondContact O-N 3.36Å; R282-L286 HydrophobicContact CG-CD1 4.22Å; R282-L286 WeakPolarHBondContact O-CB 3.48Å; R282-L286 VanDerWaalsContact O-CG 3.31Å; R282-L286 WeakPolarHBondContact O-CG 3.49Å; R282-L286 PolarHBondContact O-N 3.29Å
283	N	85.9	Confident	85.9	Confident	102 Å²	102	105.8 Å²	105.8	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-69.1	-35.5	177.9	-162.2	37.5	0	0	0	112.1	M279 S280 I281 S287	M279-N283 WeakPolarHBondContact O-CB 3.14Å; M279-N283 PolarHBondContact O-N 2.96Å; S280-N283 WeakPolarHBondContact O-CB 3.47Å; S280-N283 PolarHBondContact O-N 3.5Å; I281-N283 PolarHBondContact O-N 3.18Å; N283-S287 WeakPolarHBondContact O-CB 3.4Å; N283-S287 PolarHBondContact O-N 3.34Å; N283-S287 PolarHBondContact O-OG 2.98Å
284	E	86.9	Confident	85.5	Confident	101 Å²	101	104.7 Å²	104.7	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-67.2	-43.1	173.2	-164.5	-175.8	158.8	0	0	111.7	S280 I281 S287 R288	S280-E284 PolarHBondContact O-N 3.1Å; I281-E284 WeakPolarHBondContact O-CB 3.36Å; I281-E284 PolarHBondContact O-N 3.45Å; I281-E284 VanDerWaalsContact O-N 3.1Å; E284-S287 WeakPolarHBondContact O-CB 3.4Å; E284-S287 PolarHBondContact O-N 3.07Å; E284-S287 VanDerWaalsContact O-N 3.15Å; E284-R288 WeakPolarHBondContact O-CG 3.03Å; E284-R288 PolarHBondContact O-N 3.35Å; E284-R288 IonicContact OE1-CZ 3.25Å; E284-R288 IonicContact OE1-NE 2.7Å; E284-R288 IonicContact OE1-NH2 3.84Å; E284-R288 PolarHBondContact OE1-NH2 3.48Å
285	E	83.6	Confident	85	Confident	118 Å²	118	102.3 Å²	102.3	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-58.6	-48.2	173.4	-71.1	172.5	169.2	0	0	111.6	I281 R282 S287 R288 E289	I281-E285 WeakPolarHBondContact O-CG 3.48Å; I281-E285 PolarHBondContact O-N 3.04Å; R282-E285 PolarHBondContact O-N 3.36Å; E285-S287 VanDerWaalsContact C-N 3.25Å; E285-S287 PolarHBondContact O-N 2.95Å; E285-R288 PolarHBondContact O-N 3.49Å; E285-R288 VanDerWaalsContact O-N 3.15Å; E285-E289 PolarHBondContact O-N 3.47Å
286	L	84.1	Confident	84.4	Confident	98 Å²	98	101.5 Å²	101.5	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-58.7	-38.4	174.4	-77.3	165	0	0	0	111.8	R282 E289 L290	R282-L286 HydrophobicContact CG-CD1 4.22Å; R282-L286 WeakPolarHBondContact O-CB 3.48Å; R282-L286 VanDerWaalsContact O-CG 3.31Å; R282-L286 WeakPolarHBondContact O-CG 3.49Å; R282-L286 PolarHBondContact O-N 3.29Å; L286-E289 PolarHBondContact O-N 3.49Å; L286-L290 WeakPolarHBondContact O-CB 3.35Å; L286-L290 WeakPolarHBondContact O-CG 3.45Å; L286-L290 PolarHBondContact O-N 3.01Å
287	S	83	Confident	83.7	Confident	64 Å²	64	102.8 Å²	102.8	45%	0.448	51%	0.508	S	S	.	.	H	α-helix	trans	-67.4	-38.1	177.1	-59.3	0	0	0	0	112.1	N283 E284 E285 L291	N283-S287 WeakPolarHBondContact O-CB 3.4Å; N283-S287 PolarHBondContact O-N 3.34Å; N283-S287 PolarHBondContact O-OG 2.98Å; E284-S287 WeakPolarHBondContact O-CB 3.4Å; E284-S287 PolarHBondContact O-N 3.07Å; E284-S287 VanDerWaalsContact O-N 3.15Å; E285-S287 VanDerWaalsContact C-N 3.25Å; E285-S287 PolarHBondContact O-N 2.95Å; S287-L291 PolarHBondContact O-N 3.32Å; S287-L291 VanDerWaalsContact O-N 3.09Å
288	R	84.6	Confident	83.3	Confident	166 Å²	166	106.3 Å²	106.3	63%	0.626	52%	0.52	S	S	*	.	H	α-helix	trans	-67.5	-42	174.3	-69.4	179	-169.6	-175.6	4.8	111.9	E284 E285 L291 H292	E284-R288 WeakPolarHBondContact O-CG 3.03Å; E284-R288 PolarHBondContact O-N 3.35Å; E284-R288 IonicContact OE1-CZ 3.25Å; E284-R288 IonicContact OE1-NE 2.7Å; E284-R288 IonicContact OE1-NH2 3.84Å; E284-R288 PolarHBondContact OE1-NH2 3.48Å; E285-R288 PolarHBondContact O-N 3.49Å; E285-R288 VanDerWaalsContact O-N 3.15Å; R288-L291 WeakPolarHBondContact O-CB 3.42Å; R288-L291 PolarHBondContact O-N 2.88Å; R288-H292 PolarHBondContact O-N 2.92Å
289	E	82.7	Confident	82.5	Confident	89 Å²	89	102.1 Å²	102.1	42%	0.416	51%	0.514	S	S	.	.	H	α-helix	trans	-62.6	-45.4	176.4	-176	60.7	-153.2	0	0	111.2	E285 L286 L291 H292 Q293	E285-E289 PolarHBondContact O-N 3.47Å; L286-E289 PolarHBondContact O-N 3.49Å; E289-L291 VanDerWaalsContact C-N 3.28Å; E289-L291 PolarHBondContact O-N 3.33Å; E289-H292 WeakPolarHBondContact O-CB 3.49Å; E289-H292 PolarHBondContact O-N 3.12Å; E289-H292 VanDerWaalsContact O-N 3.15Å; E289-Q293 WeakPolarHBondContact O-CG 3.37Å; E289-Q293 PolarHBondContact O-N 3.25Å; E289-Q293 PolarHBondContact OE1-NE2 3.3Å
290	L	83.4	Confident	81.7	Confident	105 Å²	105	98.8 Å²	98.8	55%	0.55	50%	0.5	S	S	.	.	H	α-helix	trans	-58.9	-39.6	174.2	-79.3	169.5	0	0	0	112.2	L286 T294	L286-L290 WeakPolarHBondContact O-CB 3.35Å; L286-L290 WeakPolarHBondContact O-CG 3.45Å; L286-L290 PolarHBondContact O-N 3.01Å; L290-T294 WeakPolarHBondContact O-CB 3.44Å; L290-T294 PolarHBondContact O-N 3.45Å; L290-T294 PolarHBondContact O-OG1 3.45Å
291	L	84.3	Confident	81	Confident	131 Å²	131	100.9 Å²	100.9	69%	0.686	51%	0.505	S	S	*	.	H	α-helix	trans	-64.8	-42.6	175.8	-167.1	108.2	0	0	0	111.6	S287 R288 E289 T294 A295	S287-L291 PolarHBondContact O-N 3.32Å; S287-L291 VanDerWaalsContact O-N 3.09Å; R288-L291 WeakPolarHBondContact O-CB 3.42Å; R288-L291 PolarHBondContact O-N 2.88Å; E289-L291 VanDerWaalsContact C-N 3.28Å; E289-L291 PolarHBondContact O-N 3.33Å; L291-T294 PolarHBondContact O-N 2.96Å; L291-A295 PolarHBondContact O-N 3.41Å
292	H	82.4	Confident	80.3	Confident	105 Å²	105	99.6 Å²	99.6	49%	0.486	50%	0.502	S	S	.	.	H	α-helix	trans	-61	-49	176.4	-172.3	-82.4	0	0	0	111.3	R288 E289 T294 A295 E296	R288-H292 PolarHBondContact O-N 2.92Å; E289-H292 WeakPolarHBondContact O-CB 3.49Å; E289-H292 PolarHBondContact O-N 3.12Å; E289-H292 VanDerWaalsContact O-N 3.15Å; H292-T294 VanDerWaalsContact C-N 3.3Å; H292-T294 PolarHBondContact O-N 3.49Å; H292-A295 WeakPolarHBondContact O-CB 3.38Å; H292-A295 PolarHBondContact O-N 3.28Å; H292-A295 VanDerWaalsContact O-N 3.11Å; H292-E296 VanDerWaalsContact CE1-CD 3.49Å; H292-E296 IonicContact CE1-OE1 3.6Å; H292-E296 PolarHBondContact CE1-OE1 3.47Å; H292-E296 VanDerWaalsContact CE1-OE1 3.25Å; H292-E296 IonicContact ND1-OE1 2.68Å; H292-E296 IonicContact ND1-OE2 2.8Å; H292-E296 PolarHBondContact O-N 3.42Å
293	Q	80.2	Confident	79.2	Confident	43 Å²	43	94.8 Å²	94.8	20%	0.201	49%	0.485	C	S	.	.	H	α-helix	trans	-60.7	-40	176.6	-70.3	178.6	5.2	0	0	111.9	E289 A295 E296 Q297	E289-Q293 WeakPolarHBondContact O-CG 3.37Å; E289-Q293 PolarHBondContact O-N 3.25Å; E289-Q293 PolarHBondContact OE1-NE2 3.3Å; Q293-A295 VanDerWaalsContact C-N 3.32Å; Q293-A295 PolarHBondContact O-N 3.21Å; Q293-E296 PolarHBondContact O-N 3.38Å; Q293-Q297 WeakPolarHBondContact O-CB 3.35Å; Q293-Q297 VanDerWaalsContact O-CG 3.29Å; Q293-Q297 WeakPolarHBondContact O-CG 3.32Å; Q293-Q297 PolarHBondContact O-N 3Å
294	T	82	Confident	78.1	Confident	86 Å²	86	95.4 Å²	95.4	53%	0.528	49%	0.488	S	S	.	.	H	α-helix	trans	-63.9	-39	175.8	-55.3	0	0	0	0	111.4	L290 L291 H292 K298	L290-T294 WeakPolarHBondContact O-CB 3.44Å; L290-T294 PolarHBondContact O-N 3.45Å; L290-T294 PolarHBondContact O-OG1 3.45Å; L291-T294 PolarHBondContact O-N 2.96Å; H292-T294 VanDerWaalsContact C-N 3.3Å; H292-T294 PolarHBondContact O-N 3.49Å; T294-K298 WeakPolarHBondContact O-CB 3.43Å; T294-K298 PolarHBondContact O-N 2.93Å
295	A	80.2	Confident	76.9	Confident	60 Å²	60	94.1 Å²	94.1	50%	0.496	50%	0.495	S	S	.	.	H	α-helix	trans	-67.4	-42	176.1	0	0	0	0	0	112.1	L291 H292 Q293 K298 S299	L291-A295 PolarHBondContact O-N 3.41Å; H292-A295 WeakPolarHBondContact O-CB 3.38Å; H292-A295 PolarHBondContact O-N 3.28Å; H292-A295 VanDerWaalsContact O-N 3.11Å; Q293-A295 VanDerWaalsContact C-N 3.32Å; Q293-A295 PolarHBondContact O-N 3.21Å; A295-K298 WeakPolarHBondContact O-CB 3.47Å; A295-K298 PolarHBondContact O-N 3.14Å; A295-S299 PolarHBondContact O-N 2.86Å
296	E	76.8	Confident	75.7	Confident	88 Å²	88	94 Å²	94	41%	0.411	50%	0.498	S	S	.	.	H	α-helix	trans	-62	-49.2	174.1	-77.5	-173	151.2	0	0	111.5	H292 Q293 K298 S299 V300	H292-E296 VanDerWaalsContact CE1-CD 3.49Å; H292-E296 IonicContact CE1-OE1 3.6Å; H292-E296 PolarHBondContact CE1-OE1 3.47Å; H292-E296 VanDerWaalsContact CE1-OE1 3.25Å; H292-E296 IonicContact ND1-OE1 2.68Å; H292-E296 IonicContact ND1-OE2 2.8Å; H292-E296 PolarHBondContact O-N 3.42Å; Q293-E296 PolarHBondContact O-N 3.38Å; E296-K298 VanDerWaalsContact C-N 3.27Å; E296-K298 PolarHBondContact O-N 2.96Å; E296-S299 CarbonylContact O-C 3.56Å; E296-S299 WeakPolarHBondContact O-CA 3.43Å; E296-S299 WeakPolarHBondContact O-CB 3.38Å; E296-S299 PolarHBondContact O-N 3.48Å; E296-S299 PolarHBondContact O-OG 3.4Å; E296-V300 WeakPolarHBondContact O-CG2 3.31Å; E296-V300 PolarHBondContact O-N 3.02Å
297	Q	75.6	Confident	74.1	Confident	125 Å²	125	98.4 Å²	98.4	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-56.4	-42.1	175.6	-75.8	178.2	-3	0	0	111.6	Q293 S299 V300 L301	Q293-Q297 WeakPolarHBondContact O-CB 3.35Å; Q293-Q297 VanDerWaalsContact O-CG 3.29Å; Q293-Q297 WeakPolarHBondContact O-CG 3.32Å; Q293-Q297 PolarHBondContact O-N 3Å; Q297-S299 VanDerWaalsContact C-N 3.33Å; Q297-S299 PolarHBondContact O-N 2.89Å; Q297-V300 PolarHBondContact O-N 2.93Å; Q297-L301 WeakPolarHBondContact O-CB 3.41Å; Q297-L301 VanDerWaalsContact O-CG 3.32Å; Q297-L301 WeakPolarHBondContact O-CG 3.38Å; Q297-L301 PolarHBondContact O-N 3.06Å
298	K	79.5	Confident	72.6	Confident	151 Å²	151	101.8 Å²	101.8	66%	0.657	53%	0.526	S	S	*	.	H	α-helix	trans	-61.3	-41.1	173.6	-175	-179.9	177.9	-178.3	0	111.6	T294 A295 E296 L301 T302	T294-K298 WeakPolarHBondContact O-CB 3.43Å; T294-K298 PolarHBondContact O-N 2.93Å; A295-K298 WeakPolarHBondContact O-CB 3.47Å; A295-K298 PolarHBondContact O-N 3.14Å; E296-K298 VanDerWaalsContact C-N 3.27Å; E296-K298 PolarHBondContact O-N 2.96Å; K298-L301 PolarHBondContact O-N 3.24Å; K298-T302 WeakPolarHBondContact O-CB 3.39Å; K298-T302 PolarHBondContact O-N 3.01Å; K298-T302 PolarHBondContact O-OG1 2.98Å
299	S	73.1	Confident	71.2	Confident	67 Å²	67	99.5 Å²	99.5	47%	0.469	53%	0.531	S	S	.	.	H	α-helix	trans	-63.6	-42.6	176.1	91.3	0	0	0	0	111.9	A295 E296 Q297 T302 F303	A295-S299 PolarHBondContact O-N 2.86Å; E296-S299 CarbonylContact O-C 3.56Å; E296-S299 WeakPolarHBondContact O-CA 3.43Å; E296-S299 WeakPolarHBondContact O-CB 3.38Å; E296-S299 PolarHBondContact O-N 3.48Å; E296-S299 PolarHBondContact O-OG 3.4Å; Q297-S299 VanDerWaalsContact C-N 3.33Å; Q297-S299 PolarHBondContact O-N 2.89Å; S299-T302 WeakPolarHBondContact O-CB 3.43Å; S299-T302 PolarHBondContact O-N 3.17Å; S299-F303 WeakPolarHBondContact O-CB 3.39Å; S299-F303 PolarHBondContact O-N 3.31Å
300	V	68.4	Low	69.7	Low	33 Å²	33	104 Å²	104	20%	0.2	55%	0.552	C	S	.	*	H	α-helix	trans	-64.5	-45.6	177.4	175.6	0	0	0	0	110.7	E296 Q297 T302 F303 L304 F319	E296-V300 WeakPolarHBondContact O-CG2 3.31Å; E296-V300 PolarHBondContact O-N 3.02Å; Q297-V300 PolarHBondContact O-N 2.93Å; V300-T302 VanDerWaalsContact C-N 3.27Å; V300-T302 PolarHBondContact O-N 3.29Å; V300-F303 WeakPolarHBondContact O-CB 3.47Å; V300-F303 PolarHBondContact O-N 3Å; V300-L304 HydrophobicContact CG1-CD1 3.93Å; V300-L304 HydrophobicContact CG1-CG 4.33Å; V300-L304 WeakPolarHBondContact O-CB 3.39Å; V300-L304 WeakPolarHBondContact O-CG 3.47Å; V300-L304 PolarHBondContact O-N 3.38Å; V300-F319 HydrophobicContact CG2-CD1 3.77Å; V300-F319 HydrophobicContact CG2-CE1 3.2Å; V300-F319 HydrophobicContact CG2-CZ 3.74Å
301	L	70.8	Confident	68.1	Low	117 Å²	117	104.5 Å²	104.5	61%	0.613	55%	0.553	S	S	*	*	H	α-helix	trans	-61	-38.8	175.2	-75	168.2	0	0	0	111.5	Q297 K298 L304 A305	Q297-L301 WeakPolarHBondContact O-CB 3.41Å; Q297-L301 VanDerWaalsContact O-CG 3.32Å; Q297-L301 WeakPolarHBondContact O-CG 3.38Å; Q297-L301 PolarHBondContact O-N 3.06Å; K298-L301 PolarHBondContact O-N 3.24Å; L301-L304 PolarHBondContact O-N 3Å; L301-A305 VanDerWaalsContact O-CB 3.29Å; L301-A305 WeakPolarHBondContact O-CB 3.41Å; L301-A305 PolarHBondContact O-N 3.48Å
302	T	71.6	Confident	66.5	Low	70 Å²	70	104.7 Å²	104.7	43%	0.429	55%	0.548	S	S	.	.	H	α-helix	trans	-67.3	-39.9	175.7	-50.5	0	0	0	0	111.3	K298 S299 V300 A305 N306	K298-T302 WeakPolarHBondContact O-CB 3.39Å; K298-T302 PolarHBondContact O-N 3.01Å; K298-T302 PolarHBondContact O-OG1 2.98Å; S299-T302 WeakPolarHBondContact O-CB 3.43Å; S299-T302 PolarHBondContact O-N 3.17Å; V300-T302 VanDerWaalsContact C-N 3.27Å; V300-T302 PolarHBondContact O-N 3.29Å; T302-A305 PolarHBondContact O-N 3.08Å; T302-N306 WeakPolarHBondContact O-CB 3.34Å; T302-N306 PolarHBondContact O-N 3.31Å
303	F	64.3	Low	65.2	Low	71 Å²	71	105.4 Å²	105.4	31%	0.311	56%	0.56	S	S	.	*	H	α-helix	trans	-64.3	-45.2	174.4	176.4	-95.3	0	0	0	112	S299 V300 A305 N306 M311	S299-F303 WeakPolarHBondContact O-CB 3.39Å; S299-F303 PolarHBondContact O-N 3.31Å; V300-F303 WeakPolarHBondContact O-CB 3.47Å; V300-F303 PolarHBondContact O-N 3Å; F303-A305 VanDerWaalsContact C-N 3.31Å; F303-A305 PolarHBondContact O-N 3.47Å; F303-N306 CarbonylContact O-C 3.54Å; F303-N306 PolarHBondContact O-N 2.97Å; F303-M311 HydrophobicContact CE2-CB 4.27Å; F303-M311 HydrophobicContact CZ-CB 3.95Å
304	L	62.4	Low	64.1	Low	115 Å²	115	112 Å²	112	60%	0.602	59%	0.588	S	S	*	*	H	α-helix	trans	-65.6	-33.4	176.4	-71.4	172.2	0	0	0	112.3	V300 L301	V300-L304 HydrophobicContact CG1-CD1 3.93Å; V300-L304 HydrophobicContact CG1-CG 4.33Å; V300-L304 WeakPolarHBondContact O-CB 3.39Å; V300-L304 WeakPolarHBondContact O-CG 3.47Å; V300-L304 PolarHBondContact O-N 3.38Å; L301-L304 PolarHBondContact O-N 3Å
305	A	62.6	Low	62.9	Low	75 Å²	75	111.5 Å²	111.5	62%	0.62	58%	0.579	S	S	*	*	H	α-helix	trans	-70	-35.3	173.9	0	0	0	0	0	112.4	L301 T302 F303 K307	L301-A305 VanDerWaalsContact O-CB 3.29Å; L301-A305 WeakPolarHBondContact O-CB 3.41Å; L301-A305 PolarHBondContact O-N 3.48Å; T302-A305 PolarHBondContact O-N 3.08Å; F303-A305 VanDerWaalsContact C-N 3.31Å; F303-A305 PolarHBondContact O-N 3.47Å; A305-K307 VanDerWaalsContact C-N 3.34Å; A305-K307 PolarHBondContact O-N 3.45Å
306	N	58.7	Low	61.8	Low	114 Å²	114	112.7 Å²	112.7	61%	0.61	58%	0.577	S	S	*	*	S	Bend	trans	-82.3	76.3	175.6	-72.3	-17.8	0	0	0	110.7	T302 F303 N308	T302-N306 WeakPolarHBondContact O-CB 3.34Å; T302-N306 PolarHBondContact O-N 3.31Å; F303-N306 CarbonylContact O-C 3.54Å; F303-N306 PolarHBondContact O-N 2.97Å; N306-N308 PolarHBondContact O-N 3.45Å
307	K	50.2	Low	61.2	Low	192 Å²	192	112 Å²	112	84%	0.835	58%	0.58	S	S	*	*			trans	-54.9	93.5	177.4	-71	-176	176.5	179	0	112.8	A305	A305-K307 VanDerWaalsContact C-N 3.34Å; A305-K307 PolarHBondContact O-N 3.45Å
308	N	51.5	Low	60.7	Low	135 Å²	135	115 Å²	115	72%	0.722	59%	0.586	S	S	*	*			trans	-122.9	112.9	158.3	-94.2	-13.7	0	0	0	109.6	N306 E310	N306-N308 PolarHBondContact O-N 3.45Å; N308-E310 PolarHBondContact O-N 2.75Å; N308-E310 VanDerWaalsContact O-N 3.15Å
309	T	54.4	Low	59.8	Low	118 Å²	118	111.3 Å²	111.3	72%	0.724	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-9.6	-169.1	12.1	0	0	0	0	115
310	E	51.4	Low	59.3	Low	183 Å²	183	114 Å²	114	86%	0.855	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-12	-174	-76.1	-177.7	150.4	0	0	115.4	N308	N308-E310 PolarHBondContact O-N 2.75Å; N308-E310 VanDerWaalsContact O-N 3.15Å
311	M	50.3	Low	59.5	Low	116 Å²	116	120 Å²	120	57%	0.571	60%	0.599	S	S	*	*	S	Bend	trans	-94.7	-4.9	-179.9	-72.8	-117.5	-164.4	0	0	114.5	F303 T313 K314	F303-M311 HydrophobicContact CE2-CB 4.27Å; F303-M311 HydrophobicContact CZ-CB 3.95Å; M311-T313 PolarHBondContact O-N 3.36Å; M311-T313 VanDerWaalsContact O-N 3.08Å; M311-K314 PolarHBondContact O-N 3.11Å
312	K	50.5	Low	59.2	Low	135 Å²	135	118 Å²	118	59%	0.587	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-20.3	-175.2	-81.4	-175.4	172.9	-176.2	0	115
313	T	54.1	Low	59	Low	120 Å²	120	120.6 Å²	120.6	74%	0.736	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-10.4	-171.6	45.5	0	0	0	0	114.6	M311	M311-T313 PolarHBondContact O-N 3.36Å; M311-T313 VanDerWaalsContact O-N 3.08Å
314	K	57.9	Low	59.4	Low	181 Å²	181	122 Å²	122	79%	0.787	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	-27.7	-178.2	-75.7	-176.4	177.5	177.5	0	115.2	M311	M311-K314 PolarHBondContact O-N 3.11Å
315	E	56	Low	60	Low	75 Å²	75	123.3 Å²	123.3	35%	0.35	61%	0.605	S	S	.	*	S	Bend	trans	-104.6	-22.5	-175.3	-61.7	-148.1	150.6	0	0	115.1	P317 R318 F319	E315-P317 VanDerWaalsContact C-CD 3.48Å; E315-R318 WeakPolarHBondContact O-CB 3.45Å; E315-R318 PolarHBondContact O-N 2.96Å; E315-F319 HydrophobicContact CB-CD2 4.33Å; E315-F319 HydrophobicContact CB-CE2 3.91Å; E315-F319 WeakPolarHBondContact O-CD2 3.37Å; E315-F319 PolarHBondContact O-N 2.91Å
316	L	58.5	Low	60.1	Low	85 Å²	85	122 Å²	122	45%	0.445	59%	0.588	S	S	.	*	H	α-helix	trans	-54.1	-44.2	176.3	-116.1	91.1	0	0	0	114.1	R318 F319 E320	L316-R318 PolarHBondContact O-N 2.87Å; L316-F319 PolarHBondContact O-N 3.35Å; L316-F319 VanDerWaalsContact O-N 3.11Å; L316-E320 PolarHBondContact O-N 3.32Å
317	P	63.9	Low	60.5	Low	73 Å²	73	122.8 Å²	122.8	47%	0.474	59%	0.589	S	S	.	*	H	α-helix	trans	-67.4	-21.5	179.7	-19.9	32.1	0	0	0	113.6	E315 K321	E315-P317 VanDerWaalsContact C-CD 3.48Å; P317-K321 PolarHBondContact O-N 3.41Å
318	R	64.6	Low	61.4	Low	188 Å²	188	118.3 Å²	118.3	71%	0.709	58%	0.577	S	S	*	*	H	α-helix	trans	-73.8	-41.1	172.3	-98	-174.7	171.5	-163.8	-3.4	110.8	E315 L316 K321 E322	E315-R318 WeakPolarHBondContact O-CB 3.45Å; E315-R318 PolarHBondContact O-N 2.96Å; L316-R318 PolarHBondContact O-N 2.87Å; R318-K321 PolarHBondContact O-N 3.36Å; R318-E322 PolarHBondContact O-N 3.47Å; R318-E322 VanDerWaalsContact O-N 3.12Å
319	F	59.9	Low	61.9	Low	75 Å²	75	115.5 Å²	115.5	33%	0.329	56%	0.561	S	S	.	*	H	α-helix	trans	-70.5	-36.2	179.7	-70.1	-62.7	0	0	0	113.1	V300 E315 L316 E322 L323	V300-F319 HydrophobicContact CG2-CD1 3.77Å; V300-F319 HydrophobicContact CG2-CE1 3.2Å; V300-F319 HydrophobicContact CG2-CZ 3.74Å; E315-F319 HydrophobicContact CB-CD2 4.33Å; E315-F319 HydrophobicContact CB-CE2 3.91Å; E315-F319 WeakPolarHBondContact O-CD2 3.37Å; E315-F319 PolarHBondContact O-N 2.91Å; L316-F319 PolarHBondContact O-N 3.35Å; L316-F319 VanDerWaalsContact O-N 3.11Å; F319-E322 PolarHBondContact O-N 2.92Å; F319-L323 WeakPolarHBondContact O-CB 3.39Å; F319-L323 PolarHBondContact O-N 2.76Å
320	E	64	Low	62.1	Low	124 Å²	124	115.3 Å²	115.3	58%	0.579	56%	0.555	S	S	*	*	H	α-helix	trans	-64.4	-42.2	173.4	-74.7	176.1	164.9	0	0	111.9	L316 E322 L323 D324	L316-E320 PolarHBondContact O-N 3.32Å; E320-E322 VanDerWaalsContact C-N 3.32Å; E320-E322 PolarHBondContact O-N 3.25Å; E320-L323 PolarHBondContact O-N 2.96Å; E320-D324 PolarHBondContact O-N 3.45Å
321	K	72.1	Confident	62.2	Low	159 Å²	159	108.4 Å²	108.4	69%	0.691	53%	0.533	S	S	*	.	H	α-helix	trans	-61.1	-38.7	173.9	-93.6	-174.9	173.8	-178.1	0	113.3	P317 R318 R325	P317-K321 PolarHBondContact O-N 3.41Å; R318-K321 PolarHBondContact O-N 3.36Å; K321-R325 WeakPolarHBondContact O-CB 3.47Å; K321-R325 PolarHBondContact O-N 3.45Å; K321-R325 VanDerWaalsContact O-N 3.08Å
322	E	64.2	Low	62.5	Low	75 Å²	75	106.5 Å²	106.5	35%	0.35	53%	0.527	S	S	.	.	H	α-helix	trans	-74.8	-32.1	179.5	-140.2	60.3	-153.2	0	0	111.6	R318 F319 E320 R325 V326	R318-E322 PolarHBondContact O-N 3.47Å; R318-E322 VanDerWaalsContact O-N 3.12Å; F319-E322 PolarHBondContact O-N 2.92Å; E320-E322 VanDerWaalsContact C-N 3.32Å; E320-E322 PolarHBondContact O-N 3.25Å; E322-R325 PolarHBondContact O-N 3.4Å; E322-R325 WeakPolarHBondContact OE1-CD 3.37Å; E322-R325 IonicContact OE1-CZ 3.36Å; E322-R325 IonicContact OE1-NE 3.89Å; E322-R325 IonicContact OE1-NH1 3.87Å; E322-R325 PolarHBondContact OE1-NH1 2.94Å; E322-V326 VanDerWaalsContact O-CG2 3.3Å; E322-V326 WeakPolarHBondContact O-CG2 3.45Å; E322-V326 PolarHBondContact O-N 3.01Å
323	L	67.5	Low	62.5	Low	124 Å²	124	104.5 Å²	104.5	65%	0.649	53%	0.527	S	S	*	.	H	α-helix	trans	-64.7	-47.9	172.2	-131.4	105.2	0	0	0	111.7	F319 E320 R325 V326 E327	F319-L323 WeakPolarHBondContact O-CB 3.39Å; F319-L323 PolarHBondContact O-N 2.76Å; E320-L323 PolarHBondContact O-N 2.96Å; L323-R325 VanDerWaalsContact C-N 3.28Å; L323-R325 PolarHBondContact O-N 3.31Å; L323-V326 PolarHBondContact O-N 3.35Å; L323-E327 PolarHBondContact O-N 2.98Å
324	D	72.6	Confident	62.1	Low	100 Å²	100	101.9 Å²	101.9	54%	0.535	52%	0.518	S	S	.	.	H	α-helix	trans	-59.1	-40.8	175.6	-84.4	-12.1	0	0	0	111.2	E320 V326 E327 V328	E320-D324 PolarHBondContact O-N 3.45Å; D324-V326 PolarHBondContact O-N 3.01Å; D324-E327 PolarHBondContact O-N 2.82Å; D324-V328 VanDerWaalsContact O-CG2 3.28Å; D324-V328 WeakPolarHBondContact O-CG2 3.42Å; D324-V328 PolarHBondContact O-N 3.45Å
325	R	75.6	Confident	61.4	Low	143 Å²	143	102.2 Å²	102.2	54%	0.54	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-43.1	176.8	-175.8	-173.2	165.4	-162.1	-5.8	111.9	K321 E322 L323 V328 M329	K321-R325 WeakPolarHBondContact O-CB 3.47Å; K321-R325 PolarHBondContact O-N 3.45Å; K321-R325 VanDerWaalsContact O-N 3.08Å; E322-R325 PolarHBondContact O-N 3.4Å; E322-R325 WeakPolarHBondContact OE1-CD 3.37Å; E322-R325 IonicContact OE1-CZ 3.36Å; E322-R325 IonicContact OE1-NE 3.89Å; E322-R325 IonicContact OE1-NH1 3.87Å; E322-R325 PolarHBondContact OE1-NH1 2.94Å; L323-R325 VanDerWaalsContact C-N 3.28Å; L323-R325 PolarHBondContact O-N 3.31Å; R325-V328 PolarHBondContact O-N 3.42Å; R325-M329 PolarHBondContact O-N 2.94Å; R325-M329 VanDerWaalsContact O-N 3.13Å
326	V	64.3	Low	61	Low	46 Å²	46	105.7 Å²	105.7	28%	0.279	53%	0.531	S	S	.	.	H	α-helix	trans	-68.7	-38.2	178.3	171.4	0	0	0	0	111.2	E322 L323 D324 M329 L330	E322-V326 VanDerWaalsContact O-CG2 3.3Å; E322-V326 WeakPolarHBondContact O-CG2 3.45Å; E322-V326 PolarHBondContact O-N 3.01Å; L323-V326 PolarHBondContact O-N 3.35Å; D324-V326 PolarHBondContact O-N 3.01Å; V326-M329 HydrophobicContact CG2-CE 4.26Å; V326-M329 PolarHBondContact O-N 3.29Å; V326-L330 HydrophobicContact CG1-CD1 3.84Å; V326-L330 WeakPolarHBondContact O-CG 3.46Å; V326-L330 PolarHBondContact O-N 3.07Å
327	E	66.5	Low	60.3	Low	131 Å²	131	110.8 Å²	110.8	61%	0.612	55%	0.55	S	S	*	.	H	α-helix	trans	-65.2	-38.5	176.4	-163	168.1	-165.1	0	0	111.9	L323 D324 L330 G331	L323-E327 PolarHBondContact O-N 2.98Å; D324-E327 PolarHBondContact O-N 2.82Å; E327-L330 PolarHBondContact O-N 3.33Å; E327-G331 PolarHBondContact O-N 2.65Å
328	V	70.2	Confident	59.4	Low	98 Å²	98	115.9 Å²	115.9	59%	0.594	56%	0.564	S	S	*	*	H	α-helix	trans	-66.1	-38.7	173.2	171.9	0	0	0	0	112.3	D324 R325 G331 T332	D324-V328 VanDerWaalsContact O-CG2 3.28Å; D324-V328 WeakPolarHBondContact O-CG2 3.42Å; D324-V328 PolarHBondContact O-N 3.45Å; R325-V328 PolarHBondContact O-N 3.42Å; V328-G331 PolarHBondContact O-N 3.49Å; V328-T332 PolarHBondContact O-N 3.24Å; V328-T332 VanDerWaalsContact O-N 3.1Å; V328-T332 PolarHBondContact O-OG1 3.22Å
329	M	61.8	Low	58.3	Low	76 Å²	76	113.8 Å²	113.8	37%	0.374	57%	0.567	S	S	.	*	H	α-helix	trans	-68	-36.9	174.9	-77.8	-166.9	-55.7	0	0	113	R325 V326 T332 T333	R325-M329 PolarHBondContact O-N 2.94Å; R325-M329 VanDerWaalsContact O-N 3.13Å; V326-M329 HydrophobicContact CG2-CE 4.26Å; V326-M329 PolarHBondContact O-N 3.29Å; M329-T332 WeakPolarHBondContact CA-OG1 3.35Å; M329-T332 PolarHBondContact O-OG1 3Å; M329-T332 VanDerWaalsContact O-OG1 3.06Å; M329-T333 PolarHBondContact O-N 3.08Å; M329-T333 PolarHBondContact O-OG1 3.17Å
330	L	57.8	Low	57.2	Low	115 Å²	115	114.4 Å²	114.4	60%	0.602	59%	0.586	S	S	*	*	H	α-helix	trans	-72.2	-35.4	175.5	-74.9	164.2	0	0	0	111.9	V326 E327 T333 A334	V326-L330 HydrophobicContact CG1-CD1 3.84Å; V326-L330 WeakPolarHBondContact O-CG 3.46Å; V326-L330 PolarHBondContact O-N 3.07Å; E327-L330 PolarHBondContact O-N 3.33Å; L330-T333 PolarHBondContact O-OG1 3.41Å; L330-A334 PolarHBondContact O-N 3.04Å
331	G	54.8	Low	55.7	Low	38 Å²	38	117 Å²	117	39%	0.392	60%	0.596	S	S	.	*	H	α-helix	trans	-66.6	-36.5	175	0	0	0	0	0	113.8	E327 V328 Y335	E327-G331 PolarHBondContact O-N 2.65Å; V328-G331 PolarHBondContact O-N 3.49Å; G331-Y335 PolarHBondContact O-N 3.43Å
332	T	55.1	Low	54.1	Low	75 Å²	75	116.1 Å²	116.1	46%	0.46	60%	0.597	S	S	.	*	H	α-helix	trans	-75.6	-34.1	178.9	42.9	0	0	0	0	113.1	V328 M329 Y335 H336	V328-T332 PolarHBondContact O-N 3.24Å; V328-T332 VanDerWaalsContact O-N 3.1Å; V328-T332 PolarHBondContact O-OG1 3.22Å; M329-T332 WeakPolarHBondContact CA-OG1 3.35Å; M329-T332 PolarHBondContact O-OG1 3Å; M329-T332 VanDerWaalsContact O-OG1 3.06Å; T332-Y335 PolarHBondContact O-N 3.08Å; T332-H336 PolarHBondContact O-CD2 3.39Å
333	T	51.8	Low	52.6	Low	93 Å²	93	120.7 Å²	120.7	57%	0.571	62%	0.624	S	S	*	*	H	α-helix	trans	-73.2	-28.6	175.3	42	0	0	0	0	113.4	M329 L330	M329-T333 PolarHBondContact O-N 3.08Å; M329-T333 PolarHBondContact O-OG1 3.17Å; L330-T333 PolarHBondContact O-OG1 3.41Å
334	A	46.2	Very low	51	Low	66 Å²	66	119.6 Å²	119.6	55%	0.545	63%	0.626	S	S	.	*	H	α-helix	trans	-70.6	-28.7	172.9	0	0	0	0	0	113.3	L330	L330-A334 PolarHBondContact O-N 3.04Å
335	Y	43	Very low	49.1	Very low	187 Å²	187	122.7 Å²	122.7	73%	0.733	64%	0.641	S	S	*	*	H	α-helix	trans	-77.1	-32.8	179.9	-110	-87.9	0	0	0	113.7	G331 T332	G331-Y335 PolarHBondContact O-N 3.43Å; T332-Y335 PolarHBondContact O-N 3.08Å
336	H	46.8	Very low	46.9	Very low	149 Å²	149	120.7 Å²	120.7	69%	0.69	66%	0.655	S	S	*	*	H	α-helix	trans	-75.9	-23	179.4	-74.5	-58.4	0	0	0	114.1	T332 K338	T332-H336 PolarHBondContact O-CD2 3.39Å; H336-K338 VanDerWaalsContact C-N 3.35Å; H336-K338 PolarHBondContact O-N 2.96Å
337	K	43.8	Very low	45.5	Very low	191 Å²	191	126.5 Å²	126.5	83%	0.83	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-14.3	-177.6	-142.3	172.1	-174	175.8	0	114.1
338	K	44.1	Very low	44.1	Very low	180 Å²	180	126.9 Å²	126.9	78%	0.783	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-17.7	176.8	-97.6	179.9	175.9	175.6	0	114.6	H336	H336-K338 VanDerWaalsContact C-N 3.35Å; H336-K338 PolarHBondContact O-N 2.96Å
339	N	41.6	Very low	42.2	Very low	144 Å²	144	131.9 Å²	131.9	77%	0.77	71%	0.705	S	S	*	*	S	Bend	trans	-107.4	0.7	-175.6	-71.4	-9.9	0	0	0	114.8	K341	N339-K341 VanDerWaalsContact C-N 3.31Å; N339-K341 PolarHBondContact O-N 3.39Å
340	A	38.3	Very low	40.9	Very low	88 Å²	88	131.5 Å²	131.5	73%	0.727	72%	0.721	S	S	*	*			trans	-91.3	19.7	178.5	0	0	0	0	0	114	I342	A340-I342 PolarHBondContact O-N 3.48Å
341	K	31.8	Very low	39.6	Very low	179 Å²	179	130.9 Å²	130.9	78%	0.778	73%	0.725	S	S	*	*			trans	-82.1	115.8	176.4	-120	-179.6	179.2	177	0	109.6	N339	N339-K341 VanDerWaalsContact C-N 3.31Å; N339-K341 PolarHBondContact O-N 3.39Å
342	I	38.7	Very low	38.5	Very low	140 Å²	140	136.2 Å²	136.2	72%	0.718	74%	0.737	S	S	*	*	S	Bend	trans	81.6	75	152	-45	157.5	0	0	0	114.5	A340	A340-I342 PolarHBondContact O-N 3.48Å
343	N	31.8	Very low	37.4	Very low	172 Å²	172	134.3 Å²	134.3	92%	0.92	73%	0.727	S	S	*	*			trans	-147.8	68.6	153.8	-87.8	-27.4	0	0	0	108.4
344	S	34.9	Very low	36.6	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	73%	0.733	S	S	*	*			trans	-147	108.2	165.8	54.5	0	0	0	0	111.5
345	I	32.4	Very low	35.9	Very low	166 Å²	166	138 Å²	138	85%	0.851	74%	0.738	S	S	*	*			trans	75	97.2	137.8	-49.7	160.6	0	0	0	116.5
346	A	30.3	Very low	35.5	Very low	101 Å²	101	137.7 Å²	137.7	84%	0.835	74%	0.741	S	S	*	*			trans	-143.4	69.1	153.3	0	0	0	0	0	109.8
347	E	33	Very low	35	Very low	168 Å²	168	137.8 Å²	137.8	79%	0.785	75%	0.747	S	S	*	*			trans	-98.7	98.1	161.9	-79.6	-176.4	162.4	0	0	108.5
348	T	37.1	Very low	34.6	Very low	138 Å²	138	134.3 Å²	134.3	85%	0.847	74%	0.741	S	S	*	*			trans	-115.7	100.7	162.3	19.6	0	0	0	0	108.9
349	F	31.7	Very low	34.3	Very low	203 Å²	203	132.9 Å²	132.9	89%	0.89	74%	0.742	S	S	*	*			trans	-57.4	128.4	161.4	-92	-101.3	0	0	0	110.3
350	G	33	Very low	34.1	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	74%	0.741	S	S	*	*			trans	-152.5	107.2	170.2	0	0	0	0	0	110
351	C	31.1	Very low	33.7	Very low	101 Å²	101	136.5 Å²	136.5	68%	0.682	74%	0.744	S	S	*	*			trans	-98.9	136.4	-171.3	-152.6	0	0	0	0	112
352	K	32.1	Very low	34	Very low	151 Å²	151	133.9 Å²	133.9	66%	0.657	75%	0.748	S	S	*	*			trans	111	130.1	142.8	-58.5	-176.1	179	175.4	0	119.5	K379	K352-K379 WeakPolarHBondContact O-CE 3.44Å; K352-K379 PolarHBondContact O-NZ 3.11Å
353	S	32.4	Very low	34.3	Very low	35 Å²	35	136.7 Å²	136.7	25%	0.245	76%	0.755	C	S	.	*			trans	92	114.8	137.8	84.9	0	0	0	0	125.1	L375 K379	S353-L375 WeakPolarHBondContact O-CD1 3.43Å; S353-L375 VanDerWaalsContact O-CD2 3.31Å; S353-L375 WeakPolarHBondContact O-CD2 3.34Å; S353-K379 WeakPolarHBondContact OG-CE 3.31Å; S353-K379 PolarHBondContact OG-NZ 3.37Å
354	N	34.1	Very low	34.8	Very low	130 Å²	130	133.1 Å²	133.1	70%	0.695	74%	0.736	S	S	*	*				77.4	115.9	119.9	-67.8	11	0	0	0	123.7
355	T	31.1	Very low	35.4	Very low	106 Å²	106	136.2 Å²	136.2	65%	0.65	74%	0.74	S	S	*	*			trans	81.4	114.2	143.2	1.7	0	0	0	0	121.1	K371	T355-K371 PolarHBondContact O-NZ 3.37Å; T355-K371 VanDerWaalsContact O-NZ 3.08Å
356	F	34.7	Very low	36.1	Very low	180 Å²	180	139 Å²	139	79%	0.789	74%	0.739	S	S	*	*				176.1	139.7	111.9	-105.9	-87.6	0	0	0	112.1
357	N	36.5	Very low	37	Very low	152 Å²	152	138.4 Å²	138.4	81%	0.813	73%	0.729	S	S	*	*			trans	-56.1	144.6	170.3	-78.1	-24.1	0	0	0	113.7
358	T	36.5	Very low	37.8	Very low	117 Å²	117	132.6 Å²	132.6	72%	0.718	71%	0.707	S	S	*	*			trans	-164.3	127.2	132.6	26	0	0	0	0	110.1
359	N	37.5	Very low	38.5	Very low	151 Å²	151	132.2 Å²	132.2	81%	0.807	70%	0.696	S	S	*	*			trans	-75.5	155.7	177	-78.4	-22.9	0	0	0	112.3
360	N	36.1	Very low	39.8	Very low	140 Å²	140	128.2 Å²	128.2	75%	0.749	68%	0.683	S	S	*	*	S	Bend	trans	99.8	92.2	163	-59.8	-3.2	0	0	0	118.1
361	E	30.6	Very low	40.9	Very low	168 Å²	168	129.6 Å²	129.6	79%	0.785	67%	0.67	S	S	*	*	S	Bend	trans	69.8	80.5	139.8	-64.9	176.6	169.7	0	0	118.8	K363	E361-K363 PolarHBondContact O-N 3.21Å
362	S	39.4	Very low	42.1	Very low	124 Å²	124	131.5 Å²	131.5	87%	0.867	66%	0.663	S	S	*	*	S	Bend	trans	58.5	35.8	147.9	53.7	0	0	0	0	117.9
363	K	43.7	Very low	43.7	Very low	198 Å²	198	126.5 Å²	126.5	86%	0.861	65%	0.65	S	S	*	*			trans	-148.6	16.9	-178.5	-102.4	166.3	-170.9	175.7	0	117.5	E361	E361-K363 PolarHBondContact O-N 3.21Å
364	N	42	Very low	45.4	Very low	97 Å²	97	130 Å²	130	52%	0.519	67%	0.666	S	S	.	*			trans	-102.9	12	-172.9	-88.3	-9.1	0	0	0	117.7	R366	N364-R366 PolarHBondContact O-N 3.43Å
365	Q	47.4	Very low	46.9	Very low	166 Å²	166	125.6 Å²	125.6	78%	0.776	64%	0.642	S	S	*	*	H	α-helix	trans	-69.6	-19.5	-172.6	-98	169.9	-22	0	0	116.7	S368	Q365-S368 PolarHBondContact O-OG 3.07Å
366	R	48.4	Very low	48.8	Very low	223 Å²	223	124.2 Å²	124.2	84%	0.842	63%	0.631	S	S	*	*	H	α-helix	trans	-87.8	-16.9	-175.9	-84	-178.7	176.2	168.1	-1	115.8	N364	N364-R366 PolarHBondContact O-N 3.43Å
367	S	49.5	Very low	50.7	Low	90 Å²	90	120.1 Å²	120.1	63%	0.629	62%	0.617	S	S	*	*	H	α-helix	trans	-90.7	-22.1	174.2	94.6	0	0	0	0	112.7
368	S	49.2	Very low	52.5	Low	45 Å²	45	118.3 Å²	118.3	32%	0.315	60%	0.603	S	S	.	*	H	α-helix	trans	-68.8	-35	173.2	44.5	0	0	0	0	113.1	Q365 K371 W372	Q365-S368 PolarHBondContact O-OG 3.07Å; S368-K371 PolarHBondContact O-N 3.21Å; S368-W372 PolarHBondContact O-N 3.39Å
369	E	52.2	Low	54.3	Low	131 Å²	131	115.3 Å²	115.3	61%	0.612	58%	0.58	S	S	*	*	H	α-helix	trans	-65.7	-42.1	-178	-80.3	177.1	152	0	0	113.3	K371 W372 A373	E369-K371 VanDerWaalsContact C-N 3.32Å; E369-K371 PolarHBondContact O-N 3.07Å; E369-W372 PolarHBondContact O-N 3.02Å; E369-A373 PolarHBondContact O-N 3.21Å
370	N	58.6	Low	56.2	Low	118 Å²	118	112.8 Å²	112.8	63%	0.631	57%	0.566	S	S	*	*	H	α-helix	trans	-66.1	-37	174.6	-74.9	-8.4	0	0	0	111.8	W372 A373 D374	N370-W372 PolarHBondContact O-N 3.11Å; N370-A373 PolarHBondContact O-N 2.87Å; N370-D374 PolarHBondContact O-N 2.95Å; N370-D374 VanDerWaalsContact O-N 3.07Å
371	K	56.6	Low	58	Low	98 Å²	98	111.1 Å²	111.1	43%	0.426	56%	0.557	S	S	.	*	H	α-helix	trans	-66.8	-36.5	177.5	-144.6	-179.5	-172.1	-171	0	112.2	T355 S368 E369 L375	T355-K371 PolarHBondContact O-NZ 3.37Å; T355-K371 VanDerWaalsContact O-NZ 3.08Å; S368-K371 PolarHBondContact O-N 3.21Å; E369-K371 VanDerWaalsContact C-N 3.32Å; E369-K371 PolarHBondContact O-N 3.07Å; K371-L375 WeakPolarHBondContact O-CB 2.87Å; K371-L375 WeakPolarHBondContact O-CD1 3.08Å; K371-L375 PolarHBondContact O-N 3.04Å; K371-L375 VanDerWaalsContact O-N 3.1Å
372	W	55.3	Low	60.2	Low	142 Å²	142	107.6 Å²	107.6	54%	0.538	54%	0.54	S	S	.	.	H	α-helix	trans	-70.2	-37.9	174.6	-82.4	111.2	0	0	0	112.7	S368 E369 N370 L375 N376	S368-W372 PolarHBondContact O-N 3.39Å; E369-W372 PolarHBondContact O-N 3.02Å; N370-W372 PolarHBondContact O-N 3.11Å; W372-L375 PolarHBondContact O-N 3.44Å; W372-N376 WeakPolarHBondContact O-CB 2.98Å; W372-N376 PolarHBondContact O-N 2.96Å
373	A	66.3	Low	62	Low	46 Å²	46	109.6 Å²	109.6	38%	0.38	53%	0.53	S	S	.	.	H	α-helix	trans	-64	-44.4	175.3	0	0	0	0	0	111.9	E369 N370 N376 N377	E369-A373 PolarHBondContact O-N 3.21Å; N370-A373 PolarHBondContact O-N 2.87Å; A373-N376 PolarHBondContact O-N 3.48Å; A373-N377 WeakPolarHBondContact O-CB 3.43Å; A373-N377 PolarHBondContact O-N 3.3Å; A373-N377 PolarHBondContact O-ND2 3.09Å
374	D	67.4	Low	63.7	Low	109 Å²	109	102.5 Å²	102.5	58%	0.583	51%	0.508	S	S	*	.	H	α-helix	trans	-64.8	-43	176.7	-72.1	-20.8	0	0	0	112	N370 N376 N377 Q378	N370-D374 PolarHBondContact O-N 2.95Å; N370-D374 VanDerWaalsContact O-N 3.07Å; D374-N376 VanDerWaalsContact C-N 3.33Å; D374-N376 PolarHBondContact O-N 3.33Å; D374-N377 PolarHBondContact O-N 2.99Å; D374-Q378 VanDerWaalsContact O-CB 3.32Å; D374-Q378 WeakPolarHBondContact O-CB 3.44Å; D374-Q378 PolarHBondContact O-N 2.9Å
375	L	66.4	Low	65.4	Low	37 Å²	37	103 Å²	103	19%	0.194	51%	0.507	C	S	.	.	H	α-helix	trans	-62.4	-37.6	175.3	-99	149	0	0	0	112.7	S353 K371 W372 K379	S353-L375 WeakPolarHBondContact O-CD1 3.43Å; S353-L375 VanDerWaalsContact O-CD2 3.31Å; S353-L375 WeakPolarHBondContact O-CD2 3.34Å; K371-L375 WeakPolarHBondContact O-CB 2.87Å; K371-L375 WeakPolarHBondContact O-CD1 3.08Å; K371-L375 PolarHBondContact O-N 3.04Å; K371-L375 VanDerWaalsContact O-N 3.1Å; W372-L375 PolarHBondContact O-N 3.44Å; L375-K379 WeakPolarHBondContact O-CG 3.49Å; L375-K379 PolarHBondContact O-N 3.29Å; L375-K379 VanDerWaalsContact O-N 3.1Å
376	N	71.5	Confident	67	Low	77 Å²	77	102 Å²	102	41%	0.412	50%	0.5	S	S	.	.	H	α-helix	trans	-72.8	-43.2	178.3	-162.4	36.9	0	0	0	111.5	W372 A373 D374 Q378 K379 I380	W372-N376 WeakPolarHBondContact O-CB 2.98Å; W372-N376 PolarHBondContact O-N 2.96Å; A373-N376 PolarHBondContact O-N 3.48Å; D374-N376 VanDerWaalsContact C-N 3.33Å; D374-N376 PolarHBondContact O-N 3.33Å; N376-Q378 VanDerWaalsContact C-N 3.3Å; N376-Q378 PolarHBondContact O-N 3.02Å; N376-K379 PolarHBondContact O-N 3.27Å; N376-K379 VanDerWaalsContact O-N 3.15Å; N376-I380 WeakPolarHBondContact O-CG1 3.46Å; N376-I380 PolarHBondContact O-N 2.95Å
377	N	74.7	Confident	68.5	Low	93 Å²	93	94.6 Å²	94.6	50%	0.497	48%	0.476	S	S	.	.	H	α-helix	trans	-59.8	-41.6	173.4	-74.6	-21.5	0	0	0	111.4	A373 D374 K379 I380 L381	A373-N377 WeakPolarHBondContact O-CB 3.43Å; A373-N377 PolarHBondContact O-N 3.3Å; A373-N377 PolarHBondContact O-ND2 3.09Å; D374-N377 PolarHBondContact O-N 2.99Å; N377-K379 VanDerWaalsContact C-N 3.31Å; N377-K379 PolarHBondContact O-N 2.93Å; N377-I380 PolarHBondContact O-N 2.92Å; N377-L381 WeakPolarHBondContact O-CB 3.32Å; N377-L381 PolarHBondContact O-N 2.87Å
378	Q	73.6	Confident	70.2	Confident	114 Å²	114	95 Å²	95	53%	0.533	47%	0.474	S	S	.	.	H	α-helix	trans	-64.1	-35.4	176.5	-164	174.3	23.7	0	0	112.3	D374 N376 Q382	D374-Q378 VanDerWaalsContact O-CB 3.32Å; D374-Q378 WeakPolarHBondContact O-CB 3.44Å; D374-Q378 PolarHBondContact O-N 2.9Å; N376-Q378 VanDerWaalsContact C-N 3.3Å; N376-Q378 PolarHBondContact O-N 3.02Å; Q378-Q382 WeakPolarHBondContact O-CB 3.36Å; Q378-Q382 WeakPolarHBondContact O-CG 3.27Å; Q378-Q382 PolarHBondContact O-N 2.87Å
379	K	74.7	Confident	71.8	Confident	54 Å²	54	99.1 Å²	99.1	24%	0.235	49%	0.486	C	S	.	.	H	α-helix	trans	-71.9	-39.3	174.9	-78.8	-178	178.8	-165.4	0	114.1	K352 S353 L375 N376 N377 L381 Q382 Y383	K352-K379 WeakPolarHBondContact O-CE 3.44Å; K352-K379 PolarHBondContact O-NZ 3.11Å; S353-K379 WeakPolarHBondContact OG-CE 3.31Å; S353-K379 PolarHBondContact OG-NZ 3.37Å; L375-K379 WeakPolarHBondContact O-CG 3.49Å; L375-K379 PolarHBondContact O-N 3.29Å; L375-K379 VanDerWaalsContact O-N 3.1Å; N376-K379 PolarHBondContact O-N 3.27Å; N376-K379 VanDerWaalsContact O-N 3.15Å; N377-K379 VanDerWaalsContact C-N 3.31Å; N377-K379 PolarHBondContact O-N 2.93Å; K379-L381 VanDerWaalsContact C-N 3.31Å; K379-Q382 PolarHBondContact O-N 3.1Å; K379-Y383 WeakPolarHBondContact O-CB 3.4Å; K379-Y383 PolarHBondContact O-N 2.66Å
380	I	76	Confident	73	Confident	98 Å²	98	95.9 Å²	95.9	50%	0.503	47%	0.473	S	S	.	.	H	α-helix	trans	-63.4	-43.3	175.3	-67.6	166.3	0	0	0	109.3	N376 N377 Y383 A384	N376-I380 WeakPolarHBondContact O-CG1 3.46Å; N376-I380 PolarHBondContact O-N 2.95Å; N377-I380 PolarHBondContact O-N 2.92Å; I380-Y383 PolarHBondContact O-N 3.15Å; I380-A384 WeakPolarHBondContact O-CB 3.43Å; I380-A384 PolarHBondContact O-N 2.89Å
381	L	75.3	Confident	74.2	Confident	106 Å²	106	93.8 Å²	93.8	56%	0.555	46%	0.461	S	S	*	.	H	α-helix	trans	-59.5	-48.7	172	-98.8	147.4	0	0	0	112.1	N377 K379 Y383 A384 E385	N377-L381 WeakPolarHBondContact O-CB 3.32Å; N377-L381 PolarHBondContact O-N 2.87Å; K379-L381 VanDerWaalsContact C-N 3.31Å; L381-Y383 VanDerWaalsContact C-N 3.3Å; L381-Y383 PolarHBondContact O-N 3.25Å; L381-A384 PolarHBondContact O-N 2.98Å; L381-E385 WeakPolarHBondContact O-CB 3.46Å; L381-E385 WeakPolarHBondContact O-CG 3.31Å; L381-E385 PolarHBondContact O-N 3.35Å
382	Q	76.9	Confident	75.5	Confident	94 Å²	94	94.6 Å²	94.6	44%	0.439	47%	0.47	S	S	.	.	H	α-helix	trans	-62.5	-35.3	176.9	-77.8	-177	10.7	0	0	113.3	Q378 K379 K386	Q378-Q382 WeakPolarHBondContact O-CB 3.36Å; Q378-Q382 WeakPolarHBondContact O-CG 3.27Å; Q378-Q382 PolarHBondContact O-N 2.87Å; K379-Q382 PolarHBondContact O-N 3.1Å; Q382-K386 WeakPolarHBondContact O-CB 3.48Å; Q382-K386 VanDerWaalsContact O-CG 3.32Å; Q382-K386 WeakPolarHBondContact O-CG 3.48Å; Q382-K386 PolarHBondContact O-N 3.26Å
383	Y	76.6	Confident	76.6	Confident	166 Å²	166	92.7 Å²	92.7	65%	0.651	47%	0.469	S	S	*	.	H	α-helix	trans	-70.9	-43.6	176.4	-173.4	-96.9	0	0	0	111.2	K379 I380 L381 E385 K386 Q387	K379-Y383 WeakPolarHBondContact O-CB 3.4Å; K379-Y383 PolarHBondContact O-N 2.66Å; I380-Y383 PolarHBondContact O-N 3.15Å; L381-Y383 VanDerWaalsContact C-N 3.3Å; L381-Y383 PolarHBondContact O-N 3.25Å; Y383-E385 VanDerWaalsContact C-N 3.34Å; Y383-E385 PolarHBondContact O-N 3Å; Y383-K386 PolarHBondContact O-N 2.8Å; Y383-Q387 WeakPolarHBondContact O-CB 3.49Å; Y383-Q387 PolarHBondContact O-N 2.86Å
384	A	79.5	Confident	77.3	Confident	49 Å²	49	94.3 Å²	94.3	41%	0.405	47%	0.47	S	S	.	.	H	α-helix	trans	-60.4	-42.6	173.7	0	0	0	0	0	111.5	I380 L381 K386 Q387 V388	I380-A384 WeakPolarHBondContact O-CB 3.43Å; I380-A384 PolarHBondContact O-N 2.89Å; L381-A384 PolarHBondContact O-N 2.98Å; A384-K386 PolarHBondContact O-N 3.46Å; A384-Q387 PolarHBondContact O-N 2.97Å; A384-V388 VanDerWaalsContact O-CG2 3.27Å; A384-V388 WeakPolarHBondContact O-CG2 3.36Å; A384-V388 PolarHBondContact O-N 3.39Å
385	E	78.4	Confident	78.2	Confident	107 Å²	107	96.4 Å²	96.4	50%	0.5	47%	0.474	S	S	.	.	H	α-helix	trans	-62.1	-42.2	174.3	-76.3	178.6	-179.2	0	0	112.5	L381 Y383 K389	L381-E385 WeakPolarHBondContact O-CB 3.46Å; L381-E385 WeakPolarHBondContact O-CG 3.31Å; L381-E385 PolarHBondContact O-N 3.35Å; Y383-E385 VanDerWaalsContact C-N 3.34Å; Y383-E385 PolarHBondContact O-N 3Å; E385-K389 WeakPolarHBondContact O-CG 3.47Å; E385-K389 PolarHBondContact O-N 3.36Å
386	K	79.5	Confident	79	Confident	144 Å²	144	100.3 Å²	100.3	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-67.1	-37.4	175.8	-77.2	179.7	-179.7	-176.8	0	112	Q382 Y383 A384 K389 L390	Q382-K386 WeakPolarHBondContact O-CB 3.48Å; Q382-K386 VanDerWaalsContact O-CG 3.32Å; Q382-K386 WeakPolarHBondContact O-CG 3.48Å; Q382-K386 PolarHBondContact O-N 3.26Å; Y383-K386 PolarHBondContact O-N 2.8Å; A384-K386 PolarHBondContact O-N 3.46Å; K386-K389 PolarHBondContact O-N 3.37Å; K386-L390 WeakPolarHBondContact O-CB 3.44Å; K386-L390 PolarHBondContact O-N 2.8Å
387	Q	80.5	Confident	79.4	Confident	69 Å²	69	103 Å²	103	32%	0.322	50%	0.495	S	S	.	.	H	α-helix	trans	-66.5	-44.7	176.7	-170.4	60.5	39.1	0	0	111	Y383 A384 K389 L390 D391	Y383-Q387 WeakPolarHBondContact O-CB 3.49Å; Y383-Q387 PolarHBondContact O-N 2.86Å; A384-Q387 PolarHBondContact O-N 2.97Å; Q387-K389 VanDerWaalsContact C-N 3.3Å; Q387-K389 PolarHBondContact O-N 3.41Å; Q387-L390 PolarHBondContact O-N 3.01Å; Q387-L390 VanDerWaalsContact O-N 3.14Å; Q387-D391 PolarHBondContact NE2-OD1 3.28Å; Q387-D391 WeakPolarHBondContact O-CB 3.14Å; Q387-D391 VanDerWaalsContact O-CG 3.25Å; Q387-D391 PolarHBondContact O-N 3.29Å
388	V	86	Confident	79.9	Confident	97 Å²	97	101.9 Å²	101.9	59%	0.588	49%	0.489	S	S	*	.	H	α-helix	trans	-60.3	-41.2	174.4	172.4	0	0	0	0	111	A384 L392	A384-V388 VanDerWaalsContact O-CG2 3.27Å; A384-V388 WeakPolarHBondContact O-CG2 3.36Å; A384-V388 PolarHBondContact O-N 3.39Å; V388-L392 WeakPolarHBondContact O-CB 3.23Å; V388-L392 PolarHBondContact O-N 2.94Å
389	K	81.7	Confident	80.6	Confident	132 Å²	132	101 Å²	101	57%	0.574	49%	0.485	S	S	*	.	H	α-helix	trans	-64	-41.3	174.1	-76.2	175.5	-178.4	173.9	0	112.4	E385 K386 Q387 L392 I393	E385-K389 WeakPolarHBondContact O-CG 3.47Å; E385-K389 PolarHBondContact O-N 3.36Å; K386-K389 PolarHBondContact O-N 3.37Å; Q387-K389 VanDerWaalsContact C-N 3.3Å; Q387-K389 PolarHBondContact O-N 3.41Å; K389-L392 PolarHBondContact O-N 3.23Å; K389-I393 VanDerWaalsContact O-CG1 3.28Å; K389-I393 WeakPolarHBondContact O-CG1 2.85Å; K389-I393 PolarHBondContact O-N 3.21Å
390	L	78.3	Confident	80.9	Confident	64 Å²	64	103.1 Å²	103.1	34%	0.335	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-45.4	177.5	-175.2	66	0	0	0	111.1	K386 Q387 L392 I393 M394	K386-L390 WeakPolarHBondContact O-CB 3.44Å; K386-L390 PolarHBondContact O-N 2.8Å; Q387-L390 PolarHBondContact O-N 3.01Å; Q387-L390 VanDerWaalsContact O-N 3.14Å; L390-L392 VanDerWaalsContact C-N 3.27Å; L390-L392 PolarHBondContact O-N 3.44Å; L390-I393 PolarHBondContact O-N 2.69Å; L390-M394 HydrophobicContact CG-SD 4.34Å; L390-M394 WeakPolarHBondContact O-CB 3.25Å; L390-M394 WeakPolarHBondContact O-CG 3.15Å; L390-M394 PolarHBondContact O-N 3.31Å
391	D	83.2	Confident	81.2	Confident	73 Å²	73	103.1 Å²	103.1	39%	0.39	50%	0.496	S	S	.	.	H	α-helix	trans	-61.8	-37.4	176.9	-67.5	-9.4	0	0	0	111.2	Q387 K395	Q387-D391 PolarHBondContact NE2-OD1 3.28Å; Q387-D391 WeakPolarHBondContact O-CB 3.14Å; Q387-D391 VanDerWaalsContact O-CG 3.25Å; Q387-D391 PolarHBondContact O-N 3.29Å; D391-K395 WeakPolarHBondContact O-CB 3.26Å; D391-K395 WeakPolarHBondContact O-CG 3.31Å; D391-K395 PolarHBondContact O-N 3.4Å
392	L	84	Confident	81.8	Confident	116 Å²	116	102.2 Å²	102.2	61%	0.607	49%	0.491	S	S	*	.	H	α-helix	trans	-65.1	-46.7	174.5	-161.1	83.1	0	0	0	111.5	V388 K389 L390 M394 K395 E396	V388-L392 WeakPolarHBondContact O-CB 3.23Å; V388-L392 PolarHBondContact O-N 2.94Å; K389-L392 PolarHBondContact O-N 3.23Å; L390-L392 VanDerWaalsContact C-N 3.27Å; L390-L392 PolarHBondContact O-N 3.44Å; L392-M394 VanDerWaalsContact C-N 3.33Å; L392-M394 PolarHBondContact O-N 3.44Å; L392-K395 PolarHBondContact O-N 3.45Å; L392-E396 WeakPolarHBondContact O-CB 3.28Å; L392-E396 PolarHBondContact O-N 2.81Å
393	I	77.7	Confident	82.1	Confident	101 Å²	101	102.2 Å²	102.2	52%	0.518	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-38.7	177.4	-69.3	166.4	0	0	0	110.9	K389 L390 E396 R397	K389-I393 VanDerWaalsContact O-CG1 3.28Å; K389-I393 WeakPolarHBondContact O-CG1 2.85Å; K389-I393 PolarHBondContact O-N 3.21Å; L390-I393 PolarHBondContact O-N 2.69Å; I393-E396 PolarHBondContact O-N 3.46Å; I393-R397 WeakPolarHBondContact O-CB 3.5Å; I393-R397 PolarHBondContact O-N 2.98Å
394	M	81.3	Confident	82.2	Confident	81 Å²	81	98.4 Å²	98.4	40%	0.399	48%	0.481	S	S	.	.	H	α-helix	trans	-64.9	-43.3	176.3	-74.8	-176.1	67.9	0	0	111.5	L390 L392 R397 D398	L390-M394 HydrophobicContact CG-SD 4.34Å; L390-M394 WeakPolarHBondContact O-CB 3.25Å; L390-M394 WeakPolarHBondContact O-CG 3.15Å; L390-M394 PolarHBondContact O-N 3.31Å; L392-M394 VanDerWaalsContact C-N 3.33Å; L392-M394 PolarHBondContact O-N 3.44Å; M394-R397 PolarHBondContact O-N 3.41Å; M394-D398 PolarHBondContact O-N 3.41Å
395	K	86.9	Confident	82.4	Confident	152 Å²	152	98.6 Å²	98.6	66%	0.661	48%	0.478	S	S	*	.	H	α-helix	trans	-61.7	-42	172.7	-76.2	178.6	-179.1	179	0	112.1	D391 L392 D398 Q399	D391-K395 WeakPolarHBondContact O-CB 3.26Å; D391-K395 WeakPolarHBondContact O-CG 3.31Å; D391-K395 PolarHBondContact O-N 3.4Å; L392-K395 PolarHBondContact O-N 3.45Å; K395-D398 PolarHBondContact O-N 3.29Å; K395-Q399 VanDerWaalsContact O-CB 3.31Å; K395-Q399 WeakPolarHBondContact O-CB 3.4Å; K395-Q399 PolarHBondContact O-N 3.47Å
396	E	82.3	Confident	82.7	Confident	119 Å²	119	96.5 Å²	96.5	56%	0.556	47%	0.47	S	S	*	.	H	α-helix	trans	-64.6	-40.4	176.3	-169.9	177.1	-175.1	0	0	111.5	L392 I393 Q399 L400	L392-E396 WeakPolarHBondContact O-CB 3.28Å; L392-E396 PolarHBondContact O-N 2.81Å; I393-E396 PolarHBondContact O-N 3.46Å; E396-Q399 PolarHBondContact O-N 3.43Å; E396-L400 HydrophobicContact CG-CD1 4.32Å; E396-L400 WeakPolarHBondContact O-CB 3.45Å; E396-L400 VanDerWaalsContact O-CG 3.31Å; E396-L400 WeakPolarHBondContact O-CG 3.43Å; E396-L400 PolarHBondContact O-N 3.01Å
397	R	80.4	Confident	82.6	Confident	134 Å²	134	93.1 Å²	93.1	51%	0.506	46%	0.461	S	S	.	.	H	α-helix	trans	-63.2	-45	174.4	-177.9	-86	-59.7	-174.9	6.3	111.8	I393 M394 Q399 L400 Q401	I393-R397 WeakPolarHBondContact O-CB 3.5Å; I393-R397 PolarHBondContact O-N 2.98Å; M394-R397 PolarHBondContact O-N 3.41Å; R397-Q399 VanDerWaalsContact C-N 3.31Å; R397-L400 PolarHBondContact O-N 3.48Å; R397-Q401 WeakPolarHBondContact O-CB 3.35Å; R397-Q401 PolarHBondContact O-N 3.37Å
398	D	85.7	Confident	82.4	Confident	69 Å²	69	93.7 Å²	93.7	37%	0.369	47%	0.467	S	S	.	.	H	α-helix	trans	-64.6	-39.4	177.4	-71.7	-25.3	0	0	0	111	M394 K395 Q401 I402	M394-D398 PolarHBondContact O-N 3.41Å; K395-D398 PolarHBondContact O-N 3.29Å; D398-Q401 PolarHBondContact O-N 3.09Å; D398-I402 VanDerWaalsContact O-CG1 3.26Å; D398-I402 WeakPolarHBondContact O-CG1 3.46Å; D398-I402 PolarHBondContact O-N 3Å
399	Q	87.2	Confident	82.1	Confident	97 Å²	97	96.1 Å²	96.1	45%	0.453	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-48.1	173.4	-179.3	59.6	28.3	0	0	111.9	K395 E396 R397 Q401 I402 E403	K395-Q399 VanDerWaalsContact O-CB 3.31Å; K395-Q399 WeakPolarHBondContact O-CB 3.4Å; K395-Q399 PolarHBondContact O-N 3.47Å; E396-Q399 PolarHBondContact O-N 3.43Å; R397-Q399 VanDerWaalsContact C-N 3.31Å; Q399-Q401 VanDerWaalsContact C-N 3.29Å; Q399-Q401 PolarHBondContact O-N 2.97Å; Q399-I402 WeakPolarHBondContact O-CB 3.46Å; Q399-I402 PolarHBondContact O-N 3.09Å; Q399-E403 PolarHBondContact NE2-OE1 3.29Å; Q399-E403 WeakPolarHBondContact O-CG 3.45Å; Q399-E403 PolarHBondContact O-N 2.73Å
400	L	81	Confident	81.9	Confident	97 Å²	97	97 Å²	97	51%	0.508	47%	0.469	S	S	.	.	H	α-helix	trans	-62.9	-35.3	176.1	-73.7	171.6	0	0	0	112.1	E396 R397 E403 L404	E396-L400 HydrophobicContact CG-CD1 4.32Å; E396-L400 WeakPolarHBondContact O-CB 3.45Å; E396-L400 VanDerWaalsContact O-CG 3.31Å; E396-L400 WeakPolarHBondContact O-CG 3.43Å; E396-L400 PolarHBondContact O-N 3.01Å; R397-L400 PolarHBondContact O-N 3.48Å; L400-E403 PolarHBondContact O-N 3.25Å; L400-L404 WeakPolarHBondContact O-CB 3.39Å; L400-L404 PolarHBondContact O-N 2.96Å
401	Q	83.4	Confident	81.6	Confident	98 Å²	98	98.4 Å²	98.4	46%	0.458	48%	0.476	S	S	.	.	H	α-helix	trans	-67.3	-39	175.1	-169.6	66.8	13.7	0	0	111.4	R397 D398 Q399 L404 T405	R397-Q401 WeakPolarHBondContact O-CB 3.35Å; R397-Q401 PolarHBondContact O-N 3.37Å; D398-Q401 PolarHBondContact O-N 3.09Å; Q399-Q401 VanDerWaalsContact C-N 3.29Å; Q399-Q401 PolarHBondContact O-N 2.97Å; Q401-L404 PolarHBondContact O-N 3.3Å; Q401-T405 WeakPolarHBondContact O-CB 3.35Å; Q401-T405 VanDerWaalsContact O-CG2 3.31Å; Q401-T405 WeakPolarHBondContact O-CG2 3.39Å; Q401-T405 PolarHBondContact O-N 3.27Å; Q401-T405 PolarHBondContact O-OG1 3.46Å
402	I	87.5	Confident	81.2	Confident	87 Å²	87	98.6 Å²	98.6	45%	0.446	48%	0.48	S	S	.	.	H	α-helix	trans	-64.1	-43.1	172.7	-68.9	163.6	0	0	0	110.3	D398 Q399 T405 N406	D398-I402 VanDerWaalsContact O-CG1 3.26Å; D398-I402 WeakPolarHBondContact O-CG1 3.46Å; D398-I402 PolarHBondContact O-N 3Å; Q399-I402 WeakPolarHBondContact O-CB 3.46Å; Q399-I402 PolarHBondContact O-N 3.09Å; I402-T405 WeakPolarHBondContact CA-OG1 3.48Å; I402-T405 PolarHBondContact O-N 3.01Å; I402-T405 PolarHBondContact O-OG1 3.41Å; I402-N406 VanDerWaalsContact O-CB 3.31Å; I402-N406 WeakPolarHBondContact O-CB 3.36Å; I402-N406 PolarHBondContact O-N 3.32Å; I402-N406 PolarHBondContact O-ND2 2.86Å
403	E	83.9	Confident	80.8	Confident	94 Å²	94	101.8 Å²	101.8	44%	0.439	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-42.9	176.5	-73.5	175.9	-164.2	0	0	112.1	Q399 L400 N406 T407	Q399-E403 PolarHBondContact NE2-OE1 3.29Å; Q399-E403 WeakPolarHBondContact O-CG 3.45Å; Q399-E403 PolarHBondContact O-N 2.73Å; L400-E403 PolarHBondContact O-N 3.25Å; E403-N406 PolarHBondContact O-N 2.97Å; E403-T407 WeakPolarHBondContact O-CG2 3.33Å; E403-T407 PolarHBondContact O-N 3.36Å; E403-T407 PolarHBondContact O-OG1 2.88Å
404	L	78.9	Confident	80.5	Confident	86 Å²	86	102.8 Å²	102.8	45%	0.45	49%	0.485	S	S	.	.	H	α-helix	trans	-64.9	-42.4	176.8	-176.9	63.5	0	0	0	112.3	L400 Q401 N406 T407 N408	L400-L404 WeakPolarHBondContact O-CB 3.39Å; L400-L404 PolarHBondContact O-N 2.96Å; Q401-L404 PolarHBondContact O-N 3.3Å; L404-N406 VanDerWaalsContact C-N 3.31Å; L404-N406 PolarHBondContact O-N 3.46Å; L404-T407 WeakPolarHBondContact CA-OG1 3.42Å; L404-T407 PolarHBondContact O-N 2.98Å; L404-T407 PolarHBondContact O-OG1 3.35Å; L404-N408 WeakPolarHBondContact O-CB 3.4Å; L404-N408 PolarHBondContact O-N 3.25Å; L404-N408 PolarHBondContact O-ND2 3.43Å
405	T	83.3	Confident	80	Confident	53 Å²	53	103.3 Å²	103.3	33%	0.325	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-35.6	175.7	52.6	0	0	0	0	111.4	Q401 I402 R409	Q401-T405 WeakPolarHBondContact O-CB 3.35Å; Q401-T405 VanDerWaalsContact O-CG2 3.31Å; Q401-T405 WeakPolarHBondContact O-CG2 3.39Å; Q401-T405 PolarHBondContact O-N 3.27Å; Q401-T405 PolarHBondContact O-OG1 3.46Å; I402-T405 WeakPolarHBondContact CA-OG1 3.48Å; I402-T405 PolarHBondContact O-N 3.01Å; I402-T405 PolarHBondContact O-OG1 3.41Å; T405-R409 WeakPolarHBondContact O-CB 3.37Å; T405-R409 VanDerWaalsContact O-CG 3.3Å; T405-R409 WeakPolarHBondContact O-CG 3.23Å; T405-R409 PolarHBondContact O-N 2.64Å
406	N	83.3	Confident	79.4	Confident	64 Å²	64	100.5 Å²	100.5	34%	0.342	48%	0.482	S	S	.	.	H	α-helix	trans	-69.2	-39.7	174.4	-75.7	-28	0	0	0	112.8	I402 E403 L404 R409 K410	I402-N406 VanDerWaalsContact O-CB 3.31Å; I402-N406 WeakPolarHBondContact O-CB 3.36Å; I402-N406 PolarHBondContact O-N 3.32Å; I402-N406 PolarHBondContact O-ND2 2.86Å; E403-N406 PolarHBondContact O-N 2.97Å; L404-N406 VanDerWaalsContact C-N 3.31Å; L404-N406 PolarHBondContact O-N 3.46Å; N406-R409 PolarHBondContact O-N 3.37Å; N406-R409 PolarHBondContact OD1-NH1 2.81Å; N406-K410 WeakPolarHBondContact O-CG 3.44Å; N406-K410 PolarHBondContact O-N 2.98Å
407	T	78.6	Confident	79	Confident	72 Å²	72	100.5 Å²	100.5	44%	0.442	48%	0.481	S	S	.	.	H	α-helix	trans	-68.2	-40.5	175.5	58.7	0	0	0	0	111	E403 L404 K410 L411	E403-T407 WeakPolarHBondContact O-CG2 3.33Å; E403-T407 PolarHBondContact O-N 3.36Å; E403-T407 PolarHBondContact O-OG1 2.88Å; L404-T407 WeakPolarHBondContact CA-OG1 3.42Å; L404-T407 PolarHBondContact O-N 2.98Å; L404-T407 PolarHBondContact O-OG1 3.35Å; T407-K410 WeakPolarHBondContact O-CB 3.36Å; T407-K410 PolarHBondContact O-N 3.33Å; T407-L411 PolarHBondContact O-N 3.13Å
408	N	75.5	Confident	78.6	Confident	81 Å²	81	99.3 Å²	99.3	43%	0.433	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-44.5	172.6	-78.1	-20.9	0	0	0	111.8	L404 K410 L411 T412	L404-N408 WeakPolarHBondContact O-CB 3.4Å; L404-N408 PolarHBondContact O-N 3.25Å; L404-N408 PolarHBondContact O-ND2 3.43Å; N408-K410 VanDerWaalsContact C-N 3.32Å; N408-K410 PolarHBondContact O-N 2.9Å; N408-L411 WeakPolarHBondContact O-CB 3.41Å; N408-L411 PolarHBondContact O-N 2.89Å; N408-L411 VanDerWaalsContact O-N 3.16Å; N408-T412 PolarHBondContact O-N 3.35Å; N408-T412 PolarHBondContact O-OG1 3.45Å
409	R	80.1	Confident	77.9	Confident	149 Å²	149	102.3 Å²	102.3	56%	0.562	49%	0.489	S	S	*	.	H	α-helix	trans	-59.6	-40.4	173.4	-76.5	173.8	-174.3	158.3	-1.8	112.5	T405 N406 T412 R413	T405-R409 WeakPolarHBondContact O-CB 3.37Å; T405-R409 VanDerWaalsContact O-CG 3.3Å; T405-R409 WeakPolarHBondContact O-CG 3.23Å; T405-R409 PolarHBondContact O-N 2.64Å; N406-R409 PolarHBondContact O-N 3.37Å; N406-R409 PolarHBondContact OD1-NH1 2.81Å; R409-T412 PolarHBondContact O-N 2.91Å; R409-R413 WeakPolarHBondContact O-CB 3.49Å; R409-R413 WeakPolarHBondContact O-CG 3.08Å; R409-R413 PolarHBondContact O-N 3.39Å
410	K	77.6	Confident	77.4	Confident	149 Å²	149	100.4 Å²	100.4	65%	0.648	49%	0.49	S	S	*	.	H	α-helix	trans	-63.3	-42.1	175	-73.5	175.1	-176.6	179.5	0	111.2	N406 T407 N408 R413 F414	N406-K410 WeakPolarHBondContact O-CG 3.44Å; N406-K410 PolarHBondContact O-N 2.98Å; T407-K410 WeakPolarHBondContact O-CB 3.36Å; T407-K410 PolarHBondContact O-N 3.33Å; N408-K410 VanDerWaalsContact C-N 3.32Å; N408-K410 PolarHBondContact O-N 2.9Å; K410-R413 PolarHBondContact O-N 3Å; K410-F414 WeakPolarHBondContact O-CB 3.36Å; K410-F414 PolarHBondContact O-N 3.48Å
411	L	71.9	Confident	77	Confident	94 Å²	94	98.9 Å²	98.9	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-65.1	-45	176.6	-177.2	63	0	0	0	111.6	T407 N408 R413 F414 L415	T407-L411 PolarHBondContact O-N 3.13Å; N408-L411 WeakPolarHBondContact O-CB 3.41Å; N408-L411 PolarHBondContact O-N 2.89Å; N408-L411 VanDerWaalsContact O-N 3.16Å; L411-R413 PolarHBondContact O-N 2.89Å; L411-F414 WeakPolarHBondContact O-CB 3.19Å; L411-F414 PolarHBondContact O-N 2.96Å; L411-L415 HydrophobicContact CD1-CG 4.5Å; L411-L415 HydrophobicContact CG-CD1 4.28Å; L411-L415 WeakPolarHBondContact O-CG 3.29Å; L411-L415 PolarHBondContact O-N 2.87Å
412	T	74.3	Confident	76.4	Confident	77 Å²	77	98.1 Å²	98.1	47%	0.472	48%	0.476	S	S	.	.	H	α-helix	trans	-59.7	-47.5	175.5	-53.9	0	0	0	0	111	N408 R409 F414 L415 D416	N408-T412 PolarHBondContact O-N 3.35Å; N408-T412 PolarHBondContact O-OG1 3.45Å; R409-T412 PolarHBondContact O-N 2.91Å; T412-F414 VanDerWaalsContact C-N 3.28Å; T412-F414 PolarHBondContact O-N 3.25Å; T412-L415 PolarHBondContact O-N 2.98Å; T412-L415 VanDerWaalsContact O-N 3.15Å; T412-D416 WeakPolarHBondContact O-CB 3.46Å; T412-D416 VanDerWaalsContact O-CG 3.3Å; T412-D416 PolarHBondContact O-N 3Å
413	R	76.9	Confident	75.9	Confident	184 Å²	184	97.8 Å²	97.8	69%	0.694	48%	0.475	S	S	*	.	H	α-helix	trans	-59.4	-38.4	175.1	-73.8	176.8	-177.3	175.7	0.8	112.7	R409 K410 L411 H417	R409-R413 WeakPolarHBondContact O-CB 3.49Å; R409-R413 WeakPolarHBondContact O-CG 3.08Å; R409-R413 PolarHBondContact O-N 3.39Å; K410-R413 PolarHBondContact O-N 3Å; L411-R413 PolarHBondContact O-N 2.89Å; R413-H417 WeakPolarHBondContact O-CB 3.3Å; R413-H417 PolarHBondContact O-N 3.44Å
414	F	70.1	Confident	75.5	Confident	121 Å²	121	100.3 Å²	100.3	53%	0.531	48%	0.481	S	S	.	.	H	α-helix	trans	-65	-45	175.2	174.8	-95.1	0	0	0	111.6	K410 L411 T412 H417 F418	K410-F414 WeakPolarHBondContact O-CB 3.36Å; K410-F414 PolarHBondContact O-N 3.48Å; L411-F414 WeakPolarHBondContact O-CB 3.19Å; L411-F414 PolarHBondContact O-N 2.96Å; T412-F414 VanDerWaalsContact C-N 3.28Å; T412-F414 PolarHBondContact O-N 3.25Å; F414-H417 PolarHBondContact O-N 2.73Å; F414-F418 WeakPolarHBondContact O-CB 3.29Å; F414-F418 PolarHBondContact O-N 3.08Å
415	L	71.1	Confident	75.4	Confident	93 Å²	93	97.2 Å²	97.2	49%	0.487	47%	0.465	S	S	.	.	H	α-helix	trans	-65.6	-39.6	176.7	-69.8	174.6	0	0	0	112	L411 T412 F418 K419	L411-L415 HydrophobicContact CD1-CG 4.5Å; L411-L415 HydrophobicContact CG-CD1 4.28Å; L411-L415 WeakPolarHBondContact O-CG 3.29Å; L411-L415 PolarHBondContact O-N 2.87Å; T412-L415 PolarHBondContact O-N 2.98Å; T412-L415 VanDerWaalsContact O-N 3.15Å; L415-F418 PolarHBondContact O-N 3.21Å; L415-K419 VanDerWaalsContact O-CB 3.27Å; L415-K419 WeakPolarHBondContact O-CB 3.45Å; L415-K419 PolarHBondContact O-N 3.35Å
416	D	75.3	Confident	75	Confident	93 Å²	93	99.3 Å²	99.3	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-64.5	-42.4	175.3	-71.6	-24.5	0	0	0	111.2	T412 K419 A420	T412-D416 WeakPolarHBondContact O-CB 3.46Å; T412-D416 VanDerWaalsContact O-CG 3.3Å; T412-D416 PolarHBondContact O-N 3Å; D416-K419 PolarHBondContact O-N 3.04Å; D416-A420 VanDerWaalsContact O-CB 3.3Å; D416-A420 WeakPolarHBondContact O-CB 3.28Å; D416-A420 PolarHBondContact O-N 3.02Å
417	H	73.9	Confident	74.7	Confident	118 Å²	118	100.7 Å²	100.7	55%	0.546	48%	0.48	S	S	.	.	H	α-helix	trans	-63.2	-43.3	174.2	-176.7	71.3	0	0	0	111.6	R413 F414 A420 R421	R413-H417 WeakPolarHBondContact O-CB 3.3Å; R413-H417 PolarHBondContact O-N 3.44Å; F414-H417 PolarHBondContact O-N 2.73Å; H417-A420 PolarHBondContact O-N 3.39Å; H417-R421 WeakPolarHBondContact O-CB 3.5Å; H417-R421 PolarHBondContact O-N 3.39Å
418	F	70.8	Confident	74.6	Confident	110 Å²	110	98.1 Å²	98.1	48%	0.482	47%	0.468	S	S	.	.	H	α-helix	trans	-63.3	-43.5	176.3	-171.7	-102	0	0	0	111.6	F414 L415 R421 L422	F414-F418 WeakPolarHBondContact O-CB 3.29Å; F414-F418 PolarHBondContact O-N 3.08Å; L415-F418 PolarHBondContact O-N 3.21Å; F418-R421 PolarHBondContact O-N 3.15Å; F418-L422 HydrophobicContact CD1-CD1 3.72Å; F418-L422 HydrophobicContact CE1-CD1 3.26Å; F418-L422 HydrophobicContact CE1-CG 4.47Å; F418-L422 HydrophobicContact CZ-CD1 3.88Å; F418-L422 WeakPolarHBondContact O-CB 3.48Å; F418-L422 PolarHBondContact O-N 3.46Å
419	K	71.3	Confident	74.7	Confident	131 Å²	131	97.2 Å²	97.2	57%	0.57	46%	0.463	S	S	*	.	H	α-helix	trans	-62.5	-45.7	175.7	-173.2	-177.3	-175.9	-174.7	0	111.4	L415 D416 R421 L422 I423	L415-K419 VanDerWaalsContact O-CB 3.27Å; L415-K419 WeakPolarHBondContact O-CB 3.45Å; L415-K419 PolarHBondContact O-N 3.35Å; D416-K419 PolarHBondContact O-N 3.04Å; K419-R421 VanDerWaalsContact C-N 3.33Å; K419-R421 PolarHBondContact O-N 3.23Å; K419-L422 WeakPolarHBondContact O-CB 3.45Å; K419-L422 PolarHBondContact O-N 3.02Å; K419-I423 HydrophobicContact CG-CD1 3.99Å; K419-I423 VanDerWaalsContact O-CG1 3.27Å; K419-I423 WeakPolarHBondContact O-CG1 3.14Å; K419-I423 PolarHBondContact O-N 3.28Å
420	A	76.2	Confident	74.6	Confident	57 Å²	57	92.1 Å²	92.1	47%	0.471	45%	0.452	S	S	.	.	H	α-helix	trans	-61.4	-41.4	177.3	0	0	0	0	0	111.8	D416 H417 I423 Y424	D416-A420 VanDerWaalsContact O-CB 3.3Å; D416-A420 WeakPolarHBondContact O-CB 3.28Å; D416-A420 PolarHBondContact O-N 3.02Å; H417-A420 PolarHBondContact O-N 3.39Å; A420-I423 PolarHBondContact O-N 3.25Å; A420-Y424 WeakPolarHBondContact O-CB 3.43Å; A420-Y424 PolarHBondContact O-N 2.96Å
421	R	72.7	Confident	74.8	Confident	66 Å²	66	89.3 Å²	89.3	25%	0.249	45%	0.45	C	S	.	.	H	α-helix	trans	-65.9	-41.9	175.7	-170.8	167.8	179.1	-171.2	-0.3	112.1	H417 F418 K419 Y424 H425 D461 T465	H417-R421 WeakPolarHBondContact O-CB 3.5Å; H417-R421 PolarHBondContact O-N 3.39Å; F418-R421 PolarHBondContact O-N 3.15Å; K419-R421 VanDerWaalsContact C-N 3.33Å; K419-R421 PolarHBondContact O-N 3.23Å; R421-Y424 WeakPolarHBondContact O-CB 3.39Å; R421-Y424 PolarHBondContact O-N 3.04Å; R421-H425 WeakPolarHBondContact CG-NE2 3.4Å; R421-H425 PolarHBondContact O-CD2 3.2Å; R421-H425 PolarHBondContact O-N 3.28Å; R421-D461 IonicContact CZ-OD1 2.64Å; R421-D461 IonicContact CZ-OD2 3.53Å; R421-D461 IonicContact NE-OD1 3.57Å; R421-D461 IonicContact NE-OD2 3.43Å; R421-D461 PolarHBondContact NE-OD2 2.85Å; R421-D461 PolarHBondContact NH2-O 2.85Å; R421-D461 IonicContact NH2-OD1 2.81Å; R421-D461 PolarHBondContact NH2-OD1 2.83Å; R421-D461 IonicContact NH2-OD2 3.5Å; R421-D461 PolarHBondContact NH2-OD2 2.74Å; R421-T465 PolarHBondContact NH1-OG1 3.5Å; R421-T465 PolarHBondContact NH2-OG1 3.31Å
422	L	71.8	Confident	75.1	Confident	81 Å²	81	86.6 Å²	86.6	42%	0.424	44%	0.436	S	S	.	.	H	α-helix	trans	-59.5	-46.8	172.5	-108.1	153.3	0	0	0	111.9	F418 K419 Y424 H425 I426	F418-L422 HydrophobicContact CD1-CD1 3.72Å; F418-L422 HydrophobicContact CE1-CD1 3.26Å; F418-L422 HydrophobicContact CE1-CG 4.47Å; F418-L422 HydrophobicContact CZ-CD1 3.88Å; F418-L422 WeakPolarHBondContact O-CB 3.48Å; F418-L422 PolarHBondContact O-N 3.46Å; K419-L422 WeakPolarHBondContact O-CB 3.45Å; K419-L422 PolarHBondContact O-N 3.02Å; L422-Y424 VanDerWaalsContact C-N 3.34Å; L422-Y424 PolarHBondContact O-N 3.36Å; L422-H425 PolarHBondContact O-N 2.79Å; L422-I426 HydrophobicContact CD2-CD1 4Å; L422-I426 WeakPolarHBondContact O-CB 3.41Å; L422-I426 VanDerWaalsContact O-CG1 3.23Å; L422-I426 WeakPolarHBondContact O-CG1 3.31Å; L422-I426 PolarHBondContact O-N 2.97Å
423	I	76.2	Confident	75.4	Confident	80 Å²	80	85.3 Å²	85.3	41%	0.41	43%	0.428	S	S	.	.	H	α-helix	trans	-62	-43.3	177.1	-68.4	166.3	0	0	0	110.5	K419 A420 H425 I426 N427	K419-I423 HydrophobicContact CG-CD1 3.99Å; K419-I423 VanDerWaalsContact O-CG1 3.27Å; K419-I423 WeakPolarHBondContact O-CG1 3.14Å; K419-I423 PolarHBondContact O-N 3.28Å; A420-I423 PolarHBondContact O-N 3.25Å; I423-H425 VanDerWaalsContact C-N 3.32Å; I423-H425 PolarHBondContact O-N 3.48Å; I423-I426 PolarHBondContact O-N 3.39Å; I423-N427 VanDerWaalsContact O-CB 3.31Å; I423-N427 WeakPolarHBondContact O-CB 3.32Å; I423-N427 VanDerWaalsContact O-CG 3.23Å; I423-N427 PolarHBondContact O-N 2.98Å
424	Y	76.2	Confident	75.6	Confident	148 Å²	148	80.9 Å²	80.9	58%	0.58	42%	0.418	S	S	*	.	H	α-helix	trans	-57.7	-45	175	176.7	-97.3	0	0	0	111.8	A420 R421 L422 G428 Y454	A420-Y424 WeakPolarHBondContact O-CB 3.43Å; A420-Y424 PolarHBondContact O-N 2.96Å; R421-Y424 WeakPolarHBondContact O-CB 3.39Å; R421-Y424 PolarHBondContact O-N 3.04Å; L422-Y424 VanDerWaalsContact C-N 3.34Å; L422-Y424 PolarHBondContact O-N 3.36Å; Y424-G428 PolarHBondContact O-N 3.15Å; Y424-Y454 WeakPolarHBondContact CE1-OH 3.38Å; Y424-Y454 PolarHBondContact O-OH 3.42Å
425	H	75.4	Confident	76	Confident	21 Å²	21	76.5 Å²	76.5	10%	0.097	40%	0.404	C	S	.	.	H	α-helix	trans	-68.1	-42.8	177.7	-67.6	-52.9	0	0	0	113.8	R421 L422 I423 G428 I429 Y454 L458 D461	R421-H425 WeakPolarHBondContact CG-NE2 3.4Å; R421-H425 PolarHBondContact O-CD2 3.2Å; R421-H425 PolarHBondContact O-N 3.28Å; L422-H425 PolarHBondContact O-N 2.79Å; I423-H425 VanDerWaalsContact C-N 3.32Å; I423-H425 PolarHBondContact O-N 3.48Å; H425-G428 PolarHBondContact O-N 3.47Å; H425-I429 VanDerWaalsContact O-CG1 3.27Å; H425-I429 WeakPolarHBondContact O-CG1 3.46Å; H425-I429 PolarHBondContact O-N 3.41Å; H425-Y454 VanDerWaalsContact CA-OH 3.26Å; H425-Y454 WeakPolarHBondContact CA-OH 3.33Å; H425-Y454 HydrophobicContact CB-CE1 4.38Å; H425-Y454 AromaticContact ND1-CE1 3.73Å; H425-Y454 AromaticContact ND1-CZ 3.6Å; H425-Y454 PolarHBondContact ND1-OH 3.22Å; H425-L458 HydrophobicContact CB-CD1 3.97Å; H425-D461 IonicContact CE1-OD2 3.56Å; H425-D461 IonicContact NE2-OD2 2.73Å; H425-D461 PolarHBondContact NE2-OD2 3.3Å
426	I	75	Confident	76.3	Confident	96 Å²	96	73.9 Å²	73.9	49%	0.492	39%	0.392	S	S	.	.	H	α-helix	trans	-62.6	-46.1	176.8	-69.6	165.5	0	0	0	110.3	L422 I423 I429 A430	L422-I426 HydrophobicContact CD2-CD1 4Å; L422-I426 WeakPolarHBondContact O-CB 3.41Å; L422-I426 VanDerWaalsContact O-CG1 3.23Å; L422-I426 WeakPolarHBondContact O-CG1 3.31Å; L422-I426 PolarHBondContact O-N 2.97Å; I423-I426 PolarHBondContact O-N 3.39Å; I426-I429 PolarHBondContact O-N 3.23Å; I426-A430 VanDerWaalsContact O-CB 3.3Å; I426-A430 WeakPolarHBondContact O-CB 3.28Å; I426-A430 PolarHBondContact O-N 3.5Å
427	N	78.2	Confident	76.6	Confident	93 Å²	93	76.4 Å²	76.4	50%	0.497	40%	0.398	S	S	.	.	H	α-helix	trans	-64.9	-41.4	178.4	-71.6	-10.5	0	0	0	111.8	I423 A430 C431	I423-N427 VanDerWaalsContact O-CB 3.31Å; I423-N427 WeakPolarHBondContact O-CB 3.32Å; I423-N427 VanDerWaalsContact O-CG 3.23Å; I423-N427 PolarHBondContact O-N 2.98Å; N427-A430 PolarHBondContact O-N 2.94Å; N427-C431 PolarHBondContact O-N 2.92Å; N427-C431 PolarHBondContact O-SG 2.88Å
428	G	76.9	Confident	76.9	Confident	18 Å²	18	72.7 Å²	72.7	19%	0.186	39%	0.385	C	S	.	.	H	α-helix	trans	-60.7	-45.1	176.2	0	0	0	0	0	112.5	Y424 H425 L432	Y424-G428 PolarHBondContact O-N 3.15Å; H425-G428 PolarHBondContact O-N 3.47Å; G428-L432 WeakPolarHBondContact O-CD1 3.38Å; G428-L432 WeakPolarHBondContact O-CG 3.24Å; G428-L432 PolarHBondContact O-N 3.25Å
429	I	77.1	Confident	77.3	Confident	63 Å²	63	73.6 Å²	73.6	32%	0.323	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-44.3	175.8	-67.1	166.3	0	0	0	110.5	H425 I426 C431 L432 V433 L451 Y454 L458	H425-I429 VanDerWaalsContact O-CG1 3.27Å; H425-I429 WeakPolarHBondContact O-CG1 3.46Å; H425-I429 PolarHBondContact O-N 3.41Å; I426-I429 PolarHBondContact O-N 3.23Å; I429-C431 PolarHBondContact O-N 3.04Å; I429-L432 PolarHBondContact O-N 2.95Å; I429-V433 HydrophobicContact CG2-CG2 4.01Å; I429-V433 WeakPolarHBondContact O-CB 3.41Å; I429-V433 VanDerWaalsContact O-CG2 3.24Å; I429-V433 WeakPolarHBondContact O-CG2 3.4Å; I429-V433 PolarHBondContact O-N 2.87Å; I429-L451 HydrophobicContact CG2-CD1 4.27Å; I429-Y454 HydrophobicContact CD1-CE1 4.41Å; I429-Y454 HydrophobicContact CG1-CD1 3.79Å; I429-Y454 HydrophobicContact CG1-CE1 3.86Å; I429-L458 HydrophobicContact CD1-CD1 4.4Å
430	A	78.5	Confident	77.8	Confident	41 Å²	41	71 Å²	71	34%	0.339	40%	0.398	S	S	.	.	H	α-helix	trans	-59.5	-48.2	179.6	0	0	0	0	0	112	I426 N427 L432 V433 D434	I426-A430 VanDerWaalsContact O-CB 3.3Å; I426-A430 WeakPolarHBondContact O-CB 3.28Å; I426-A430 PolarHBondContact O-N 3.5Å; N427-A430 PolarHBondContact O-N 2.94Å; A430-L432 VanDerWaalsContact C-N 3.3Å; A430-L432 PolarHBondContact O-N 3.3Å; A430-V433 PolarHBondContact O-N 2.88Å; A430-D434 WeakPolarHBondContact O-CB 3.15Å; A430-D434 PolarHBondContact O-N 2.8Å
431	C	80.2	Confident	78.1	Confident	90 Å²	90	75.5 Å²	75.5	61%	0.608	41%	0.409	S	S	*	.	H	α-helix	trans	-58.8	-41.1	177.3	-70.2	0	0	0	0	112.5	N427 I429 D434 A435	N427-C431 PolarHBondContact O-N 2.92Å; N427-C431 PolarHBondContact O-SG 2.88Å; I429-C431 PolarHBondContact O-N 3.04Å; C431-D434 PolarHBondContact O-N 2.74Å; C431-A435 PolarHBondContact O-N 2.79Å
432	L	79	Confident	78.6	Confident	37 Å²	37	77.5 Å²	77.5	19%	0.194	42%	0.424	C	S	.	.	H	α-helix	trans	-72	-39.2	179.4	-69.5	167.5	0	0	0	111.6	G428 I429 A430 D434 A435 T436 L451 Y454	G428-L432 WeakPolarHBondContact O-CD1 3.38Å; G428-L432 WeakPolarHBondContact O-CG 3.24Å; G428-L432 PolarHBondContact O-N 3.25Å; I429-L432 PolarHBondContact O-N 2.95Å; A430-L432 VanDerWaalsContact C-N 3.3Å; A430-L432 PolarHBondContact O-N 3.3Å; L432-D434 VanDerWaalsContact C-N 3.31Å; L432-D434 PolarHBondContact O-N 3.41Å; L432-A435 WeakPolarHBondContact O-CB 3.25Å; L432-A435 PolarHBondContact O-N 2.88Å; L432-T436 WeakPolarHBondContact O-CG2 3.19Å; L432-T436 PolarHBondContact O-N 2.87Å; L432-L451 HydrophobicContact CB-CB 4.41Å; L432-L451 HydrophobicContact CB-CD1 4.12Å; L432-L451 HydrophobicContact CD1-CD1 4.5Å; L432-Y454 HydrophobicContact CD1-CD2 4.25Å; L432-Y454 HydrophobicContact CD1-CG 4.07Å
433	V	80.8	Confident	79	Confident	50 Å²	50	76.9 Å²	76.9	30%	0.303	42%	0.421	S	S	.	.	H	α-helix	trans	-66.7	-32.7	174.7	169.6	0	0	0	0	111.7	I429 A430 T436 K437 L451	I429-V433 HydrophobicContact CG2-CG2 4.01Å; I429-V433 WeakPolarHBondContact O-CB 3.41Å; I429-V433 VanDerWaalsContact O-CG2 3.24Å; I429-V433 WeakPolarHBondContact O-CG2 3.4Å; I429-V433 PolarHBondContact O-N 2.87Å; A430-V433 PolarHBondContact O-N 2.88Å; V433-T436 WeakPolarHBondContact CA-OG1 3.32Å; V433-T436 PolarHBondContact O-N 2.87Å; V433-T436 PolarHBondContact O-OG1 2.99Å; V433-K437 WeakPolarHBondContact O-CG 3.47Å; V433-K437 PolarHBondContact O-N 3.17Å; V433-L451 HydrophobicContact CG2-CD1 4.37Å
434	D	80.9	Confident	79	Confident	92 Å²	92	74.7 Å²	74.7	49%	0.492	41%	0.411	S	S	.	.	H	α-helix	trans	-73.9	-34.9	174.1	-72.1	-22.8	0	0	0	111.5	A430 C431 L432 T436 K437	A430-D434 WeakPolarHBondContact O-CB 3.15Å; A430-D434 PolarHBondContact O-N 2.8Å; C431-D434 PolarHBondContact O-N 2.74Å; L432-D434 VanDerWaalsContact C-N 3.31Å; L432-D434 PolarHBondContact O-N 3.41Å; D434-T436 VanDerWaalsContact C-N 3.3Å; D434-T436 PolarHBondContact O-N 3.2Å; D434-K437 PolarHBondContact O-N 2.85Å; D434-K437 VanDerWaalsContact O-N 3.16Å; D434-K437 IonicContact OD1-NZ 2.94Å; D434-K437 PolarHBondContact OD1-NZ 3.15Å
435	A	78.5	Confident	79.2	Confident	28 Å²	28	76.5 Å²	76.5	23%	0.231	42%	0.417	C	S	.	.	H	α-helix	trans	-61.9	-36.5	170.8	0	0	0	0	0	112.3	C431 L432 K437 S438 I443	C431-A435 PolarHBondContact O-N 2.79Å; L432-A435 WeakPolarHBondContact O-CB 3.25Å; L432-A435 PolarHBondContact O-N 2.88Å; A435-K437 PolarHBondContact O-N 3.27Å; A435-S438 VanDerWaalsContact O-CB 3.25Å; A435-S438 WeakPolarHBondContact O-CB 3.28Å; A435-S438 PolarHBondContact O-N 3.21Å; A435-S438 VanDerWaalsContact O-N 3.14Å; A435-I443 HydrophobicContact CB-CG2 4.14Å
436	T	77.1	Confident	79.6	Confident	38 Å²	38	81.8 Å²	81.8	23%	0.233	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-11.1	176.8	60.9	0	0	0	0	114.3	L432 V433 D434 L448	L432-T436 WeakPolarHBondContact O-CG2 3.19Å; L432-T436 PolarHBondContact O-N 2.87Å; V433-T436 WeakPolarHBondContact CA-OG1 3.32Å; V433-T436 PolarHBondContact O-N 2.87Å; V433-T436 PolarHBondContact O-OG1 2.99Å; D434-T436 VanDerWaalsContact C-N 3.3Å; D434-T436 PolarHBondContact O-N 3.2Å; T436-L448 HydrophobicContact CG2-CB 4.48Å; T436-L448 HydrophobicContact CG2-CD2 3.84Å; T436-L448 HydrophobicContact CG2-CG 3.77Å
437	K	81.5	Confident	79.8	Confident	147 Å²	147	77.4 Å²	77.4	64%	0.639	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-2.6	171.5	-63.5	170.5	-165.5	156.9	0	113.3	V433 D434 A435	V433-K437 WeakPolarHBondContact O-CG 3.47Å; V433-K437 PolarHBondContact O-N 3.17Å; D434-K437 PolarHBondContact O-N 2.85Å; D434-K437 VanDerWaalsContact O-N 3.16Å; D434-K437 IonicContact OD1-NZ 2.94Å; D434-K437 PolarHBondContact OD1-NZ 3.15Å; A435-K437 PolarHBondContact O-N 3.27Å
438	S	81.1	Confident	79.9	Confident	39 Å²	39	77.6 Å²	77.6	27%	0.273	42%	0.421	S	S	.	.			trans	-61.2	151	177.8	-173.4	0	0	0	0	111.5	A435 D440 V444	A435-S438 VanDerWaalsContact O-CB 3.25Å; A435-S438 WeakPolarHBondContact O-CB 3.28Å; A435-S438 PolarHBondContact O-N 3.21Å; A435-S438 VanDerWaalsContact O-N 3.14Å; S438-D440 VanDerWaalsContact C-N 3.28Å; S438-D440 PolarHBondContact OG-N 2.8Å; S438-V444 WeakPolarHBondContact O-CG2 3.37Å
439	S	78.1	Confident	80.3	Confident	129 Å²	129	84.4 Å²	84.4	90%	0.902	44%	0.442	S	S	*	.	S	Bend	trans	-77.1	-16.3	172.5	49.5	0	0	0	0	112.9
440	D	81.7	Confident	80.5	Confident	78 Å²	78	82.3 Å²	82.3	42%	0.417	44%	0.436	S	S	.	.			trans	-82.8	116.2	177.3	-172.6	-21.1	0	0	0	111	S438 L442 I443 V444	S438-D440 VanDerWaalsContact C-N 3.28Å; S438-D440 PolarHBondContact OG-N 2.8Å; D440-L442 PolarHBondContact O-N 2.81Å; D440-L442 WeakPolarHBondContact OD1-CB 3.41Å; D440-L442 PolarHBondContact OD1-N 3.34Å; D440-I443 HydrophobicContact CB-CB 4.13Å; D440-I443 HydrophobicContact CB-CD1 3.8Å; D440-I443 HydrophobicContact CB-CG1 3.84Å; D440-I443 PolarHBondContact O-N 3.22Å; D440-V444 WeakPolarHBondContact O-CG2 3.36Å; D440-V444 PolarHBondContact O-N 3.43Å
441	Q	83.2	Confident	80.6	Confident	150 Å²	150	82 Å²	82	70%	0.701	43%	0.429	S	S	*	.	H	α-helix	trans	-59	-29.7	179.7	-72	-170	-2.7	0	0	113.4	R445	Q441-R445 WeakPolarHBondContact O-CG 3.38Å; Q441-R445 PolarHBondContact O-N 2.75Å
442	L	83.7	Confident	80.7	Confident	109 Å²	109	82.6 Å²	82.6	57%	0.571	42%	0.422	S	S	*	.	H	α-helix	trans	-70.4	-45.1	179	-163.1	146.3	0	0	0	110.1	D440 V444 R445 E446	D440-L442 PolarHBondContact O-N 2.81Å; D440-L442 WeakPolarHBondContact OD1-CB 3.41Å; D440-L442 PolarHBondContact OD1-N 3.34Å; L442-V444 VanDerWaalsContact C-N 3.33Å; L442-V444 PolarHBondContact O-N 3.24Å; L442-R445 PolarHBondContact O-N 2.93Å; L442-E446 HydrophobicContact CD2-CG 4.32Å; L442-E446 PolarHBondContact O-N 2.73Å
443	I	80	Confident	81	Confident	67 Å²	67	87.5 Å²	87.5	34%	0.344	44%	0.442	S	S	.	.	H	α-helix	trans	-61.7	-41.7	174.8	-59.6	-179.6	0	0	0	110.8	A435 D440 R445 E446 G447	A435-I443 HydrophobicContact CB-CG2 4.14Å; D440-I443 HydrophobicContact CB-CB 4.13Å; D440-I443 HydrophobicContact CB-CD1 3.8Å; D440-I443 HydrophobicContact CB-CG1 3.84Å; D440-I443 PolarHBondContact O-N 3.22Å; I443-R445 PolarHBondContact O-N 2.91Å; I443-E446 PolarHBondContact O-N 2.92Å; I443-G447 PolarHBondContact O-N 2.92Å
444	V	76.3	Confident	81	Confident	35 Å²	35	86.5 Å²	86.5	21%	0.212	43%	0.433	C	S	.	.	H	α-helix	trans	-63.4	-43.2	178.3	174.6	0	0	0	0	111.5	S438 D440 L442 G447 L448	S438-V444 WeakPolarHBondContact O-CG2 3.37Å; D440-V444 WeakPolarHBondContact O-CG2 3.36Å; D440-V444 PolarHBondContact O-N 3.43Å; L442-V444 VanDerWaalsContact C-N 3.33Å; L442-V444 PolarHBondContact O-N 3.24Å; V444-G447 PolarHBondContact O-N 3.05Å; V444-L448 HydrophobicContact CG1-CD1 4.23Å; V444-L448 WeakPolarHBondContact O-CG 3.19Å; V444-L448 PolarHBondContact O-N 3.36Å
445	R	80.9	Confident	80.9	Confident	186 Å²	186	86.1 Å²	86.1	70%	0.702	43%	0.43	S	S	*	.	H	α-helix	trans	-65.3	-43.8	177.1	-77.7	-177.7	179.7	-177.3	2.2	112.1	Q441 L442 I443 G447 L448 Y449	Q441-R445 WeakPolarHBondContact O-CG 3.38Å; Q441-R445 PolarHBondContact O-N 2.75Å; L442-R445 PolarHBondContact O-N 2.93Å; I443-R445 PolarHBondContact O-N 2.91Å; R445-G447 VanDerWaalsContact C-N 3.35Å; R445-L448 PolarHBondContact O-N 2.87Å; R445-Y449 WeakPolarHBondContact O-CB 3.17Å; R445-Y449 PolarHBondContact O-N 3.43Å
446	E	82.2	Confident	81.2	Confident	131 Å²	131	90.7 Å²	90.7	61%	0.612	45%	0.445	S	S	*	.	H	α-helix	trans	-64.4	-39.5	175.4	-73.2	-168.5	166.6	0	0	111.9	L442 I443 Y449 G450	L442-E446 HydrophobicContact CD2-CG 4.32Å; L442-E446 PolarHBondContact O-N 2.73Å; I443-E446 PolarHBondContact O-N 2.92Å; E446-Y449 PolarHBondContact O-N 2.94Å; E446-G450 PolarHBondContact O-N 2.9Å
447	G	79.1	Confident	81.5	Confident	4 Å²	4	93.4 Å²	93.4	4%	0.041	46%	0.455	C	S	.	.	H	α-helix	trans	-62.2	-45.4	175	0	0	0	0	0	112.7	I443 V444 R445 G450 L451	I443-G447 PolarHBondContact O-N 2.92Å; V444-G447 PolarHBondContact O-N 3.05Å; R445-G447 VanDerWaalsContact C-N 3.35Å; G447-G450 PolarHBondContact O-N 2.81Å; G447-L451 WeakPolarHBondContact O-CB 3.28Å; G447-L451 PolarHBondContact O-N 2.94Å
448	L	81.2	Confident	81.3	Confident	98 Å²	98	88.4 Å²	88.4	51%	0.513	44%	0.435	S	S	.	.	H	α-helix	trans	-64.9	-45.1	176.4	-76.9	173.2	0	0	0	112	T436 V444 R445 G450 L451 E452	T436-L448 HydrophobicContact CG2-CB 4.48Å; T436-L448 HydrophobicContact CG2-CD2 3.84Å; T436-L448 HydrophobicContact CG2-CG 3.77Å; V444-L448 HydrophobicContact CG1-CD1 4.23Å; V444-L448 WeakPolarHBondContact O-CG 3.19Å; V444-L448 PolarHBondContact O-N 3.36Å; R445-L448 PolarHBondContact O-N 2.87Å; L448-G450 VanDerWaalsContact C-N 3.33Å; L448-G450 PolarHBondContact O-N 2.77Å; L448-L451 PolarHBondContact O-N 2.9Å; L448-E452 PolarHBondContact O-N 3.47Å
449	Y	84.5	Confident	81.3	Confident	160 Å²	160	90.8 Å²	90.8	63%	0.627	44%	0.443	S	S	*	.	H	α-helix	trans	-63.1	-41.5	175.9	179.5	-105.6	0	0	0	111.5	R445 E446 L451 E452 K453	R445-Y449 WeakPolarHBondContact O-CB 3.17Å; R445-Y449 PolarHBondContact O-N 3.43Å; E446-Y449 PolarHBondContact O-N 2.94Å; Y449-L451 VanDerWaalsContact C-N 3.34Å; Y449-L451 PolarHBondContact O-N 3.32Å; Y449-E452 PolarHBondContact O-N 3.48Å; Y449-K453 WeakPolarHBondContact O-CB 3.39Å; Y449-K453 PolarHBondContact O-N 2.81Å
450	G	81.6	Confident	81.7	Confident	19 Å²	19	87.3 Å²	87.3	20%	0.196	42%	0.422	C	S	.	.	H	α-helix	trans	-59.5	-43.3	172.9	0	0	0	0	0	112	E446 G447 L448 K453 Y454	E446-G450 PolarHBondContact O-N 2.9Å; G447-G450 PolarHBondContact O-N 2.81Å; L448-G450 VanDerWaalsContact C-N 3.33Å; L448-G450 PolarHBondContact O-N 2.77Å; G450-K453 PolarHBondContact O-N 3.21Å; G450-Y454 VanDerWaalsContact O-CB 3.28Å; G450-Y454 WeakPolarHBondContact O-CB 3.47Å; G450-Y454 PolarHBondContact O-N 3.4Å
451	L	81	Confident	81.4	Confident	36 Å²	36	85.5 Å²	85.5	19%	0.188	41%	0.413	C	S	.	.	H	α-helix	trans	-64.6	-44.7	178.1	-170	70.7	0	0	0	111.9	I429 L432 V433 G447 L448 Y449 K453 Y454 I455	I429-L451 HydrophobicContact CG2-CD1 4.27Å; L432-L451 HydrophobicContact CB-CB 4.41Å; L432-L451 HydrophobicContact CB-CD1 4.12Å; L432-L451 HydrophobicContact CD1-CD1 4.5Å; V433-L451 HydrophobicContact CG2-CD1 4.37Å; G447-L451 WeakPolarHBondContact O-CB 3.28Å; G447-L451 PolarHBondContact O-N 2.94Å; L448-L451 PolarHBondContact O-N 2.9Å; Y449-L451 VanDerWaalsContact C-N 3.34Å; Y449-L451 PolarHBondContact O-N 3.32Å; L451-K453 PolarHBondContact O-N 2.84Å; L451-Y454 PolarHBondContact O-N 2.77Å; L451-I455 HydrophobicContact CG-CD1 4.12Å; L451-I455 WeakPolarHBondContact O-CG1 3.25Å; L451-I455 PolarHBondContact O-N 3.29Å
452	E	82.5	Confident	81	Confident	101 Å²	101	82.3 Å²	82.3	47%	0.472	40%	0.399	S	S	.	.	H	α-helix	trans	-61.5	-45	176.3	-167.2	-167.9	156.3	0	0	111.2	L448 Y449 Y454 I455 K456	L448-E452 PolarHBondContact O-N 3.47Å; Y449-E452 PolarHBondContact O-N 3.48Å; E452-Y454 VanDerWaalsContact C-N 3.3Å; E452-Y454 PolarHBondContact O-N 3.3Å; E452-I455 PolarHBondContact O-N 3.07Å; E452-K456 WeakPolarHBondContact O-CG 3.5Å; E452-K456 PolarHBondContact O-N 3Å; E452-K456 VanDerWaalsContact OE1-CE 3.28Å; E452-K456 WeakPolarHBondContact OE1-CE 3.36Å; E452-K456 IonicContact OE1-NZ 2.73Å; E452-K456 PolarHBondContact OE1-NZ 2.93Å
453	K	86	Confident	80.9	Confident	140 Å²	140	81.6 Å²	81.6	61%	0.609	40%	0.396	S	S	*	.	H	α-helix	trans	-62.5	-38.9	175.5	-171.1	177.7	179	-178.6	0	111.5	Y449 G450 L451 K456 H457	Y449-K453 WeakPolarHBondContact O-CB 3.39Å; Y449-K453 PolarHBondContact O-N 2.81Å; G450-K453 PolarHBondContact O-N 3.21Å; L451-K453 PolarHBondContact O-N 2.84Å; K453-K456 PolarHBondContact O-N 3.44Å; K453-H457 WeakPolarHBondContact O-CB 3.11Å; K453-H457 PolarHBondContact O-N 3.1Å
454	Y	80.2	Confident	81	Confident	30 Å²	30	80.8 Å²	80.8	12%	0.118	40%	0.399	C	S	.	.	H	α-helix	trans	-67.6	-43.1	178.6	-159.9	-92.7	0	0	0	112.2	Y424 H425 I429 L432 G450 L451 E452 H457 L458	Y424-Y454 WeakPolarHBondContact CE1-OH 3.38Å; Y424-Y454 PolarHBondContact O-OH 3.42Å; H425-Y454 VanDerWaalsContact CA-OH 3.26Å; H425-Y454 WeakPolarHBondContact CA-OH 3.33Å; H425-Y454 HydrophobicContact CB-CE1 4.38Å; H425-Y454 AromaticContact ND1-CE1 3.73Å; H425-Y454 AromaticContact ND1-CZ 3.6Å; H425-Y454 PolarHBondContact ND1-OH 3.22Å; I429-Y454 HydrophobicContact CD1-CE1 4.41Å; I429-Y454 HydrophobicContact CG1-CD1 3.79Å; I429-Y454 HydrophobicContact CG1-CE1 3.86Å; L432-Y454 HydrophobicContact CD1-CD2 4.25Å; L432-Y454 HydrophobicContact CD1-CG 4.07Å; G450-Y454 VanDerWaalsContact O-CB 3.28Å; G450-Y454 WeakPolarHBondContact O-CB 3.47Å; G450-Y454 PolarHBondContact O-N 3.4Å; L451-Y454 PolarHBondContact O-N 2.77Å; E452-Y454 VanDerWaalsContact C-N 3.3Å; E452-Y454 PolarHBondContact O-N 3.3Å; Y454-H457 WeakPolarHBondContact O-CB 3.19Å; Y454-H457 PolarHBondContact O-N 3.05Å; Y454-L458 HydrophobicContact CE1-CD1 4.48Å; Y454-L458 WeakPolarHBondContact O-CB 3.31Å; Y454-L458 PolarHBondContact O-N 2.56Å
455	I	78.7	Confident	80.8	Confident	83 Å²	83	81.5 Å²	81.5	43%	0.426	40%	0.403	S	S	.	.	H	α-helix	trans	-62.5	-43.8	175.9	-69.2	168	0	0	0	110.4	L451 E452 H457 L458 I459	L451-I455 HydrophobicContact CG-CD1 4.12Å; L451-I455 WeakPolarHBondContact O-CG1 3.25Å; L451-I455 PolarHBondContact O-N 3.29Å; E452-I455 PolarHBondContact O-N 3.07Å; I455-H457 VanDerWaalsContact C-N 3.32Å; I455-H457 PolarHBondContact O-N 3.44Å; I455-L458 PolarHBondContact O-N 3.42Å; I455-I459 HydrophobicContact CG2-CD1 3.96Å; I455-I459 WeakPolarHBondContact O-CG1 3.33Å; I455-I459 PolarHBondContact O-N 2.95Å
456	K	85.6	Confident	80.5	Confident	124 Å²	124	79.7 Å²	79.7	54%	0.539	40%	0.397	S	S	.	.	H	α-helix	trans	-60	-42.8	174.1	-72.7	176.3	-173.8	168.3	0	111.8	E452 K453 I459 A460	E452-K456 WeakPolarHBondContact O-CG 3.5Å; E452-K456 PolarHBondContact O-N 3Å; E452-K456 VanDerWaalsContact OE1-CE 3.28Å; E452-K456 WeakPolarHBondContact OE1-CE 3.36Å; E452-K456 IonicContact OE1-NZ 2.73Å; E452-K456 PolarHBondContact OE1-NZ 2.93Å; K453-K456 PolarHBondContact O-N 3.44Å; K456-I459 PolarHBondContact O-N 3.22Å; K456-A460 WeakPolarHBondContact O-CB 3.43Å; K456-A460 PolarHBondContact O-N 3.49Å
457	H	82.1	Confident	80.5	Confident	96 Å²	96	80 Å²	80	44%	0.444	40%	0.397	S	S	.	.	H	α-helix	trans	-62.2	-44.6	175	-179.5	65.4	0	0	0	111.6	K453 Y454 I455 I459 A460 D461	K453-H457 WeakPolarHBondContact O-CB 3.11Å; K453-H457 PolarHBondContact O-N 3.1Å; Y454-H457 WeakPolarHBondContact O-CB 3.19Å; Y454-H457 PolarHBondContact O-N 3.05Å; I455-H457 VanDerWaalsContact C-N 3.32Å; I455-H457 PolarHBondContact O-N 3.44Å; H457-I459 PolarHBondContact O-N 2.95Å; H457-A460 PolarHBondContact O-N 3.27Å; H457-D461 WeakPolarHBondContact O-CB 3.39Å; H457-D461 PolarHBondContact O-N 2.8Å
458	L	77.6	Confident	80.3	Confident	42 Å²	42	84.5 Å²	84.5	22%	0.22	42%	0.419	C	S	.	.	H	α-helix	trans	-62.6	-41.9	178.4	-174.1	142	0	0	0	112.4	H425 I429 Y454 I455 D461 M462	H425-L458 HydrophobicContact CB-CD1 3.97Å; I429-L458 HydrophobicContact CD1-CD1 4.4Å; Y454-L458 HydrophobicContact CE1-CD1 4.48Å; Y454-L458 WeakPolarHBondContact O-CB 3.31Å; Y454-L458 PolarHBondContact O-N 2.56Å; I455-L458 PolarHBondContact O-N 3.42Å; L458-D461 PolarHBondContact O-N 2.83Å; L458-M462 HydrophobicContact CD2-CG 4.32Å; L458-M462 HydrophobicContact CD2-SD 3.68Å; L458-M462 WeakPolarHBondContact O-CB 3.45Å; L458-M462 WeakPolarHBondContact O-CG 3.45Å; L458-M462 PolarHBondContact O-N 3.37Å
459	I	81.2	Confident	79.8	Confident	89 Å²	89	86.1 Å²	86.1	46%	0.456	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-44.6	174.8	-67.4	167.6	0	0	0	110.7	I455 K456 H457 D461 M462 N463	I455-I459 HydrophobicContact CG2-CD1 3.96Å; I455-I459 WeakPolarHBondContact O-CG1 3.33Å; I455-I459 PolarHBondContact O-N 2.95Å; K456-I459 PolarHBondContact O-N 3.22Å; H457-I459 PolarHBondContact O-N 2.95Å; I459-D461 VanDerWaalsContact C-N 3.3Å; I459-D461 PolarHBondContact O-N 3.43Å; I459-M462 PolarHBondContact O-N 2.86Å; I459-N463 WeakPolarHBondContact O-CB 3.34Å; I459-N463 VanDerWaalsContact O-CG 3.26Å; I459-N463 PolarHBondContact O-N 2.99Å; I459-N463 PolarHBondContact O-ND2 2.9Å
460	A	85.9	Confident	79.3	Confident	56 Å²	56	84.3 Å²	84.3	46%	0.463	42%	0.415	S	S	.	.	H	α-helix	trans	-61.8	-41.1	176.9	0	0	0	0	0	111.8	K456 H457 N463 A464	K456-A460 WeakPolarHBondContact O-CB 3.43Å; K456-A460 PolarHBondContact O-N 3.49Å; H457-A460 PolarHBondContact O-N 3.27Å; A460-N463 PolarHBondContact O-N 3.48Å; A460-A464 WeakPolarHBondContact O-CB 3.31Å; A460-A464 PolarHBondContact O-N 3.49Å
461	D	76.8	Confident	79.3	Confident	39 Å²	39	87.6 Å²	87.6	21%	0.209	43%	0.428	C	S	.	.	H	α-helix	trans	-68.2	-39.5	179.8	-166.2	48	0	0	0	112.2	R421 H425 H457 L458 I459 T465	R421-D461 IonicContact CZ-OD1 2.64Å; R421-D461 IonicContact CZ-OD2 3.53Å; R421-D461 IonicContact NE-OD1 3.57Å; R421-D461 IonicContact NE-OD2 3.43Å; R421-D461 PolarHBondContact NE-OD2 2.85Å; R421-D461 PolarHBondContact NH2-O 2.85Å; R421-D461 IonicContact NH2-OD1 2.81Å; R421-D461 PolarHBondContact NH2-OD1 2.83Å; R421-D461 IonicContact NH2-OD2 3.5Å; R421-D461 PolarHBondContact NH2-OD2 2.74Å; H425-D461 IonicContact CE1-OD2 3.56Å; H425-D461 IonicContact NE2-OD2 2.73Å; H425-D461 PolarHBondContact NE2-OD2 3.3Å; H457-D461 WeakPolarHBondContact O-CB 3.39Å; H457-D461 PolarHBondContact O-N 2.8Å; L458-D461 PolarHBondContact O-N 2.83Å; I459-D461 VanDerWaalsContact C-N 3.3Å; I459-D461 PolarHBondContact O-N 3.43Å; D461-T465 PolarHBondContact O-N 2.77Å; D461-T465 VanDerWaalsContact O-N 3.07Å; D461-T465 PolarHBondContact O-OG1 3.45Å
462	M	74.7	Confident	78.9	Confident	83 Å²	83	90.1 Å²	90.1	41%	0.409	44%	0.439	S	S	.	.	H	α-helix	trans	-63.5	-47.7	170.4	-76.2	-176.3	65.4	0	0	111.9	L458 I459 A464 T465 Y466	L458-M462 HydrophobicContact CD2-CG 4.32Å; L458-M462 HydrophobicContact CD2-SD 3.68Å; L458-M462 WeakPolarHBondContact O-CB 3.45Å; L458-M462 WeakPolarHBondContact O-CG 3.45Å; L458-M462 PolarHBondContact O-N 3.37Å; I459-M462 PolarHBondContact O-N 2.86Å; M462-A464 VanDerWaalsContact C-N 3.33Å; M462-A464 PolarHBondContact O-N 2.76Å; M462-T465 WeakPolarHBondContact O-CB 3.22Å; M462-T465 PolarHBondContact O-N 2.96Å; M462-T465 VanDerWaalsContact O-N 3.09Å; M462-Y466 HydrophobicContact CB-CE2 4.33Å; M462-Y466 HydrophobicContact CE-CE2 3.98Å; M462-Y466 WeakPolarHBondContact O-CD2 3.46Å; M462-Y466 PolarHBondContact O-N 3.32Å
463	N	80.9	Confident	78.3	Confident	95 Å²	95	89.2 Å²	89.2	51%	0.508	44%	0.437	S	S	.	.	H	α-helix	trans	-61.6	-40.4	178.2	-74	-20.5	0	0	0	112.2	I459 A460 T465 Y466 K467	I459-N463 WeakPolarHBondContact O-CB 3.34Å; I459-N463 VanDerWaalsContact O-CG 3.26Å; I459-N463 PolarHBondContact O-N 2.99Å; I459-N463 PolarHBondContact O-ND2 2.9Å; A460-N463 PolarHBondContact O-N 3.48Å; N463-T465 VanDerWaalsContact C-N 3.31Å; N463-T465 PolarHBondContact O-N 3.05Å; N463-Y466 PolarHBondContact O-N 2.91Å; N463-K467 WeakPolarHBondContact O-CB 3.46Å; N463-K467 PolarHBondContact O-N 3.3Å
464	A	81.2	Confident	77.9	Confident	49 Å²	49	85.6 Å²	85.6	41%	0.405	43%	0.427	S	S	.	.	H	α-helix	trans	-61.3	-41.2	173.6	0	0	0	0	0	111.6	A460 M462 K467 I468	A460-A464 WeakPolarHBondContact O-CB 3.31Å; A460-A464 PolarHBondContact O-N 3.49Å; M462-A464 VanDerWaalsContact C-N 3.33Å; M462-A464 PolarHBondContact O-N 2.76Å; A464-K467 PolarHBondContact O-N 3.4Å; A464-I468 WeakPolarHBondContact O-CG1 3.38Å; A464-I468 PolarHBondContact O-N 2.99Å
465	T	73.2	Confident	77.8	Confident	50 Å²	50	88.4 Å²	88.4	31%	0.307	44%	0.444	S	S	.	.	H	α-helix	trans	-67.2	-41.7	177.8	-53.4	0	0	0	0	112	R421 D461 M462 N463 I468 R469	R421-T465 PolarHBondContact NH1-OG1 3.5Å; R421-T465 PolarHBondContact NH2-OG1 3.31Å; D461-T465 PolarHBondContact O-N 2.77Å; D461-T465 VanDerWaalsContact O-N 3.07Å; D461-T465 PolarHBondContact O-OG1 3.45Å; M462-T465 WeakPolarHBondContact O-CB 3.22Å; M462-T465 PolarHBondContact O-N 2.96Å; M462-T465 VanDerWaalsContact O-N 3.09Å; N463-T465 VanDerWaalsContact C-N 3.31Å; N463-T465 PolarHBondContact O-N 3.05Å; T465-I468 PolarHBondContact O-N 3.37Å; T465-R469 WeakPolarHBondContact O-CB 3.45Å; T465-R469 PolarHBondContact O-N 3.19Å
466	Y	74.9	Confident	77.6	Confident	148 Å²	148	88.6 Å²	88.6	58%	0.58	45%	0.445	S	S	*	.	H	α-helix	trans	-61.2	-43.3	174.2	-74	-53.2	0	0	0	111.8	M462 N463 I468 R469 E470	M462-Y466 HydrophobicContact CB-CE2 4.33Å; M462-Y466 HydrophobicContact CE-CE2 3.98Å; M462-Y466 WeakPolarHBondContact O-CD2 3.46Å; M462-Y466 PolarHBondContact O-N 3.32Å; N463-Y466 PolarHBondContact O-N 2.91Å; Y466-I468 PolarHBondContact O-N 2.82Å; Y466-R469 WeakPolarHBondContact O-CB 3.28Å; Y466-R469 PolarHBondContact O-N 3.13Å; Y466-R469 VanDerWaalsContact O-N 3.13Å; Y466-E470 WeakPolarHBondContact O-CB 3.45Å; Y466-E470 PolarHBondContact O-N 2.95Å
467	K	81	Confident	76.8	Confident	138 Å²	138	86.2 Å²	86.2	60%	0.6	44%	0.443	S	S	*	.	H	α-helix	trans	-63.1	-39.3	176.5	-168.6	173	-174.6	174.5	0	112.7	N463 A464 R469 N471	N463-K467 WeakPolarHBondContact O-CB 3.46Å; N463-K467 PolarHBondContact O-N 3.3Å; A464-K467 PolarHBondContact O-N 3.4Å; K467-R469 VanDerWaalsContact C-N 3.35Å; K467-N471 WeakPolarHBondContact O-CB 3.48Å; K467-N471 PolarHBondContact O-N 3.41Å; K467-N471 PolarHBondContact O-ND2 3.42Å; K467-N471 VanDerWaalsContact O-ND2 3.14Å
468	I	75.8	Confident	76.6	Confident	99 Å²	99	89 Å²	89	51%	0.508	45%	0.449	S	S	.	.	H	α-helix	trans	-62.8	-44	172.9	-69	162.1	0	0	0	110.3	A464 T465 Y466 N471 Q472	A464-I468 WeakPolarHBondContact O-CG1 3.38Å; A464-I468 PolarHBondContact O-N 2.99Å; T465-I468 PolarHBondContact O-N 3.37Å; Y466-I468 PolarHBondContact O-N 2.82Å; I468-N471 PolarHBondContact O-N 3.08Å; I468-Q472 WeakPolarHBondContact O-CG 3.16Å; I468-Q472 PolarHBondContact O-N 3.36Å
469	R	71.2	Confident	76.6	Confident	132 Å²	132	90.2 Å²	90.2	50%	0.498	46%	0.461	S	S	.	.	H	α-helix	trans	-65.8	-41.5	179.8	-174.8	59.5	175.8	175.2	0.2	112.4	T465 Y466 K467 Q472 L473	T465-R469 WeakPolarHBondContact O-CB 3.45Å; T465-R469 PolarHBondContact O-N 3.19Å; Y466-R469 WeakPolarHBondContact O-CB 3.28Å; Y466-R469 PolarHBondContact O-N 3.13Å; Y466-R469 VanDerWaalsContact O-N 3.13Å; K467-R469 VanDerWaalsContact C-N 3.35Å; R469-Q472 WeakPolarHBondContact O-CB 3.43Å; R469-Q472 PolarHBondContact O-N 2.8Å; R469-L473 HydrophobicContact CG-CD1 4.4Å; R469-L473 WeakPolarHBondContact O-CG 3.47Å; R469-L473 PolarHBondContact O-N 3.09Å
470	E	73.7	Confident	76.1	Confident	122 Å²	122	90.5 Å²	90.5	57%	0.57	46%	0.463	S	S	*	.	H	α-helix	trans	-59.1	-49.2	174.3	-176	-177.5	-166.6	0	0	110.8	Y466 Q472 L473 V474	Y466-E470 WeakPolarHBondContact O-CB 3.45Å; Y466-E470 PolarHBondContact O-N 2.95Å; E470-Q472 VanDerWaalsContact C-N 3.3Å; E470-Q472 PolarHBondContact O-N 2.94Å; E470-L473 PolarHBondContact O-N 3.43Å; E470-L473 VanDerWaalsContact O-N 3.11Å; E470-V474 WeakPolarHBondContact O-CG2 3.46Å; E470-V474 PolarHBondContact O-N 3.13Å
471	N	80.9	Confident	75.3	Confident	87 Å²	87	92.6 Å²	92.6	47%	0.465	47%	0.467	S	S	.	.	H	α-helix	trans	-59.1	-39.6	176	-76.7	-35.7	0	0	0	112.6	K467 I468 N475	K467-N471 WeakPolarHBondContact O-CB 3.48Å; K467-N471 PolarHBondContact O-N 3.41Å; K467-N471 PolarHBondContact O-ND2 3.42Å; K467-N471 VanDerWaalsContact O-ND2 3.14Å; I468-N471 PolarHBondContact O-N 3.08Å; N471-N475 WeakPolarHBondContact O-CB 3.31Å; N471-N475 PolarHBondContact O-N 2.65Å; N471-N475 PolarHBondContact O-ND2 3.02Å
472	Q	73.4	Confident	75.2	Confident	89 Å²	89	92.8 Å²	92.8	42%	0.416	48%	0.478	S	S	.	.	H	α-helix	trans	-62.6	-45.6	174.3	-72.7	173.9	-5.9	0	0	111.7	I468 R469 E470 N475 I476	I468-Q472 WeakPolarHBondContact O-CG 3.16Å; I468-Q472 PolarHBondContact O-N 3.36Å; R469-Q472 WeakPolarHBondContact O-CB 3.43Å; R469-Q472 PolarHBondContact O-N 2.8Å; E470-Q472 VanDerWaalsContact C-N 3.3Å; E470-Q472 PolarHBondContact O-N 2.94Å; Q472-N475 PolarHBondContact O-N 3.48Å; Q472-I476 VanDerWaalsContact O-CG1 3.28Å; Q472-I476 WeakPolarHBondContact O-CG1 3.49Å; Q472-I476 PolarHBondContact O-N 2.9Å
473	L	68.3	Low	75.1	Confident	83 Å²	83	94.3 Å²	94.3	44%	0.435	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-44.6	178.4	-71.8	170.7	0	0	0	111.5	R469 E470 N475 I476 C477	R469-L473 HydrophobicContact CG-CD1 4.4Å; R469-L473 WeakPolarHBondContact O-CG 3.47Å; R469-L473 PolarHBondContact O-N 3.09Å; E470-L473 PolarHBondContact O-N 3.43Å; E470-L473 VanDerWaalsContact O-N 3.11Å; L473-N475 VanDerWaalsContact C-N 3.31Å; L473-N475 PolarHBondContact O-N 3.24Å; L473-I476 PolarHBondContact O-N 3.03Å; L473-C477 PolarHBondContact O-N 3.4Å; L473-C477 PolarHBondContact O-SG 3.46Å; L473-C477 VanDerWaalsContact O-SG 3.33Å
474	V	79.1	Confident	74.3	Confident	63 Å²	63	92 Å²	92	38%	0.382	47%	0.472	S	S	.	.	H	α-helix	trans	-59.2	-42.1	175.1	171.2	0	0	0	0	111.2	E470 C477 R478	E470-V474 WeakPolarHBondContact O-CG2 3.46Å; E470-V474 PolarHBondContact O-N 3.13Å; V474-C477 PolarHBondContact O-N 2.86Å; V474-R478 WeakPolarHBondContact O-CB 3.46Å; V474-R478 PolarHBondContact O-N 3.49Å
475	N	77.3	Confident	73.7	Confident	90 Å²	90	95.3 Å²	95.3	48%	0.481	48%	0.478	S	S	.	.	H	α-helix	trans	-66.5	-39	176.9	-73.4	-19.5	0	0	0	112.5	N471 Q472 L473 R478 S479	N471-N475 WeakPolarHBondContact O-CB 3.31Å; N471-N475 PolarHBondContact O-N 2.65Å; N471-N475 PolarHBondContact O-ND2 3.02Å; Q472-N475 PolarHBondContact O-N 3.48Å; L473-N475 VanDerWaalsContact C-N 3.31Å; L473-N475 PolarHBondContact O-N 3.24Å; N475-R478 PolarHBondContact O-N 2.93Å; N475-R478 PolarHBondContact OD1-NH1 2.88Å; N475-S479 WeakPolarHBondContact O-CB 3.18Å; N475-S479 PolarHBondContact O-N 2.98Å
476	I	74.2	Confident	73.4	Confident	87 Å²	87	96 Å²	96	45%	0.446	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-47.5	173.7	-68.8	163.8	0	0	0	110.2	Q472 L473 R478 S479 L480	Q472-I476 VanDerWaalsContact O-CG1 3.28Å; Q472-I476 WeakPolarHBondContact O-CG1 3.49Å; Q472-I476 PolarHBondContact O-N 2.9Å; L473-I476 PolarHBondContact O-N 3.03Å; I476-R478 VanDerWaalsContact C-N 3.32Å; I476-R478 PolarHBondContact O-N 3.28Å; I476-S479 PolarHBondContact O-N 2.9Å; I476-L480 HydrophobicContact CG2-CD1 3.78Å; I476-L480 HydrophobicContact CG2-CG 4.25Å; I476-L480 WeakPolarHBondContact O-CB 3.31Å; I476-L480 WeakPolarHBondContact O-CG 3.33Å; I476-L480 PolarHBondContact O-N 3.43Å
477	C	69.5	Low	72.8	Confident	73 Å²	73	91.9 Å²	91.9	49%	0.493	48%	0.479	S	S	.	.	H	α-helix	trans	-58.5	-42.9	176.4	-70.1	0	0	0	0	112	L473 V474 L480 N481	L473-C477 PolarHBondContact O-N 3.4Å; L473-C477 PolarHBondContact O-SG 3.46Å; L473-C477 VanDerWaalsContact O-SG 3.33Å; V474-C477 PolarHBondContact O-N 2.86Å; C477-L480 PolarHBondContact O-N 3.23Å; C477-N481 WeakPolarHBondContact O-CB 3.36Å; C477-N481 PolarHBondContact O-N 2.8Å
478	R	78.7	Confident	71.9	Confident	154 Å²	154	89 Å²	89	58%	0.581	47%	0.465	S	S	*	.	H	α-helix	trans	-64.3	-42.3	176.6	-165	-177.9	-63.8	114	-0.6	111.8	V474 N475 I476 G482	V474-R478 WeakPolarHBondContact O-CB 3.46Å; V474-R478 PolarHBondContact O-N 3.49Å; N475-R478 PolarHBondContact O-N 2.93Å; N475-R478 PolarHBondContact OD1-NH1 2.88Å; I476-R478 VanDerWaalsContact C-N 3.32Å; I476-R478 PolarHBondContact O-N 3.28Å; R478-G482 PolarHBondContact O-N 2.74Å
479	S	75.9	Confident	71.6	Confident	68 Å²	68	89.1 Å²	89.1	48%	0.476	46%	0.463	S	S	.	.	H	α-helix	trans	-64	-45.3	176.5	-179.8	0	0	0	0	112.1	N475 I476 G482 Q483	N475-S479 WeakPolarHBondContact O-CB 3.18Å; N475-S479 PolarHBondContact O-N 2.98Å; I476-S479 PolarHBondContact O-N 2.9Å; S479-G482 PolarHBondContact O-N 3.21Å; S479-Q483 WeakPolarHBondContact O-CG 3.3Å; S479-Q483 PolarHBondContact O-N 3.47Å
480	L	70.6	Confident	71.2	Confident	95 Å²	95	85.3 Å²	85.3	50%	0.497	46%	0.46	S	S	.	.	H	α-helix	trans	-63.4	-41.5	177.2	-72.5	172.5	0	0	0	112.1	I476 C477 G482 Q483 L484	I476-L480 HydrophobicContact CG2-CD1 3.78Å; I476-L480 HydrophobicContact CG2-CG 4.25Å; I476-L480 WeakPolarHBondContact O-CB 3.31Å; I476-L480 WeakPolarHBondContact O-CG 3.33Å; I476-L480 PolarHBondContact O-N 3.43Å; C477-L480 PolarHBondContact O-N 3.23Å; L480-G482 VanDerWaalsContact C-N 3.31Å; L480-G482 PolarHBondContact O-N 3.06Å; L480-Q483 PolarHBondContact O-N 2.88Å; L480-L484 WeakPolarHBondContact O-CB 3.32Å; L480-L484 PolarHBondContact O-N 2.98Å
481	N	69.5	Low	70.8	Confident	100 Å²	100	81.4 Å²	81.4	54%	0.535	44%	0.442	S	S	.	.	H	α-helix	trans	-62.1	-38.5	173.4	-81.7	-16.4	0	0	0	112.1	C477 L484 H485	C477-N481 WeakPolarHBondContact O-CB 3.36Å; C477-N481 PolarHBondContact O-N 2.8Å; N481-L484 PolarHBondContact O-N 2.82Å; N481-H485 PolarHBondContact O-N 3.02Å
482	G	75.2	Confident	70.1	Confident	43 Å²	43	80 Å²	80	44%	0.443	43%	0.43	S	S	.	.	H	α-helix	trans	-63.2	-45.4	173.4	0	0	0	0	0	112.7	R478 S479 L480 H485 A486	R478-G482 PolarHBondContact O-N 2.74Å; S479-G482 PolarHBondContact O-N 3.21Å; L480-G482 VanDerWaalsContact C-N 3.31Å; L480-G482 PolarHBondContact O-N 3.06Å; G482-H485 PolarHBondContact O-N 3.3Å; G482-A486 PolarHBondContact O-N 2.97Å
483	Q	71.6	Confident	69.9	Low	116 Å²	116	82.3 Å²	82.3	54%	0.542	44%	0.439	S	S	.	.	H	α-helix	trans	-62.1	-43.8	175.5	-72.1	179.3	-10.7	0	0	111.6	S479 L480 H485 A486 T487	S479-Q483 WeakPolarHBondContact O-CG 3.3Å; S479-Q483 PolarHBondContact O-N 3.47Å; L480-Q483 PolarHBondContact O-N 2.88Å; Q483-H485 VanDerWaalsContact C-N 3.33Å; Q483-H485 PolarHBondContact O-N 3.47Å; Q483-A486 PolarHBondContact O-N 3.44Å; Q483-A486 VanDerWaalsContact O-N 3.17Å; Q483-T487 PolarHBondContact O-N 2.88Å; Q483-T487 PolarHBondContact O-OG1 3.45Å
484	L	64.6	Low	69.8	Low	47 Å²	47	83 Å²	83	25%	0.246	45%	0.446	C	S	.	.	H	α-helix	trans	-57.4	-44.9	176.2	-179.7	67.6	0	0	0	111.9	L480 N481 T487 R488 L540	L480-L484 WeakPolarHBondContact O-CB 3.32Å; L480-L484 PolarHBondContact O-N 2.98Å; N481-L484 PolarHBondContact O-N 2.82Å; L484-T487 PolarHBondContact O-N 3.24Å; L484-R488 WeakPolarHBondContact O-CB 3.21Å; L484-R488 WeakPolarHBondContact O-CG 3.44Å; L484-R488 PolarHBondContact O-N 2.8Å; L484-L540 HydrophobicContact CD1-CD2 3.6Å; L484-L540 HydrophobicContact CD1-CG 4.36Å
485	H	68.3	Low	69.1	Low	118 Å²	118	80.2 Å²	80.2	55%	0.546	43%	0.43	S	S	.	.	H	α-helix	trans	-63.5	-42.8	175.2	-95.9	-70.6	0	0	0	112.6	N481 G482 Q483 R488 E489	N481-H485 PolarHBondContact O-N 3.02Å; G482-H485 PolarHBondContact O-N 3.3Å; Q483-H485 VanDerWaalsContact C-N 3.33Å; Q483-H485 PolarHBondContact O-N 3.47Å; H485-R488 WeakPolarHBondContact O-CB 3.45Å; H485-R488 PolarHBondContact O-N 2.8Å; H485-E489 PolarHBondContact O-N 3.37Å; H485-E489 VanDerWaalsContact O-N 3.08Å
486	A	68.3	Low	68.6	Low	63 Å²	63	79.3 Å²	79.3	52%	0.521	42%	0.424	S	S	.	.	H	α-helix	trans	-64	-41.7	177.5	0	0	0	0	0	112.1	G482 Q483 E489 A490	G482-A486 PolarHBondContact O-N 2.97Å; Q483-A486 PolarHBondContact O-N 3.44Å; Q483-A486 VanDerWaalsContact O-N 3.17Å; A486-E489 PolarHBondContact O-N 3.09Å; A486-A490 PolarHBondContact O-N 2.96Å
487	T	62.2	Low	68.4	Low	63 Å²	63	78.8 Å²	78.8	39%	0.387	43%	0.427	S	S	.	.	H	α-helix	trans	-64.2	-39.7	175.5	-56.1	0	0	0	0	111.6	Q483 L484 A490 M491	Q483-T487 PolarHBondContact O-N 2.88Å; Q483-T487 PolarHBondContact O-OG1 3.45Å; L484-T487 PolarHBondContact O-N 3.24Å; T487-A490 PolarHBondContact O-N 3.15Å; T487-M491 HydrophobicContact CG2-CE 3.47Å; T487-M491 VanDerWaalsContact CG2-CE 3.47Å; T487-M491 HydrophobicContact CG2-SD 4.32Å; T487-M491 WeakPolarHBondContact O-CG 3.34Å; T487-M491 PolarHBondContact O-N 3.34Å
488	R	61.2	Low	68.2	Low	76 Å²	76	78.3 Å²	78.3	29%	0.287	42%	0.415	S	S	.	.	H	α-helix	trans	-56.4	-50.1	173	-86.6	174.7	-179.7	171.1	-1.2	112.5	L484 H485 A490 M491 R492 I544	L484-R488 WeakPolarHBondContact O-CB 3.21Å; L484-R488 WeakPolarHBondContact O-CG 3.44Å; L484-R488 PolarHBondContact O-N 2.8Å; H485-R488 WeakPolarHBondContact O-CB 3.45Å; H485-R488 PolarHBondContact O-N 2.8Å; R488-A490 VanDerWaalsContact C-N 3.35Å; R488-A490 PolarHBondContact O-N 3.1Å; R488-M491 PolarHBondContact O-N 3.27Å; R488-R492 WeakPolarHBondContact O-CB 3.46Å; R488-R492 PolarHBondContact O-N 3.15Å; R488-I544 HydrophobicContact CB-CG2 4.27Å; R488-I544 HydrophobicContact CG-CB 4.34Å; R488-I544 HydrophobicContact CG-CD1 3.81Å; R488-I544 HydrophobicContact CG-CG1 3.62Å; R488-I544 HydrophobicContact CG-CG2 3.87Å
489	E	69	Low	67.6	Low	102 Å²	102	73.7 Å²	73.7	48%	0.477	40%	0.404	S	S	.	.	H	α-helix	trans	-64.2	-38.1	178.2	-76.5	-58.4	133.6	0	0	112.8	H485 A486 R492 K493	H485-E489 PolarHBondContact O-N 3.37Å; H485-E489 VanDerWaalsContact O-N 3.08Å; A486-E489 PolarHBondContact O-N 3.09Å; E489-R492 PolarHBondContact O-N 3.24Å; E489-K493 WeakPolarHBondContact O-CG 3.39Å; E489-K493 PolarHBondContact O-N 3.41Å; E489-K493 VanDerWaalsContact O-N 3.07Å
490	A	64.6	Low	67.3	Low	53 Å²	53	76.8 Å²	76.8	44%	0.438	41%	0.409	S	S	.	.	H	α-helix	trans	-64	-46.5	176.1	0	0	0	0	0	111.9	A486 T487 R488 R492 K493 V494	A486-A490 PolarHBondContact O-N 2.96Å; T487-A490 PolarHBondContact O-N 3.15Å; R488-A490 VanDerWaalsContact C-N 3.35Å; R488-A490 PolarHBondContact O-N 3.1Å; A490-R492 VanDerWaalsContact C-N 3.31Å; A490-R492 PolarHBondContact O-N 3.01Å; A490-K493 PolarHBondContact O-N 3.2Å; A490-V494 WeakPolarHBondContact O-CG2 3.35Å; A490-V494 PolarHBondContact O-N 3.05Å; A490-V494 VanDerWaalsContact O-N 3.07Å
491	M	64.3	Low	67.2	Low	39 Å²	39	77.6 Å²	77.6	19%	0.192	41%	0.413	C	S	.	.	H	α-helix	trans	-61.7	-39.9	176.2	-73.3	177.6	-171.4	0	0	111.9	T487 R488 K493 V494 M495 N541 I544	T487-M491 HydrophobicContact CG2-CE 3.47Å; T487-M491 VanDerWaalsContact CG2-CE 3.47Å; T487-M491 HydrophobicContact CG2-SD 4.32Å; T487-M491 WeakPolarHBondContact O-CG 3.34Å; T487-M491 PolarHBondContact O-N 3.34Å; R488-M491 PolarHBondContact O-N 3.27Å; M491-K493 VanDerWaalsContact C-N 3.34Å; M491-K493 PolarHBondContact O-N 3.44Å; M491-V494 PolarHBondContact O-N 3.18Å; M491-M495 PolarHBondContact O-N 3.18Å; M491-N541 HydrophobicContact CE-CB 4.48Å; M491-N541 WeakPolarHBondContact CE-OD1 3.4Å; M491-N541 HydrophobicContact SD-CB 4.42Å; M491-I544 HydrophobicContact CB-CG2 3.59Å; M491-I544 HydrophobicContact CG-CG2 4.09Å; M491-I544 HydrophobicContact SD-CB 3.89Å; M491-I544 HydrophobicContact SD-CD1 3.9Å; M491-I544 HydrophobicContact SD-CG2 3.43Å; M491-I544 WeakPolarHBondContact SD-CG2 3.49Å
492	R	65.8	Low	67	Low	57 Å²	57	75.3 Å²	75.3	22%	0.215	40%	0.397	C	S	.	.	H	α-helix	trans	-58.6	-44.3	174.4	178.2	179.4	171.5	87.6	19.4	112.6	R488 E489 A490 M495 I496 S548 Q550	R488-R492 WeakPolarHBondContact O-CB 3.46Å; R488-R492 PolarHBondContact O-N 3.15Å; E489-R492 PolarHBondContact O-N 3.24Å; A490-R492 VanDerWaalsContact C-N 3.31Å; A490-R492 PolarHBondContact O-N 3.01Å; R492-M495 PolarHBondContact O-N 3.3Å; R492-I496 HydrophobicContact CG-CD1 4.09Å; R492-I496 VanDerWaalsContact O-CG1 3.31Å; R492-I496 WeakPolarHBondContact O-CG1 3.46Å; R492-I496 PolarHBondContact O-N 3.23Å; R492-I496 VanDerWaalsContact O-N 3.11Å; R492-S548 VanDerWaalsContact CA-CB 3.48Å; R492-S548 PolarHBondContact NH1-O 3.15Å; R492-Q550 PolarHBondContact NH1-O 3.03Å
493	K	69.2	Low	66.7	Low	138 Å²	138	77.9 Å²	77.9	60%	0.6	40%	0.404	S	S	*	.	H	α-helix	trans	-61.9	-43.5	175.4	-70.9	173.9	-177.3	178.7	0	112.1	E489 A490 M491 M495 I496 C497	E489-K493 WeakPolarHBondContact O-CG 3.39Å; E489-K493 PolarHBondContact O-N 3.41Å; E489-K493 VanDerWaalsContact O-N 3.07Å; A490-K493 PolarHBondContact O-N 3.2Å; M491-K493 VanDerWaalsContact C-N 3.34Å; M491-K493 PolarHBondContact O-N 3.44Å; K493-M495 PolarHBondContact O-N 3.25Å; K493-I496 PolarHBondContact O-N 3.47Å; K493-C497 PolarHBondContact O-N 3.32Å; K493-C497 PolarHBondContact O-SG 3.04Å; K493-C497 VanDerWaalsContact O-SG 3.39Å
494	V	65.8	Low	66.6	Low	97 Å²	97	78 Å²	78	59%	0.588	41%	0.405	S	S	*	.	H	α-helix	trans	-61.2	-43.6	177.7	173.5	0	0	0	0	111.3	A490 M491 I496 C497 Y498	A490-V494 WeakPolarHBondContact O-CG2 3.35Å; A490-V494 PolarHBondContact O-N 3.05Å; A490-V494 VanDerWaalsContact O-N 3.07Å; M491-V494 PolarHBondContact O-N 3.18Å; V494-I496 PolarHBondContact O-N 3.48Å; V494-C497 WeakPolarHBondContact O-CB 3.4Å; V494-C497 PolarHBondContact O-N 2.92Å; V494-Y498 PolarHBondContact O-N 3.11Å
495	M	64.8	Low	66.4	Low	6 Å²	6	77 Å²	77	3%	0.03	40%	0.404	C	S	.	.	H	α-helix	trans	-64.6	-39.3	178.3	-78.8	-59.4	-69.8	0	0	113.7	M491 R492 K493 C497 Y498 T499 P519 M545 T549	M491-M495 PolarHBondContact O-N 3.18Å; R492-M495 PolarHBondContact O-N 3.3Å; K493-M495 PolarHBondContact O-N 3.25Å; M495-C497 VanDerWaalsContact C-N 3.35Å; M495-Y498 PolarHBondContact O-N 2.8Å; M495-T499 WeakPolarHBondContact O-CB 3.39Å; M495-T499 PolarHBondContact O-N 3.39Å; M495-T499 PolarHBondContact O-OG1 3.04Å; M495-P519 HydrophobicContact CE-CB 3.62Å; M495-P519 HydrophobicContact CE-CG 4.44Å; M495-M545 HydrophobicContact CE-CE 4Å; M495-M545 HydrophobicContact CE-SD 4.4Å; M495-M545 HydrophobicContact CG-CE 4.03Å; M495-M545 HydrophobicContact CG-CG 4.47Å; M495-M545 HydrophobicContact CG-SD 3.26Å; M495-M545 WeakPolarHBondContact CG-SD 3.45Å; M495-M545 HydrophobicContact SD-CE 3.15Å; M495-M545 WeakPolarHBondContact SD-CE 3.47Å; M495-M545 HydrophobicContact SD-SD 3.28Å; M495-T549 HydrophobicContact CE-CG2 3.88Å
496	I	68	Low	66	Low	71 Å²	71	76 Å²	76	36%	0.364	40%	0.401	S	S	.	.	H	α-helix	trans	-62.5	-44.5	173.6	-67.8	166	0	0	0	110.2	R492 K493 V494 T499 K500	R492-I496 HydrophobicContact CG-CD1 4.09Å; R492-I496 VanDerWaalsContact O-CG1 3.31Å; R492-I496 WeakPolarHBondContact O-CG1 3.46Å; R492-I496 PolarHBondContact O-N 3.23Å; R492-I496 VanDerWaalsContact O-N 3.11Å; K493-I496 PolarHBondContact O-N 3.47Å; V494-I496 PolarHBondContact O-N 3.48Å; I496-T499 PolarHBondContact O-N 3.36Å; I496-K500 HydrophobicContact CG2-CD 4.5Å; I496-K500 WeakPolarHBondContact O-CG 3.34Å; I496-K500 PolarHBondContact O-N 2.93Å; I496-K500 VanDerWaalsContact O-N 3.09Å
497	C	68.3	Low	65.4	Low	75 Å²	75	79 Å²	79	51%	0.507	40%	0.404	S	S	.	.	H	α-helix	trans	-61.3	-45.2	176	-73.4	0	0	0	0	112.3	K493 V494 M495 T499 K500 L501	K493-C497 PolarHBondContact O-N 3.32Å; K493-C497 PolarHBondContact O-SG 3.04Å; K493-C497 VanDerWaalsContact O-SG 3.39Å; V494-C497 WeakPolarHBondContact O-CB 3.4Å; V494-C497 PolarHBondContact O-N 2.92Å; M495-C497 VanDerWaalsContact C-N 3.35Å; C497-T499 PolarHBondContact O-N 2.92Å; C497-K500 PolarHBondContact O-N 3.48Å; C497-L501 WeakPolarHBondContact O-CG 3.4Å; C497-L501 PolarHBondContact O-N 2.94Å
498	Y	65.4	Low	64.9	Low	63 Å²	63	82.1 Å²	82.1	25%	0.247	43%	0.426	C	S	.	.	H	α-helix	trans	-59	-46.8	177.3	-179.8	-104	0	0	0	111.9	V494 M495 K500 L501 R502 P517 P519 L522	V494-Y498 PolarHBondContact O-N 3.11Å; M495-Y498 PolarHBondContact O-N 2.8Å; Y498-K500 VanDerWaalsContact C-N 3.34Å; Y498-K500 PolarHBondContact O-N 2.98Å; Y498-L501 PolarHBondContact O-N 3.1Å; Y498-R502 WeakPolarHBondContact O-CB 3.41Å; Y498-R502 PolarHBondContact O-N 3Å; Y498-P517 PolarHBondContact OH-O 3.49Å; Y498-P519 HydrophobicContact CD1-CG 4.13Å; Y498-P519 HydrophobicContact CE1-CG 4.24Å; Y498-L522 HydrophobicContact CD1-CD1 3.92Å; Y498-L522 HydrophobicContact CE1-CD1 3.44Å; Y498-L522 VanDerWaalsContact CE1-CD1 3.44Å; Y498-L522 HydrophobicContact CE2-CD1 4.33Å
499	T	66.2	Low	64.4	Low	58 Å²	58	86.1 Å²	86.1	36%	0.356	45%	0.453	S	S	.	.	H	α-helix	trans	-60.2	-44	178.4	-52.8	0	0	0	0	111.2	M495 I496 C497 R502 T503 P519	M495-T499 WeakPolarHBondContact O-CB 3.39Å; M495-T499 PolarHBondContact O-N 3.39Å; M495-T499 PolarHBondContact O-OG1 3.04Å; I496-T499 PolarHBondContact O-N 3.36Å; C497-T499 PolarHBondContact O-N 2.92Å; T499-R502 PolarHBondContact O-N 2.98Å; T499-T503 PolarHBondContact O-N 2.97Å; T499-T503 PolarHBondContact O-OG1 3.35Å; T499-P519 HydrophobicContact CG2-CG 4.5Å
500	K	70.6	Confident	63.5	Low	133 Å²	133	83.3 Å²	83.3	58%	0.578	45%	0.447	S	S	*	.	H	α-helix	trans	-61.4	-46	176.6	-74.4	-179.7	177.2	-175.7	0	112.7	I496 C497 Y498 R502 T503 Q504	I496-K500 HydrophobicContact CG2-CD 4.5Å; I496-K500 WeakPolarHBondContact O-CG 3.34Å; I496-K500 PolarHBondContact O-N 2.93Å; I496-K500 VanDerWaalsContact O-N 3.09Å; C497-K500 PolarHBondContact O-N 3.48Å; Y498-K500 VanDerWaalsContact C-N 3.34Å; Y498-K500 PolarHBondContact O-N 2.98Å; K500-R502 VanDerWaalsContact C-N 3.32Å; K500-R502 PolarHBondContact O-N 3.05Å; K500-T503 PolarHBondContact O-N 3.35Å; K500-Q504 WeakPolarHBondContact O-CG 3.26Å; K500-Q504 PolarHBondContact O-N 3.02Å; K500-Q504 VanDerWaalsContact O-N 3.09Å
501	L	68.3	Low	62.6	Low	111 Å²	111	87 Å²	87	58%	0.581	47%	0.468	S	S	*	.	H	α-helix	trans	-62.7	-40.3	178.4	-73.8	169.1	0	0	0	111.6	C497 Y498 Q504 A505	C497-L501 WeakPolarHBondContact O-CG 3.4Å; C497-L501 PolarHBondContact O-N 2.94Å; Y498-L501 PolarHBondContact O-N 3.1Å; L501-Q504 PolarHBondContact O-N 2.89Å; L501-A505 PolarHBondContact O-N 3.15Å
502	R	65.9	Low	62	Low	53 Å²	53	89.2 Å²	89.2	20%	0.2	48%	0.48	C	S	.	.	H	α-helix	trans	-65.1	-43.8	177.1	-168.3	172.7	-177.4	-96.9	-0	112.2	Y498 T499 K500 Q504 A505 I506 P515 G516 P517 T518	Y498-R502 WeakPolarHBondContact O-CB 3.41Å; Y498-R502 PolarHBondContact O-N 3Å; T499-R502 PolarHBondContact O-N 2.98Å; K500-R502 VanDerWaalsContact C-N 3.32Å; K500-R502 PolarHBondContact O-N 3.05Å; R502-Q504 VanDerWaalsContact C-N 3.28Å; R502-Q504 PolarHBondContact O-N 3.39Å; R502-A505 PolarHBondContact O-N 3.35Å; R502-I506 HydrophobicContact CG-CD1 3.99Å; R502-I506 WeakPolarHBondContact O-CD1 3.37Å; R502-I506 VanDerWaalsContact O-CG1 3.3Å; R502-I506 WeakPolarHBondContact O-CG1 3.25Å; R502-I506 PolarHBondContact O-N 2.88Å; R502-I506 VanDerWaalsContact O-N 3.15Å; R502-P515 HydrophobicContact CG-CB 4.35Å; R502-G516 PolarHBondContact NE-O 2.94Å; R502-G516 PolarHBondContact NH2-O 2.87Å; R502-P517 PolarHBondContact NE-O 3.41Å; R502-T518 VanDerWaalsContact CZ-CG2 3.47Å
503	T	69.1	Low	61.4	Low	96 Å²	96	94.5 Å²	94.5	59%	0.589	51%	0.513	S	S	*	.	H	α-helix	trans	-62.4	-35.1	175.3	-53.1	0	0	0	0	112.2	T499 K500	T499-T503 PolarHBondContact O-N 2.97Å; T499-T503 PolarHBondContact O-OG1 3.35Å; K500-T503 PolarHBondContact O-N 3.35Å
504	Q	68.4	Low	61	Low	120 Å²	120	93.9 Å²	93.9	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-68.3	-37.7	174.4	-71.5	171.8	-5.5	0	0	112.3	K500 L501 R502 Q507	K500-Q504 WeakPolarHBondContact O-CG 3.26Å; K500-Q504 PolarHBondContact O-N 3.02Å; K500-Q504 VanDerWaalsContact O-N 3.09Å; L501-Q504 PolarHBondContact O-N 2.89Å; R502-Q504 VanDerWaalsContact C-N 3.28Å; R502-Q504 PolarHBondContact O-N 3.39Å; Q504-Q507 WeakPolarHBondContact O-CG 3.46Å; Q504-Q507 PolarHBondContact O-N 3.42Å
505	A	60.6	Low	60.8	Low	26 Å²	26	91.4 Å²	91.4	22%	0.215	50%	0.502	C	S	.	.	H	α-helix	trans	-71.2	-25.5	178.9	0	0	0	0	0	114.3	L501 R502 Q507 A510 I512	L501-A505 PolarHBondContact O-N 3.15Å; R502-A505 PolarHBondContact O-N 3.35Å; A505-Q507 VanDerWaalsContact C-N 3.27Å; A505-Q507 PolarHBondContact O-N 2.8Å; A505-A510 VanDerWaalsContact O-CB 3.29Å; A505-A510 WeakPolarHBondContact O-CB 3.33Å; A505-I512 HydrophobicContact CB-CD1 3.74Å
506	I	60.1	Low	60.7	Low	95 Å²	95	92.1 Å²	92.1	49%	0.487	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-4.2	179.9	-66.3	164.3	0	0	0	112.2	R502 P515	R502-I506 HydrophobicContact CG-CD1 3.99Å; R502-I506 WeakPolarHBondContact O-CD1 3.37Å; R502-I506 VanDerWaalsContact O-CG1 3.3Å; R502-I506 WeakPolarHBondContact O-CG1 3.25Å; R502-I506 PolarHBondContact O-N 2.88Å; R502-I506 VanDerWaalsContact O-N 3.15Å; I506-P515 HydrophobicContact CD1-CB 4.29Å; I506-P515 HydrophobicContact CD1-CG 4.37Å; I506-P515 HydrophobicContact CG1-CB 3.84Å; I506-P515 HydrophobicContact CG1-CG 4.1Å
507	Q	56.7	Low	60.6	Low	126 Å²	126	90.7 Å²	90.7	59%	0.589	51%	0.506	S	S	*	.	S	Bend	trans	-56.9	142.3	179.2	-74.9	-170.3	-1.4	0	0	112.1	Q504 A505 N509 A510	Q504-Q507 WeakPolarHBondContact O-CG 3.46Å; Q504-Q507 PolarHBondContact O-N 3.42Å; A505-Q507 VanDerWaalsContact C-N 3.27Å; A505-Q507 PolarHBondContact O-N 2.8Å; Q507-N509 PolarHBondContact O-N 2.87Å; Q507-A510 PolarHBondContact O-N 2.92Å
508	P	51.5	Low	60.6	Low	129 Å²	129	88.7 Å²	88.7	84%	0.838	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-3.6	-163.5	21.3	-33.4	0	0	0	116.7
509	N	51	Low	60.4	Low	160 Å²	160	86.7 Å²	86.7	86%	0.856	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	4.3	179.1	-71	-14.2	0	0	0	113.6	Q507	Q507-N509 PolarHBondContact O-N 2.87Å
510	A	48.9	Very low	60.2	Low	44 Å²	44	89.1 Å²	89.1	36%	0.364	49%	0.493	S	S	.	.			trans	-91.2	118	178.5	0	0	0	0	0	110.3	A505 Q507 I512	A505-A510 VanDerWaalsContact O-CB 3.29Å; A505-A510 WeakPolarHBondContact O-CB 3.33Å; Q507-A510 PolarHBondContact O-N 2.92Å; A510-I512 HydrophobicContact CB-CD1 4.41Å; A510-I512 HydrophobicContact CB-CG1 4.42Å; A510-I512 PolarHBondContact O-N 3.11Å
511	C	45.7	Very low	59.9	Low	129 Å²	129	87 Å²	87	87%	0.872	49%	0.485	S	S	*	.			trans	-69.3	47.9	174	-77.6	0	0	0	0	112.8
512	I	50.9	Low	59.6	Low	87 Å²	87	83.7 Å²	83.7	45%	0.446	47%	0.468	S	S	.	.			trans	-105.4	94.6	177.8	-59.4	174.5	0	0	0	107.1	A505 A510 D514	A505-I512 HydrophobicContact CB-CD1 3.74Å; A510-I512 HydrophobicContact CB-CD1 4.41Å; A510-I512 HydrophobicContact CB-CG1 4.42Å; A510-I512 PolarHBondContact O-N 3.11Å; I512-D514 VanDerWaalsContact CG2-O 3.29Å; I512-D514 WeakPolarHBondContact CG2-O 3.45Å; I512-D514 PolarHBondContact O-N 3.36Å
513	N	54.8	Low	59.3	Low	168 Å²	168	81.2 Å²	81.2	90%	0.898	46%	0.459	S	S	*	.	S	Bend	trans	-67.5	-11.8	-179.9	-67.1	-19.6	0	0	0	113.1
514	D	59.9	Low	58.8	Low	124 Å²	124	79.6 Å²	79.6	66%	0.663	45%	0.447	S	S	*	.			trans	-149.2	101.8	175	-172.2	-6.7	0	0	0	110	I512 G516	I512-D514 VanDerWaalsContact CG2-O 3.29Å; I512-D514 WeakPolarHBondContact CG2-O 3.45Å; I512-D514 PolarHBondContact O-N 3.36Å; D514-G516 PolarHBondContact O-N 2.62Å; D514-G516 VanDerWaalsContact O-N 3.08Å; D514-G516 PolarHBondContact OD1-N 2.89Å
515	P	61.4	Low	58.2	Low	45 Å²	45	79.6 Å²	79.6	29%	0.292	45%	0.447	S	S	.	.			trans	-71.5	6.5	178.8	30.1	-34.5	0	0	0	113.4	R502 I506	R502-P515 HydrophobicContact CG-CB 4.35Å; I506-P515 HydrophobicContact CD1-CB 4.29Å; I506-P515 HydrophobicContact CD1-CG 4.37Å; I506-P515 HydrophobicContact CG1-CB 3.84Å; I506-P515 HydrophobicContact CG1-CG 4.1Å
516	G	62.9	Low	57.8	Low	21 Å²	21	79.9 Å²	79.9	22%	0.216	45%	0.445	C	S	.	.			trans	73.7	176.9	-176.2	0	0	0	0	0	112.7	R502 D514	R502-G516 PolarHBondContact NE-O 2.94Å; R502-G516 PolarHBondContact NH2-O 2.87Å; D514-G516 PolarHBondContact O-N 2.62Å; D514-G516 VanDerWaalsContact O-N 3.08Å; D514-G516 PolarHBondContact OD1-N 2.89Å
517	P	66.7	Low	57.2	Low	41 Å²	41	83.3 Å²	83.3	27%	0.266	45%	0.451	S	S	.	.			trans	-61.4	141.3	-168.5	20.9	-31.4	0	0	0	112.1	Y498 R502 E521 L522	Y498-P517 PolarHBondContact OH-O 3.49Å; R502-P517 PolarHBondContact NE-O 3.41Å; P517-E521 WeakPolarHBondContact CA-OE2 3.27Å; P517-E521 HydrophobicContact CB-CB 3.63Å; P517-L522 HydrophobicContact CB-CD2 4.37Å; P517-L522 HydrophobicContact CB-CG 4.18Å; P517-L522 HydrophobicContact CG-CD2 3.72Å; P517-L522 HydrophobicContact CG-CG 3.91Å
518	T	67.1	Low	56.8	Low	33 Å²	33	85.9 Å²	85.9	20%	0.202	46%	0.456	C	S	.	.			trans	-56.2	152.7	168.4	59	0	0	0	0	110.2	R502 Q520 E521 L522	R502-T518 VanDerWaalsContact CZ-CG2 3.47Å; T518-Q520 PolarHBondContact O-N 3.46Å; T518-E521 WeakPolarHBondContact CG2-OE1 3.21Å; T518-E521 PolarHBondContact N-OE2 2.98Å; T518-E521 CarbonylContact O-C 3.49Å; T518-E521 WeakPolarHBondContact O-CA 3.49Å; T518-E521 WeakPolarHBondContact O-CB 3.48Å; T518-E521 PolarHBondContact O-N 2.92Å; T518-E521 WeakPolarHBondContact OG1-CB 3.29Å; T518-E521 VanDerWaalsContact OG1-CG 3.24Å; T518-E521 WeakPolarHBondContact OG1-CG 3.41Å; T518-E521 PolarHBondContact OG1-N 3.4Å; T518-E521 PolarHBondContact OG1-OE1 3.22Å; T518-L522 PolarHBondContact O-N 3.21Å
519	P	61.3	Low	56.5	Low	21 Å²	21	82.3 Å²	82.3	14%	0.136	43%	0.434	C	S	.	.	H	α-helix	trans	-44.8	-36.8	165	-33.3	38	0	0	0	112.9	M495 Y498 T499 I523	M495-P519 HydrophobicContact CE-CB 3.62Å; M495-P519 HydrophobicContact CE-CG 4.44Å; Y498-P519 HydrophobicContact CD1-CG 4.13Å; Y498-P519 HydrophobicContact CE1-CG 4.24Å; T499-P519 HydrophobicContact CG2-CG 4.5Å; P519-I523 WeakPolarHBondContact O-CB 3.36Å; P519-I523 WeakPolarHBondContact O-CD1 3.22Å; P519-I523 WeakPolarHBondContact O-CG1 3.43Å; P519-I523 PolarHBondContact O-N 2.95Å
520	Q	62.7	Low	56	Low	109 Å²	109	75.9 Å²	75.9	51%	0.509	41%	0.405	S	S	.	.	H	α-helix	trans	-70.2	-39.3	176.2	-158.7	67.1	17.9	0	0	112.6	T518 I523 N524	T518-Q520 PolarHBondContact O-N 3.46Å; Q520-I523 PolarHBondContact O-N 3.49Å; Q520-N524 VanDerWaalsContact O-CB 3.28Å; Q520-N524 WeakPolarHBondContact O-CB 3.47Å; Q520-N524 PolarHBondContact O-N 2.89Å; Q520-N524 PolarHBondContact O-ND2 3.27Å; Q520-N524 PolarHBondContact O-OD1 3.47Å
521	E	64.9	Low	55.8	Low	88 Å²	88	84.3 Å²	84.3	41%	0.411	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-41.6	172	-79.5	147.4	-131.2	0	0	111.9	P517 T518 I523 N524 E525	P517-E521 WeakPolarHBondContact CA-OE2 3.27Å; P517-E521 HydrophobicContact CB-CB 3.63Å; T518-E521 WeakPolarHBondContact CG2-OE1 3.21Å; T518-E521 PolarHBondContact N-OE2 2.98Å; T518-E521 CarbonylContact O-C 3.49Å; T518-E521 WeakPolarHBondContact O-CA 3.49Å; T518-E521 WeakPolarHBondContact O-CB 3.48Å; T518-E521 PolarHBondContact O-N 2.92Å; T518-E521 WeakPolarHBondContact OG1-CB 3.29Å; T518-E521 VanDerWaalsContact OG1-CG 3.24Å; T518-E521 WeakPolarHBondContact OG1-CG 3.41Å; T518-E521 PolarHBondContact OG1-N 3.4Å; T518-E521 PolarHBondContact OG1-OE1 3.22Å; E521-I523 VanDerWaalsContact C-N 3.33Å; E521-I523 PolarHBondContact O-N 2.83Å; E521-N524 CarbonylContact O-C 3.49Å; E521-N524 PolarHBondContact O-N 2.97Å; E521-N524 VanDerWaalsContact O-N 3.15Å; E521-E525 WeakPolarHBondContact O-CB 3.37Å; E521-E525 WeakPolarHBondContact O-CG 3.39Å; E521-E525 PolarHBondContact O-N 3.11Å
522	L	61.8	Low	55.5	Low	42 Å²	42	80.7 Å²	80.7	22%	0.22	40%	0.404	C	S	.	.	H	α-helix	trans	-60.1	-44.1	172.4	-74.6	172.7	0	0	0	111.2	Y498 P517 T518 N524 L526 M545	Y498-L522 HydrophobicContact CD1-CD1 3.92Å; Y498-L522 HydrophobicContact CE1-CD1 3.44Å; Y498-L522 VanDerWaalsContact CE1-CD1 3.44Å; Y498-L522 HydrophobicContact CE2-CD1 4.33Å; P517-L522 HydrophobicContact CB-CD2 4.37Å; P517-L522 HydrophobicContact CB-CG 4.18Å; P517-L522 HydrophobicContact CG-CD2 3.72Å; P517-L522 HydrophobicContact CG-CG 3.91Å; T518-L522 PolarHBondContact O-N 3.21Å; L522-N524 VanDerWaalsContact C-N 3.31Å; L522-N524 PolarHBondContact O-N 2.95Å; L522-L526 VanDerWaalsContact O-CB 3.23Å; L522-L526 WeakPolarHBondContact O-CB 3.38Å; L522-L526 WeakPolarHBondContact O-CD1 3.32Å; L522-L526 WeakPolarHBondContact O-CG 3.43Å; L522-L526 PolarHBondContact O-N 2.91Å; L522-M545 HydrophobicContact CB-CE 4.36Å
523	I	59.8	Low	55	Low	2 Å²	2	82.4 Å²	82.4	1%	0.01	41%	0.414	C	S	.	.	H	α-helix	trans	-64.2	-38.9	175.4	-70.2	163.1	0	0	0	110.8	P519 Q520 E521 R527 M545 A546 T549	P519-I523 WeakPolarHBondContact O-CB 3.36Å; P519-I523 WeakPolarHBondContact O-CD1 3.22Å; P519-I523 WeakPolarHBondContact O-CG1 3.43Å; P519-I523 PolarHBondContact O-N 2.95Å; Q520-I523 PolarHBondContact O-N 3.49Å; E521-I523 VanDerWaalsContact C-N 3.33Å; E521-I523 PolarHBondContact O-N 2.83Å; I523-R527 WeakPolarHBondContact O-CB 3.43Å; I523-R527 WeakPolarHBondContact O-CG 3.44Å; I523-R527 PolarHBondContact O-N 3.1Å; I523-M545 HydrophobicContact CG1-CB 3.92Å; I523-A546 HydrophobicContact CG2-CB 4.24Å; I523-T549 HydrophobicContact CD1-CG2 3.81Å
524	N	58.2	Low	54.3	Low	61 Å²	61	79.2 Å²	79.2	33%	0.326	39%	0.392	S	S	.	.	H	α-helix	trans	-67.6	-50.2	177.6	-70.7	-21.7	0	0	0	110.3	Q520 E521 L522 L526 R527 W528	Q520-N524 VanDerWaalsContact O-CB 3.28Å; Q520-N524 WeakPolarHBondContact O-CB 3.47Å; Q520-N524 PolarHBondContact O-N 2.89Å; Q520-N524 PolarHBondContact O-ND2 3.27Å; Q520-N524 PolarHBondContact O-OD1 3.47Å; E521-N524 CarbonylContact O-C 3.49Å; E521-N524 PolarHBondContact O-N 2.97Å; E521-N524 VanDerWaalsContact O-N 3.15Å; L522-N524 VanDerWaalsContact C-N 3.31Å; L522-N524 PolarHBondContact O-N 2.95Å; N524-L526 VanDerWaalsContact C-N 3.28Å; N524-L526 PolarHBondContact O-N 3.21Å; N524-R527 CarbonylContact O-C 3.51Å; N524-R527 WeakPolarHBondContact O-CA 3.38Å; N524-R527 WeakPolarHBondContact O-CB 3.16Å; N524-R527 PolarHBondContact O-N 2.89Å; N524-W528 VanDerWaalsContact C-CD1 3.47Å; N524-W528 PolarHBondContact O-N 3.35Å
525	E	55.2	Low	53.5	Low	121 Å²	121	75.1 Å²	75.1	57%	0.565	37%	0.37	S	S	*	.	H	α-helix	trans	-58.1	-39.9	175.9	-76.7	-168.5	161	0	0	112	E521 R527 W528 S529	E521-E525 WeakPolarHBondContact O-CB 3.37Å; E521-E525 WeakPolarHBondContact O-CG 3.39Å; E521-E525 PolarHBondContact O-N 3.11Å; E525-R527 VanDerWaalsContact C-N 3.34Å; E525-W528 PolarHBondContact O-N 3.32Å; E525-S529 WeakPolarHBondContact O-CB 3.46Å; E525-S529 PolarHBondContact O-N 2.92Å; E525-S529 PolarHBondContact O-OG 2.87Å
526	L	52.3	Low	52.4	Low	32 Å²	32	80.5 Å²	80.5	17%	0.168	39%	0.386	C	S	.	.	H	α-helix	trans	-66.2	-33.7	172.6	-73.3	169	0	0	0	112.4	L522 N524 S529 L538 A542 M545	L522-L526 VanDerWaalsContact O-CB 3.23Å; L522-L526 WeakPolarHBondContact O-CB 3.38Å; L522-L526 WeakPolarHBondContact O-CD1 3.32Å; L522-L526 WeakPolarHBondContact O-CG 3.43Å; L522-L526 PolarHBondContact O-N 2.91Å; N524-L526 VanDerWaalsContact C-N 3.28Å; N524-L526 PolarHBondContact O-N 3.21Å; L526-S529 WeakPolarHBondContact CA-OG 3.49Å; L526-S529 PolarHBondContact O-OG 3.19Å; L526-S529 VanDerWaalsContact O-OG 3.13Å; L526-L538 HydrophobicContact CD2-CD2 3.53Å; L526-A542 HydrophobicContact CB-CB 3.67Å; L526-M545 HydrophobicContact CD1-CE 3.7Å; L526-M545 HydrophobicContact CD1-CG 4.18Å
527	R	48.6	Very low	51.1	Low	166 Å²	166	85.7 Å²	85.7	63%	0.626	41%	0.408	S	S	*	.	H	α-helix	trans	-71	-34	171	-80.8	-179.6	179.6	-148.9	1.2	112.8	I523 N524 E525	I523-R527 WeakPolarHBondContact O-CB 3.43Å; I523-R527 WeakPolarHBondContact O-CG 3.44Å; I523-R527 PolarHBondContact O-N 3.1Å; N524-R527 CarbonylContact O-C 3.51Å; N524-R527 WeakPolarHBondContact O-CA 3.38Å; N524-R527 WeakPolarHBondContact O-CB 3.16Å; N524-R527 PolarHBondContact O-N 2.89Å; E525-R527 VanDerWaalsContact C-N 3.34Å
528	W	46.7	Very low	49.9	Very low	181 Å²	181	86.7 Å²	86.7	69%	0.686	41%	0.411	S	S	*	.	H	α-helix	trans	-80.9	-30.2	-178.4	-71.5	110.2	0	0	0	112.8	N524 E525 G530	N524-W528 VanDerWaalsContact C-CD1 3.47Å; N524-W528 PolarHBondContact O-N 3.35Å; E525-W528 PolarHBondContact O-N 3.32Å; W528-G530 PolarHBondContact O-N 3.35Å
529	S	45.2	Very low	48.7	Very low	54 Å²	54	88.2 Å²	88.2	38%	0.378	42%	0.418	S	S	.	.	S	Bend	trans	-70.5	-13.4	176.3	51	0	0	0	0	114	E525 L526 R531	E525-S529 WeakPolarHBondContact O-CB 3.46Å; E525-S529 PolarHBondContact O-N 2.92Å; E525-S529 PolarHBondContact O-OG 2.87Å; L526-S529 WeakPolarHBondContact CA-OG 3.49Å; L526-S529 PolarHBondContact O-OG 3.19Å; L526-S529 VanDerWaalsContact O-OG 3.13Å; S529-R531 PolarHBondContact O-N 2.89Å
530	G	42.1	Very low	47.7	Very low	25 Å²	25	90 Å²	90	26%	0.258	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	20	-178.6	0	0	0	0	0	117.4	W528 S532	W528-G530 PolarHBondContact O-N 3.35Å; G530-S532 VanDerWaalsContact C-N 3.34Å
531	R	43	Very low	46.9	Very low	220 Å²	220	87.2 Å²	87.2	83%	0.83	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.7	178.6	-73.4	-166.3	-174.4	-151.1	2.8	114.5	S529	S529-R531 PolarHBondContact O-N 2.89Å
532	S	39.7	Very low	45.9	Very low	53 Å²	53	83.2 Å²	83.2	37%	0.371	40%	0.396	S	S	.	.	S	Bend	trans	-108.7	136.2	176.3	116.5	0	0	0	0	110.9	G530 K534 D535	G530-S532 VanDerWaalsContact C-N 3.34Å; S532-K534 PolarHBondContact O-N 3.4Å; S532-K534 PolarHBondContact OG-N 3.34Å; S532-D535 WeakPolarHBondContact CB-OD2 3.3Å; S532-D535 PolarHBondContact O-N 2.93Å; S532-D535 VanDerWaalsContact O-N 3.15Å; S532-D535 PolarHBondContact OG-OD2 3.46Å
533	N	40.3	Very low	45.1	Very low	124 Å²	124	85 Å²	85	66%	0.663	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-11	178.2	-134.7	-28.5	0	0	0	112.1	K232 D535	K232-N533 WeakPolarHBondContact CE-O 3.31Å; K232-N533 PolarHBondContact NZ-O 3.4Å; K232-N533 PolarHBondContact NZ-OD1 3.31Å; N533-D535 VanDerWaalsContact C-N 3.32Å
534	K	41.6	Very low	44.5	Very low	100 Å²	100	85 Å²	85	44%	0.435	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-11.6	177.5	-75.2	-174.2	169.6	-169.6	0	113.8	E239 S532 Y536	E239-K534 IonicContact OE1-NZ 3.88Å; E239-K534 PolarHBondContact OE1-NZ 3.49Å; S532-K534 PolarHBondContact O-N 3.4Å; S532-K534 PolarHBondContact OG-N 3.34Å; K534-Y536 PolarHBondContact O-N 3.22Å
535	D	43.1	Very low	43.9	Very low	39 Å²	39	83.4 Å²	83.4	21%	0.209	40%	0.403	C	S	.	.			trans	-103.7	29	-167.6	-62.7	-43.4	0	0	0	113.6	S532 N533 L537 L538 N539	S532-D535 WeakPolarHBondContact CB-OD2 3.3Å; S532-D535 PolarHBondContact O-N 2.93Å; S532-D535 VanDerWaalsContact O-N 3.15Å; S532-D535 PolarHBondContact OG-OD2 3.46Å; N533-D535 VanDerWaalsContact C-N 3.32Å; D535-L537 PolarHBondContact O-N 3.18Å; D535-L538 HydrophobicContact CB-CB 3.98Å; D535-L538 HydrophobicContact CB-CD1 4.01Å; D535-L538 WeakPolarHBondContact O-CA 3.3Å; D535-L538 WeakPolarHBondContact O-CB 3.3Å; D535-L538 PolarHBondContact O-N 3.39Å; D535-L538 VanDerWaalsContact OD1-CD1 3.31Å; D535-L538 WeakPolarHBondContact OD1-CD1 3.28Å; D535-N539 PolarHBondContact O-N 2.91Å
536	Y	36.2	Very low	43.7	Very low	158 Å²	158	78.8 Å²	78.8	62%	0.62	39%	0.386	S	S	*	.	H	α-helix	trans	-60.1	-31.7	177.4	-145.2	-88.9	0	0	0	112.1	K534 L540	K534-Y536 PolarHBondContact O-N 3.22Å; Y536-L540 PolarHBondContact O-N 2.62Å; Y536-L540 VanDerWaalsContact O-N 3.08Å
537	L	37.4	Very low	43.5	Very low	129 Å²	129	82.6 Å²	82.6	68%	0.675	40%	0.403	S	S	*	.	H	α-helix	trans	-70.9	-32.7	173.1	-74.7	163.5	0	0	0	112.5	D535 N541	D535-L537 PolarHBondContact O-N 3.18Å; L537-N541 PolarHBondContact O-N 2.87Å; L537-N541 PolarHBondContact O-ND2 3.48Å; L537-N541 PolarHBondContact O-OD1 2.97Å
538	L	41.4	Very low	43.3	Very low	62 Å²	62	75.1 Å²	75.1	33%	0.325	38%	0.376	S	S	.	.	H	α-helix	trans	-76.8	-34.8	176.1	-87.2	151.8	0	0	0	112.1	L526 D535 N541 A542	L526-L538 HydrophobicContact CD2-CD2 3.53Å; D535-L538 HydrophobicContact CB-CB 3.98Å; D535-L538 HydrophobicContact CB-CD1 4.01Å; D535-L538 WeakPolarHBondContact O-CA 3.3Å; D535-L538 WeakPolarHBondContact O-CB 3.3Å; D535-L538 PolarHBondContact O-N 3.39Å; D535-L538 VanDerWaalsContact OD1-CD1 3.31Å; D535-L538 WeakPolarHBondContact OD1-CD1 3.28Å; L538-N541 CarbonylContact O-C 3.49Å; L538-N541 WeakPolarHBondContact O-CB 3.36Å; L538-N541 PolarHBondContact O-N 3.29Å; L538-A542 WeakPolarHBondContact O-CB 3.46Å; L538-A542 PolarHBondContact O-N 2.88Å
539	N	40.3	Very low	43.1	Very low	66 Å²	66	69.1 Å²	69.1	35%	0.353	36%	0.359	S	S	.	.	H	α-helix	trans	-65.9	-38.3	170.6	-92.4	-29.3	0	0	0	112	D535 N541 A542 S543	D535-N539 PolarHBondContact O-N 2.91Å; N539-N541 VanDerWaalsContact C-N 3.34Å; N539-A542 PolarHBondContact O-N 3.46Å; N539-S543 WeakPolarHBondContact O-CB 3.41Å; N539-S543 PolarHBondContact O-N 3.47Å; N539-S543 PolarHBondContact O-OG 3.42Å
540	L	40.8	Very low	42.8	Very low	59 Å²	59	72.8 Å²	72.8	31%	0.309	37%	0.37	S	S	.	.	H	α-helix	trans	-60.4	-48.6	170.8	-148.3	90	0	0	0	109.5	L484 Y536 A542 S543 I544	L484-L540 HydrophobicContact CD1-CD2 3.6Å; L484-L540 HydrophobicContact CD1-CG 4.36Å; Y536-L540 PolarHBondContact O-N 2.62Å; Y536-L540 VanDerWaalsContact O-N 3.08Å; L540-A542 VanDerWaalsContact C-N 3.33Å; L540-A542 PolarHBondContact O-N 2.91Å; L540-S543 PolarHBondContact O-N 3.34Å; L540-I544 HydrophobicContact CB-CD1 4.44Å; L540-I544 HydrophobicContact CD2-CD1 3.85Å; L540-I544 HydrophobicContact CG-CD1 3.84Å; L540-I544 VanDerWaalsContact O-CB 3.23Å; L540-I544 WeakPolarHBondContact O-CB 3.5Å; L540-I544 WeakPolarHBondContact O-CD1 3.3Å; L540-I544 WeakPolarHBondContact O-CG1 3.36Å; L540-I544 PolarHBondContact O-N 3.45Å
541	N	46.8	Very low	42.3	Very low	50 Å²	50	77.3 Å²	77.3	27%	0.267	40%	0.395	S	S	.	.	H	α-helix	trans	-59.6	-41.6	176.7	-64.1	-11.6	0	0	0	111.8	M491 L537 L538 N539 I544 M545	M491-N541 HydrophobicContact CE-CB 4.48Å; M491-N541 WeakPolarHBondContact CE-OD1 3.4Å; M491-N541 HydrophobicContact SD-CB 4.42Å; L537-N541 PolarHBondContact O-N 2.87Å; L537-N541 PolarHBondContact O-ND2 3.48Å; L537-N541 PolarHBondContact O-OD1 2.97Å; L538-N541 CarbonylContact O-C 3.49Å; L538-N541 WeakPolarHBondContact O-CB 3.36Å; L538-N541 PolarHBondContact O-N 3.29Å; N539-N541 VanDerWaalsContact C-N 3.34Å; N541-I544 PolarHBondContact O-N 2.88Å; N541-M545 VanDerWaalsContact O-CB 3.25Å; N541-M545 WeakPolarHBondContact O-CB 3.33Å; N541-M545 WeakPolarHBondContact O-CG 3.35Å; N541-M545 PolarHBondContact O-N 3.46Å
542	A	43	Very low	42.1	Very low	4 Å²	4	72 Å²	72	3%	0.033	39%	0.387	C	S	.	.	H	α-helix	trans	-64.3	-45.3	178.5	0	0	0	0	0	113	L526 L538 N539 L540 M545 A546	L526-A542 HydrophobicContact CB-CB 3.67Å; L538-A542 WeakPolarHBondContact O-CB 3.46Å; L538-A542 PolarHBondContact O-N 2.88Å; N539-A542 PolarHBondContact O-N 3.46Å; L540-A542 VanDerWaalsContact C-N 3.33Å; L540-A542 PolarHBondContact O-N 2.91Å; A542-M545 PolarHBondContact O-N 3.46Å; A542-A546 WeakPolarHBondContact O-CB 3.17Å; A542-A546 PolarHBondContact O-N 3.07Å
543	S	44.8	Very low	41.7	Very low	78 Å²	78	80.5 Å²	80.5	55%	0.545	42%	0.417	S	S	.	.	H	α-helix	trans	-66.6	-39.9	175.7	-76	0	0	0	0	111.8	N539 L540 A546 E547	N539-S543 WeakPolarHBondContact O-CB 3.41Å; N539-S543 PolarHBondContact O-N 3.47Å; N539-S543 PolarHBondContact O-OG 3.42Å; L540-S543 PolarHBondContact O-N 3.34Å; S543-A546 PolarHBondContact O-N 3.28Å; S543-E547 PolarHBondContact O-N 3.46Å
544	I	47.8	Very low	41.8	Very low	4 Å²	4	78.4 Å²	78.4	2%	0.021	41%	0.405	C	S	.	.	H	α-helix	trans	-65.5	-41.5	175.7	-67	170.8	0	0	0	110.7	R488 M491 L540 N541 E547 S548	R488-I544 HydrophobicContact CB-CG2 4.27Å; R488-I544 HydrophobicContact CG-CB 4.34Å; R488-I544 HydrophobicContact CG-CD1 3.81Å; R488-I544 HydrophobicContact CG-CG1 3.62Å; R488-I544 HydrophobicContact CG-CG2 3.87Å; M491-I544 HydrophobicContact CB-CG2 3.59Å; M491-I544 HydrophobicContact CG-CG2 4.09Å; M491-I544 HydrophobicContact SD-CB 3.89Å; M491-I544 HydrophobicContact SD-CD1 3.9Å; M491-I544 HydrophobicContact SD-CG2 3.43Å; M491-I544 WeakPolarHBondContact SD-CG2 3.49Å; L540-I544 HydrophobicContact CB-CD1 4.44Å; L540-I544 HydrophobicContact CD2-CD1 3.85Å; L540-I544 HydrophobicContact CG-CD1 3.84Å; L540-I544 VanDerWaalsContact O-CB 3.23Å; L540-I544 WeakPolarHBondContact O-CB 3.5Å; L540-I544 WeakPolarHBondContact O-CD1 3.3Å; L540-I544 WeakPolarHBondContact O-CG1 3.36Å; L540-I544 PolarHBondContact O-N 3.45Å; N541-I544 PolarHBondContact O-N 2.88Å; I544-E547 PolarHBondContact O-N 3.08Å; I544-S548 VanDerWaalsContact O-CB 3.28Å; I544-S548 WeakPolarHBondContact O-CB 3.37Å; I544-S548 PolarHBondContact O-N 3.12Å; I544-S548 PolarHBondContact O-OG 3.31Å
545	M	45.3	Very low	41.8	Very low	27 Å²	27	77.2 Å²	77.2	13%	0.133	40%	0.404	C	S	.	.	H	α-helix	trans	-65.1	-40.1	176.9	-65	-98.6	-73.4	0	0	110.9	M495 L522 I523 L526 N541 A542 S548 T549	M495-M545 HydrophobicContact CE-CE 4Å; M495-M545 HydrophobicContact CE-SD 4.4Å; M495-M545 HydrophobicContact CG-CE 4.03Å; M495-M545 HydrophobicContact CG-CG 4.47Å; M495-M545 HydrophobicContact CG-SD 3.26Å; M495-M545 WeakPolarHBondContact CG-SD 3.45Å; M495-M545 HydrophobicContact SD-CE 3.15Å; M495-M545 WeakPolarHBondContact SD-CE 3.47Å; M495-M545 HydrophobicContact SD-SD 3.28Å; L522-M545 HydrophobicContact CB-CE 4.36Å; I523-M545 HydrophobicContact CG1-CB 3.92Å; L526-M545 HydrophobicContact CD1-CE 3.7Å; L526-M545 HydrophobicContact CD1-CG 4.18Å; N541-M545 VanDerWaalsContact O-CB 3.25Å; N541-M545 WeakPolarHBondContact O-CB 3.33Å; N541-M545 WeakPolarHBondContact O-CG 3.35Å; N541-M545 PolarHBondContact O-N 3.46Å; A542-M545 PolarHBondContact O-N 3.46Å; M545-S548 VanDerWaalsContact CA-OG 3.31Å; M545-S548 WeakPolarHBondContact CA-OG 3.45Å; M545-S548 PolarHBondContact O-N 2.81Å; M545-S548 PolarHBondContact O-OG 3.31Å; M545-T549 PolarHBondContact O-N 3.24Å; M545-T549 PolarHBondContact O-OG1 3.42Å
546	A	50.5	Low	41.7	Very low	24 Å²	24	79.3 Å²	79.3	20%	0.198	41%	0.414	C	S	.	.	H	α-helix	trans	-68	-38.5	176.7	0	0	0	0	0	113.9	I523 A542 S543 S548 T549	I523-A546 HydrophobicContact CG2-CB 4.24Å; A542-A546 WeakPolarHBondContact O-CB 3.17Å; A542-A546 PolarHBondContact O-N 3.07Å; S543-A546 PolarHBondContact O-N 3.28Å; A546-S548 VanDerWaalsContact C-N 3.33Å; A546-T549 PolarHBondContact O-OG1 2.8Å
547	E	49.6	Very low	42.1	Very low	111 Å²	111	74.7 Å²	74.7	52%	0.519	40%	0.402	S	S	.	.	H	α-helix	trans	-67.6	-34.7	171.4	-82.6	-179.6	162.3	0	0	111.5	S543 I544 T549 Q550	S543-E547 PolarHBondContact O-N 3.46Å; I544-E547 PolarHBondContact O-N 3.08Å; E547-T549 VanDerWaalsContact C-N 3.34Å; E547-T549 PolarHBondContact O-N 2.9Å; E547-Q550 PolarHBondContact O-N 2.81Å
548	S	42.9	Very low	42.3	Very low	9 Å²	9	71.3 Å²	71.3	6%	0.063	39%	0.385	C	S	.	.	H	α-helix	trans	-72.9	-22.7	-178.1	71.6	0	0	0	0	115.4	R492 I544 M545 A546	R492-S548 VanDerWaalsContact CA-CB 3.48Å; R492-S548 PolarHBondContact NH1-O 3.15Å; I544-S548 VanDerWaalsContact O-CB 3.28Å; I544-S548 WeakPolarHBondContact O-CB 3.37Å; I544-S548 PolarHBondContact O-N 3.12Å; I544-S548 PolarHBondContact O-OG 3.31Å; M545-S548 VanDerWaalsContact CA-OG 3.31Å; M545-S548 WeakPolarHBondContact CA-OG 3.45Å; M545-S548 PolarHBondContact O-N 2.81Å; M545-S548 PolarHBondContact O-OG 3.31Å; A546-S548 VanDerWaalsContact C-N 3.33Å
549	T	43.9	Very low	42.4	Very low	55 Å²	55	71.9 Å²	71.9	34%	0.337	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-6	174.9	46.2	0	0	0	0	113.7	M495 I523 M545 A546 E547	M495-T549 HydrophobicContact CE-CG2 3.88Å; I523-T549 HydrophobicContact CD1-CG2 3.81Å; M545-T549 PolarHBondContact O-N 3.24Å; M545-T549 PolarHBondContact O-OG1 3.42Å; A546-T549 PolarHBondContact O-OG1 2.8Å; E547-T549 VanDerWaalsContact C-N 3.34Å; E547-T549 PolarHBondContact O-N 2.9Å
550	Q	38.7	Very low	42.6	Very low	132 Å²	132	72.4 Å²	72.4	62%	0.617	39%	0.392	S	S	*	.	S	Bend	trans	-71.7	131.2	172.3	-70.1	-173.2	-4.5	0	0	110.1	R492 E547 V552	R492-Q550 PolarHBondContact NH1-O 3.03Å; E547-Q550 PolarHBondContact O-N 2.81Å; Q550-V552 PolarHBondContact O-N 3.33Å
551	P	32.1	Very low	42.7	Very low	120 Å²	120	73.4 Å²	73.4	78%	0.779	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-58.5	125.6	170.6	24.2	-30.7	0	0	0	108.3	K553	P551-K553 PolarHBondContact O-N 2.8Å
552	V	37.4	Very low	42.4	Very low	109 Å²	109	75.3 Å²	75.3	66%	0.661	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-66.2	121	172.8	167.2	0	0	0	0	107	Q550	Q550-V552 PolarHBondContact O-N 3.33Å
553	K	32.2	Very low	42.3	Very low	231 Å²	231	81.8 Å²	81.8	100%	1.004	44%	0.443	S	S	*	.			trans	-71.5	0	164.3	-81.6	-174.7	174.3	-179.1	0	110.3	P551	P551-K553 PolarHBondContact O-N 2.8Å

Retrieved 553 of 553 residues in 556.8 ms (Link to these results)

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