A0A3Q0KNU1_SCHMA Loading...

Voltage-gated potassium channel, KCNQ

AlphaFold DB (A0A5K4EQY8), UniProt , Accession A0A3Q0KNU1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,058 aa.

						>A0A3Q0KNU1_SCHMA|A0A3Q0KNU1
MSTRFSSPVFMDTCNHYNRKNRKFRKNIFEVRVDEPIDVEMKNHPIYNIDPGGCSSKVDENLTNDSYNKPWESSNIDTGHYPYHCDTDLEVCSQSNYIDVYNNNNNNNNNNCDYKKMPHNNSTEFRHFLAPPPQECTQRRTSLHGKTITIRISRNETRYRKLQAKIYNFLERPKTWPSVIYHVFVFASVFGCLILSVLSTINEYAESAGRVLLYMELVILFWFFAEYCLRLWSAGCRSRYQTWRGRLHFARRPFCIVDVIVIVASVVVLAVDSDRNMFAASALRGLRFFQILRMIRMDRRGGSFKLLASVVWAHRQELFTTVYIGFLGLLFSSFLIFLVEKKENEKIRTYADALWWGVITLCTVGYGDSVPQSGLGKTIAGCSCLAIISFYALPPITLCTVGYGDTVPKTWMGKIIAAFCALAGISFFALPAGILGSGFALKVQQHQRQKHLIRRRVPAATLIQCLWRCYAADPHSSSVATWKIHMRPIRKPVGLTNSYSMTERSGFSRFGRFSTLKRRTEKTTSNTNTNVNNIVPTVSTDYPNNETPKSAPVKSEDLDVIYAFINDEDTTNSQNIPDPGKPPELDEKIVKASSELLPILTKVRTPNDRQCATDSLSTSQSEHISISKSGNHSAQQKQNFNSPAMFQHDPYLCSSRGSEVIMHPLTEKEKIAVRVIRKMRFFVARRKFREALRPYDVKDVIEQYSAGHVDMLARVKILQARLDQILGRPGSKGDDVYDSHQCLASRIVKIEHKIDAVEMKLDRLINILKADYMCKYRSQVENTDVSVKHSLQDSIQYIQQTNCSDKLNHQTQCNTLFSPPPRTTTGQYPKVSEDKVFVIQRRPCNRYQKQKLTSSERNSLTVNFPLSLITERWKSIDTETSTKNDYPNNEKLNTDTIIYNQDNDNRHKVYSKSQFISHSEEFPLTKRRSFPLQSTSSFNILSNKQGLSTYSESCLKTVNNNNKDYDNHSCKSFHNMNQTIHDLKTNQYPINPYTQISLNYSNLSKSMNSITIPNRYSSSLKTCLQRQEEINTPLDYGFIIEEEQERKCLLDSTHNTNS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	31.7	Very low	29.5	Very low	254 Å²	254	152.2 Å²	152.2	100%	1.251	81%	0.805	S	S	*	*				0	120.6	0	-122.5	163.6	174.5	0	0	108.7
2	S	23.6	Very low	29.3	Very low	122 Å²	122	149.3 Å²	149.3	85%	0.853	79%	0.79	S	S	*	*			trans	-118.4	113.3	-164	-178.4	0	0	0	0	111.8
3	T	30	Very low	29.3	Very low	132 Å²	132	148.2 Å²	148.2	81%	0.81	79%	0.793	S	S	*	*			trans	-150	123.5	166.6	43.6	0	0	0	0	112.2
4	R	24.7	Very low	29.2	Very low	235 Å²	235	144 Å²	144	89%	0.887	78%	0.78	S	S	*	*			trans	-49.2	141.6	172.2	-54.8	161.9	-178.5	166.4	-0.8	112.4
5	F	30.9	Very low	29.2	Very low	209 Å²	209	144.7 Å²	144.7	92%	0.917	78%	0.783	S	S	*	*			trans	-145.7	127.7	149.1	-102.8	-74.4	0	0	0	112.2
6	S	29.3	Very low	29.2	Very low	115 Å²	115	146.7 Å²	146.7	80%	0.804	79%	0.785	S	S	*	*			trans	-77.2	138.8	-167.9	-50.1	0	0	0	0	113.9
7	S	28.4	Very low	29.2	Very low	98 Å²	98	150.2 Å²	150.2	69%	0.685	79%	0.787	S	S	*	*			trans	-69.4	139.4	170.6	-58.8	0	0	0	0	112.2	V9	S7-V9 PolarHBondContact O-N 3.37Å
8	P	34.8	Very low	29.4	Very low	77 Å²	77	148.8 Å²	148.8	50%	0.5	78%	0.78	S	S	.	*			trans	-76.1	100.3	156.8	7.4	10	0	0	0	107.6	F10	P8-F10 PolarHBondContact O-N 3.38Å
9	V	28.7	Very low	29.7	Very low	96 Å²	96	152.2 Å²	152.2	58%	0.582	78%	0.782	S	S	*	*			trans	-67.9	99	177.5	179.6	0	0	0	0	109.1	S7	S7-V9 PolarHBondContact O-N 3.37Å
10	F	29.8	Very low	30.1	Very low	157 Å²	157	154.4 Å²	154.4	69%	0.689	79%	0.785	S	S	*	*			trans	-136.1	31.2	175.7	-128	-87.2	0	0	0	113	P8 I148 I150	P8-F10 PolarHBondContact O-N 3.38Å; F10-I148 HydrophobicContact CE2-CD1 4.14Å; F10-I148 HydrophobicContact CZ-CD1 4.18Å; F10-I150 HydrophobicContact CE2-CD1 4.26Å
11	M	32.2	Very low	30.6	Very low	179 Å²	179	151.9 Å²	151.9	88%	0.882	77%	0.773	S	S	*	*	S	Bend	trans	-150.8	-3.7	168.1	-122.1	178.5	-172.7	0	0	118.3
12	D	27.2	Very low	30.8	Very low	117 Å²	117	148.7 Å²	148.7	63%	0.626	75%	0.747	S	S	*	*			trans	-101.4	-1.1	-165.5	-69.2	-49.9	0	0	0	117.7	C14	D12-C14 PolarHBondContact O-N 3.35Å
13	T	29.6	Very low	31.3	Very low	135 Å²	135	151.7 Å²	151.7	83%	0.828	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	46.6	-177.9	57.3	0	0	0	0	114.2
14	C	28.4	Very low	31.4	Very low	90 Å²	90	151.8 Å²	151.8	61%	0.608	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.5	31.4	174	-129.9	0	0	0	0	115.4	D12 H16	D12-C14 PolarHBondContact O-N 3.35Å; C14-H16 VanDerWaalsContact C-N 3.26Å; C14-H16 PolarHBondContact O-N 2.99Å
15	N	28.1	Very low	31.8	Very low	155 Å²	155	149.3 Å²	149.3	83%	0.829	73%	0.725	S	S	*	*			trans	-80.1	7	-177.7	-94.3	-23.6	0	0	0	115.8
16	H	29.2	Very low	32	Very low	176 Å²	176	146.7 Å²	146.7	82%	0.815	71%	0.714	S	S	*	*			trans	-118.6	106.5	162.7	-105.8	-15.5	0	0	0	107.8	C14	C14-H16 VanDerWaalsContact C-N 3.26Å; C14-H16 PolarHBondContact O-N 2.99Å
17	Y	29.6	Very low	32.2	Very low	206 Å²	206	147.4 Å²	147.4	81%	0.808	71%	0.708	S	S	*	*	S	Bend	trans	-179.6	150.6	143.6	-113.8	-85.9	0	0	0	111.7
18	N	33.4	Very low	32.6	Very low	125 Å²	125	146.1 Å²	146.1	67%	0.668	69%	0.693	S	S	*	*			trans	-41	141.4	-163.5	-107.6	-53.7	0	0	0	120.6	K20	N18-K20 VanDerWaalsContact C-N 3.27Å; N18-K20 PolarHBondContact O-N 3.12Å; N18-K20 VanDerWaalsContact O-N 3.16Å
19	R	34.2	Very low	32.6	Very low	214 Å²	214	151.5 Å²	151.5	81%	0.808	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-62.1	-22.1	-176.7	-138.4	174.1	-173.8	178.3	0.2	114.7	N21	R19-N21 PolarHBondContact O-N 2.95Å
20	K	37.7	Very low	32.8	Very low	195 Å²	195	151.9 Å²	151.9	85%	0.848	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-66.2	-25.5	-174.2	-70.7	-174.6	176.2	-179.2	0	114.5	N18 R22	N18-K20 VanDerWaalsContact C-N 3.27Å; N18-K20 PolarHBondContact O-N 3.12Å; N18-K20 VanDerWaalsContact O-N 3.16Å; K20-R22 VanDerWaalsContact C-N 3.34Å; K20-R22 PolarHBondContact O-N 3.19Å
21	N	41.6	Very low	32.9	Very low	102 Å²	102	148.4 Å²	148.4	55%	0.545	70%	0.696	S	S	.	*	G	3₁₀ helix	trans	-82.3	3.5	-175.7	-79.9	-12.5	0	0	0	115.9	R19 K23 F24 R25	R19-N21 PolarHBondContact O-N 2.95Å; N21-K23 PolarHBondContact O-N 3.35Å; N21-F24 PolarHBondContact O-N 2.94Å; N21-R25 PolarHBondContact O-N 2.64Å
22	R	35.5	Very low	32.9	Very low	187 Å²	187	147 Å²	147	71%	0.706	68%	0.681	S	S	*	*	H	α-helix	trans	-65.2	-31.9	-179.5	-80.6	-173.3	174.3	-173	-1.8	114.4	K20 F24 R25 K26	K20-R22 VanDerWaalsContact C-N 3.34Å; K20-R22 PolarHBondContact O-N 3.19Å; R22-F24 VanDerWaalsContact C-N 3.34Å; R22-R25 PolarHBondContact O-N 3.27Å; R22-K26 PolarHBondContact O-N 3.02Å
23	K	34.6	Very low	33.2	Very low	186 Å²	186	145.3 Å²	145.3	81%	0.809	67%	0.674	S	S	*	*	H	α-helix	trans	-65.1	-35.9	174.7	-79.4	-170.9	175.1	-175.9	0	112.1	N21	N21-K23 PolarHBondContact O-N 3.35Å
24	F	32	Very low	33.1	Very low	133 Å²	133	144.1 Å²	144.1	58%	0.583	66%	0.663	S	S	*	*	H	α-helix	trans	-73	-39.8	178.1	-133.5	-108.2	0	0	0	111.9	N21 R22 K26 N27 I28	N21-F24 PolarHBondContact O-N 2.94Å; R22-F24 VanDerWaalsContact C-N 3.34Å; F24-K26 PolarHBondContact O-N 3.45Å; F24-N27 PolarHBondContact O-N 3.17Å; F24-I28 HydrophobicContact CD1-CD1 3.53Å; F24-I28 HydrophobicContact CE1-CD1 4Å; F24-I28 HydrophobicContact CG-CD1 4.45Å; F24-I28 WeakPolarHBondContact O-CD1 3.36Å; F24-I28 VanDerWaalsContact O-CG1 3.29Å; F24-I28 WeakPolarHBondContact O-CG1 3.16Å; F24-I28 PolarHBondContact O-N 3.12Å
25	R	32.6	Very low	33.1	Very low	183 Å²	183	147.2 Å²	147.2	69%	0.691	67%	0.668	S	S	*	*	H	α-helix	trans	-64.2	-37	177.5	-83.9	-164.1	178.3	-164.9	3.2	114.3	N21 R22 N27 I28	N21-R25 PolarHBondContact O-N 2.64Å; R22-R25 PolarHBondContact O-N 3.27Å; R25-N27 PolarHBondContact O-N 3.19Å; R25-I28 PolarHBondContact O-N 2.98Å
26	K	35.2	Very low	33.2	Very low	155 Å²	155	143.8 Å²	143.8	67%	0.674	65%	0.654	S	S	*	*	H	α-helix	trans	-60	-45.8	177.2	-77.9	-168.8	170.2	-167.1	0	111.4	R22 F24 I28 E30	R22-K26 PolarHBondContact O-N 3.02Å; F24-K26 PolarHBondContact O-N 3.45Å; K26-I28 PolarHBondContact O-N 3.1Å; K26-E30 WeakPolarHBondContact O-CB 3.15Å
27	N	33.2	Very low	33.3	Very low	130 Å²	130	139.4 Å²	139.4	70%	0.695	64%	0.636	S	S	*	*	H	α-helix	trans	-76.7	-3.8	-177.1	-62.6	7.7	0	0	0	114.6	F24 R25	F24-N27 PolarHBondContact O-N 3.17Å; R25-N27 PolarHBondContact O-N 3.19Å
28	I	37.7	Very low	33.4	Very low	70 Å²	70	133.4 Å²	133.4	36%	0.359	62%	0.618	S	S	.	*	H	α-helix	trans	-97.4	-26.2	-175.3	-79.4	173.1	0	0	0	113.4	F24 R25 K26	F24-I28 HydrophobicContact CD1-CD1 3.53Å; F24-I28 HydrophobicContact CE1-CD1 4Å; F24-I28 HydrophobicContact CG-CD1 4.45Å; F24-I28 WeakPolarHBondContact O-CD1 3.36Å; F24-I28 VanDerWaalsContact O-CG1 3.29Å; F24-I28 WeakPolarHBondContact O-CG1 3.16Å; F24-I28 PolarHBondContact O-N 3.12Å; R25-I28 PolarHBondContact O-N 2.98Å; K26-I28 PolarHBondContact O-N 3.1Å
29	F	33.3	Very low	33.4	Very low	191 Å²	191	129 Å²	129	84%	0.838	60%	0.595	S	S	*	*	H	α-helix	trans	-107.9	0.6	176.6	-84.9	-86.6	0	0	0	113.8
30	E	32.8	Very low	33.2	Very low	104 Å²	104	124.5 Å²	124.5	49%	0.486	58%	0.584	S	S	.	*			trans	-109.6	44.1	-175.8	-158.7	147.8	-125.2	0	0	112.3	K26 R32	K26-E30 WeakPolarHBondContact O-CB 3.15Å; E30-R32 PolarHBondContact O-N 3.42Å; E30-R32 IonicContact OE1-CZ 2.75Å; E30-R32 IonicContact OE1-NE 3.37Å; E30-R32 PolarHBondContact OE1-NE 3.46Å; E30-R32 IonicContact OE1-NH2 3.55Å; E30-R32 PolarHBondContact OE1-NH2 3.12Å
31	V	32.7	Very low	32.7	Very low	84 Å²	84	120.3 Å²	120.3	51%	0.509	57%	0.569	S	S	.	*			trans	-86.4	70.3	148.4	-175.3	0	0	0	0	106.4	V33	V31-V33 PolarHBondContact O-N 3.14Å
32	R	31.8	Very low	32.2	Very low	150 Å²	150	122.4 Å²	122.4	57%	0.566	57%	0.573	S	S	*	*			trans	-73.5	107	174.1	-102.7	-168.4	-76.6	144.1	-15	108.3	E30 D34	E30-R32 PolarHBondContact O-N 3.42Å; E30-R32 IonicContact OE1-CZ 2.75Å; E30-R32 IonicContact OE1-NE 3.37Å; E30-R32 PolarHBondContact OE1-NE 3.46Å; E30-R32 IonicContact OE1-NH2 3.55Å; E30-R32 PolarHBondContact OE1-NH2 3.12Å; R32-D34 VanDerWaalsContact CD-OD1 3.29Å; R32-D34 WeakPolarHBondContact CD-OD1 3.17Å; R32-D34 WeakPolarHBondContact CD-OD2 3.34Å; R32-D34 IonicContact CZ-OD2 2.78Å; R32-D34 IonicContact NE-OD2 2.68Å; R32-D34 IonicContact NH1-OD2 3.22Å; R32-D34 PolarHBondContact NH1-OD2 2.8Å; R32-D34 PolarHBondContact O-N 2.86Å
33	V	34.4	Very low	32.1	Very low	81 Å²	81	120.7 Å²	120.7	49%	0.491	58%	0.578	S	S	.	*			trans	-75.9	84.9	161.5	-177.4	0	0	0	0	105.5	V31 E35	V31-V33 PolarHBondContact O-N 3.14Å; V33-E35 PolarHBondContact O-N 3.5Å
34	D	27.4	Very low	31.9	Very low	109 Å²	109	119.4 Å²	119.4	58%	0.583	57%	0.574	S	S	*	*			trans	-81.2	5.9	-171.5	-91.9	-23.7	0	0	0	113.9	R32	R32-D34 VanDerWaalsContact CD-OD1 3.29Å; R32-D34 WeakPolarHBondContact CD-OD1 3.17Å; R32-D34 WeakPolarHBondContact CD-OD2 3.34Å; R32-D34 IonicContact CZ-OD2 2.78Å; R32-D34 IonicContact NE-OD2 2.68Å; R32-D34 IonicContact NH1-OD2 3.22Å; R32-D34 PolarHBondContact NH1-OD2 2.8Å; R32-D34 PolarHBondContact O-N 2.86Å
35	E	28.7	Very low	32	Very low	155 Å²	155	117.7 Å²	117.7	72%	0.724	58%	0.577	S	S	*	*	S	Bend	trans	-90.5	128.9	163.5	-74	-163.2	128.3	0	0	112	V33 I37	V33-E35 PolarHBondContact O-N 3.5Å; E35-I37 PolarHBondContact O-N 3.17Å
36	P	28.7	Very low	31.8	Very low	83 Å²	83	116.3 Å²	116.3	54%	0.539	58%	0.581	S	S	.	*			trans	-72.2	98.5	164.3	31.1	-30.9	0	0	0	108.9	D38	P36-D38 VanDerWaalsContact C-N 3.3Å; P36-D38 PolarHBondContact O-N 3.25Å
37	I	32.9	Very low	31.6	Very low	85 Å²	85	118.4 Å²	118.4	44%	0.436	59%	0.586	S	S	.	*			trans	-68.5	94.7	165.5	-54.7	177.8	0	0	0	107.2	E35 V39	E35-I37 PolarHBondContact O-N 3.17Å; I37-V39 VanDerWaalsContact C-N 3.32Å; I37-V39 HydrophobicContact CG2-CG2 3.81Å; I37-V39 PolarHBondContact O-N 2.9Å
38	D	30.7	Very low	31.4	Very low	80 Å²	80	118.8 Å²	118.8	43%	0.428	59%	0.588	S	S	.	*			trans	-67.4	94.2	167.5	-84.4	-50.7	0	0	0	108.2	P36 E40 R300	P36-D38 VanDerWaalsContact C-N 3.3Å; P36-D38 PolarHBondContact O-N 3.25Å; D38-E40 VanDerWaalsContact C-N 3.3Å; D38-E40 PolarHBondContact O-N 3.33Å; D38-R300 IonicContact OD1-CZ 4Å; D38-R300 IonicContact OD1-NH1 2.71Å; D38-R300 PolarHBondContact OD1-NH1 3.28Å
39	V	34.3	Very low	31.2	Very low	31 Å²	31	122.6 Å²	122.6	19%	0.188	61%	0.608	C	S	.	*			trans	-73.5	88.1	174.8	179.9	0	0	0	0	108.9	I37 M41 D86 K174	I37-V39 VanDerWaalsContact C-N 3.32Å; I37-V39 HydrophobicContact CG2-CG2 3.81Å; I37-V39 PolarHBondContact O-N 2.9Å; V39-M41 PolarHBondContact O-N 3.36Å; V39-D86 HydrophobicContact CG1-CB 4.44Å; V39-K174 PolarHBondContact O-NZ 3.49Å
40	E	29.1	Very low	31.2	Very low	121 Å²	121	120.3 Å²	120.3	57%	0.565	61%	0.605	S	S	*	*			trans	-81.5	91.1	166.9	-163.7	-173.2	-177.7	0	0	109.4	D38 K42	D38-E40 VanDerWaalsContact C-N 3.3Å; D38-E40 PolarHBondContact O-N 3.33Å; E40-K42 VanDerWaalsContact C-N 3.29Å; E40-K42 HydrophobicContact CG-CG 3.96Å; E40-K42 PolarHBondContact O-N 3.23Å; E40-K42 WeakPolarHBondContact OE1-CE 3.37Å; E40-K42 WeakPolarHBondContact OE1-CG 3.47Å; E40-K42 IonicContact OE1-NZ 2.7Å; E40-K42 WeakPolarHBondContact OE2-CE 3.29Å
41	M	28	Very low	31	Very low	107 Å²	107	121.5 Å²	121.5	53%	0.527	62%	0.621	S	S	.	*			trans	-69.5	91.9	158.8	-82	-164.9	168.6	0	0	108.2	V39 N43 D86	V39-M41 PolarHBondContact O-N 3.36Å; M41-N43 PolarHBondContact O-N 3.13Å; M41-N43 VanDerWaalsContact O-N 3.12Å; M41-D86 WeakPolarHBondContact CE-OD1 3.47Å
42	K	30.7	Very low	30.9	Very low	146 Å²	146	121.6 Å²	121.6	64%	0.635	64%	0.639	S	S	*	*			trans	-67.5	106	164.3	-75.6	-167.8	176.2	-176.4	0	108.8	E40 H44	E40-K42 VanDerWaalsContact C-N 3.29Å; E40-K42 HydrophobicContact CG-CG 3.96Å; E40-K42 PolarHBondContact O-N 3.23Å; E40-K42 WeakPolarHBondContact OE1-CE 3.37Å; E40-K42 WeakPolarHBondContact OE1-CG 3.47Å; E40-K42 IonicContact OE1-NZ 2.7Å; E40-K42 WeakPolarHBondContact OE2-CE 3.29Å; K42-H44 PolarHBondContact O-N 2.87Å
43	N	33.8	Very low	30.9	Very low	150 Å²	150	118.4 Å²	118.4	80%	0.802	65%	0.653	S	S	*	*			trans	-60.6	114.7	160.5	-71.5	-17.8	0	0	0	107.5	M41	M41-N43 PolarHBondContact O-N 3.13Å; M41-N43 VanDerWaalsContact O-N 3.12Å
44	H	30.2	Very low	30.4	Very low	159 Å²	159	120.9 Å²	120.9	74%	0.736	67%	0.673	S	S	*	*			trans	-68.6	140.3	167.6	-81.1	-87.7	0	0	0	109.1	K42	K42-H44 PolarHBondContact O-N 2.87Å
45	P	34	Very low	30.6	Very low	98 Å²	98	121.3 Å²	121.3	64%	0.636	68%	0.684	S	S	*	*			trans	-68.2	139.7	-179.7	28.5	-34.2	0	0	0	110.9	Y47	P45-Y47 HydrophobicContact CG-CE2 4.32Å; P45-Y47 PolarHBondContact O-N 3.09Å
46	I	29	Very low	30.7	Very low	154 Å²	154	118.3 Å²	118.3	79%	0.79	68%	0.68	S	S	*	*			trans	-77.6	116	167.3	-61.2	170.9	0	0	0	106.6
47	Y	31.2	Very low	30.9	Very low	198 Å²	198	123.9 Å²	123.9	78%	0.776	70%	0.696	S	S	*	*			trans	-87.9	111.7	164.5	-88.8	-86.4	0	0	0	108.6	P45	P45-Y47 HydrophobicContact CG-CE2 4.32Å; P45-Y47 PolarHBondContact O-N 3.09Å
48	N	27.9	Very low	30.8	Very low	138 Å²	138	125.8 Å²	125.8	74%	0.738	71%	0.711	S	S	*	*			trans	-74.9	133.2	156.1	-74.8	-4.2	0	0	0	107.8
49	I	33.8	Very low	30.9	Very low	151 Å²	151	129 Å²	129	77%	0.774	73%	0.728	S	S	*	*			trans	-137.8	135.7	158.5	-60.4	-176.2	0	0	0	106.9
50	D	32.7	Very low	30.7	Very low	143 Å²	143	135.4 Å²	135.4	77%	0.765	76%	0.756	S	S	*	*			trans	-76.7	163.1	-161.5	-58.8	-71	0	0	0	115.2
51	P	29.6	Very low	30.8	Very low	128 Å²	128	136.9 Å²	136.9	83%	0.831	77%	0.768	S	S	*	*			trans	-93.8	144.4	179.8	35.8	-32.9	0	0	0	113.8
52	G	30.2	Very low	31	Very low	87 Å²	87	138.5 Å²	138.5	90%	0.897	78%	0.778	S	S	*	*			trans	122.8	133.7	157.8	0	0	0	0	0	115.9
53	G	31.2	Very low	31	Very low	83 Å²	83	137.2 Å²	137.2	86%	0.856	78%	0.783	S	S	*	*			trans	149	87.9	172	0	0	0	0	0	114.3
54	C	25.1	Very low	30.8	Very low	133 Å²	133	136.5 Å²	136.5	90%	0.899	78%	0.779	S	S	*	*			trans	-92.4	142.5	173.3	-69.5	0	0	0	0	112.8
55	S	31.8	Very low	30.9	Very low	117 Å²	117	135.3 Å²	135.3	82%	0.818	78%	0.778	S	S	*	*			trans	156.1	144.3	144.4	-100.4	0	0	0	0	108.9
56	S	29.9	Very low	30.5	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	77%	0.772	S	S	*	*			cis	160.1	146.2	-14	54.8	0	0	0	0	105.3
57	K	33.7	Very low	30.6	Very low	199 Å²	199	136 Å²	136	87%	0.865	77%	0.771	S	S	*	*			trans	100.9	106.5	-177.8	-61.8	178.7	177.4	-174.6	0	112.9
58	V	30.4	Very low	30.6	Very low	125 Å²	125	133.2 Å²	133.2	76%	0.758	77%	0.769	S	S	*	*			cis	105.6	144.9	35.2	173	0	0	0	0	110.7
59	D	32.7	Very low	30.6	Very low	147 Å²	147	135.9 Å²	135.9	79%	0.786	77%	0.774	S	S	*	*			trans	108.3	73.9	-176.6	-57.6	-11.4	0	0	0	112.6
60	E	30	Very low	30.4	Very low	167 Å²	167	132.7 Å²	132.7	78%	0.78	76%	0.763	S	S	*	*				74.4	105.1	84	-72.3	-158.1	151.6	0	0	116.2
61	N	31.3	Very low	30.2	Very low	151 Å²	151	136.7 Å²	136.7	81%	0.807	77%	0.767	S	S	*	*				-179.1	139.5	119.5	-98	-61.1	0	0	0	114
62	L	32.7	Very low	30.1	Very low	142 Å²	142	139.4 Å²	139.4	74%	0.743	77%	0.769	S	S	*	*			trans	58.3	96	172.3	-79.5	71.8	0	0	0	117.5
63	T	30.4	Very low	29.9	Very low	119 Å²	119	140.6 Å²	140.6	73%	0.73	76%	0.764	S	S	*	*				55	132.8	81.2	70.1	0	0	0	0	115.2
64	N	29.4	Very low	29.8	Very low	134 Å²	134	141.8 Å²	141.8	72%	0.717	76%	0.759	S	S	*	*			cis	-154.7	169.2	-8.4	-103.5	37.4	0	0	0	105.1
65	D	31.5	Very low	30	Very low	134 Å²	134	142 Å²	142	72%	0.717	75%	0.751	S	S	*	*			cis	-147.5	-171.9	10.2	-139.9	-57.3	0	0	0	111.7
66	S	26.6	Very low	29.9	Very low	73 Å²	73	143.4 Å²	143.4	51%	0.51	75%	0.748	S	S	.	*			trans	-103.9	149.6	-169.4	179	0	0	0	0	114.3
67	Y	30.2	Very low	29.8	Very low	195 Å²	195	145.6 Å²	145.6	77%	0.765	75%	0.752	S	S	*	*				163.8	129	110.7	-94	-68.4	0	0	0	115.4
68	N	32.6	Very low	29.5	Very low	138 Å²	138	142.5 Å²	142.5	74%	0.738	75%	0.75	S	S	*	*			trans	64.5	103.9	148.7	-63.8	-19.6	0	0	0	122.9
69	K	27.3	Very low	29.2	Very low	195 Å²	195	140 Å²	140	85%	0.848	75%	0.749	S	S	*	*			trans	-67.3	159.2	131.4	-64.5	178.7	178.8	175.3	0	109.2
70	P	29.1	Very low	29.1	Very low	83 Å²	83	142 Å²	142	54%	0.539	75%	0.754	S	S	.	*				-133.1	-178.2	97.7	8.9	16.2	0	0	0	110.9
71	W	29.5	Very low	28.8	Very low	227 Å²	227	144.6 Å²	144.6	86%	0.86	76%	0.758	S	S	*	*			cis	-157.8	146.5	21	-1.8	62.4	0	0	0	108.3
72	E	26.2	Very low	28.9	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.864	75%	0.754	S	S	*	*			trans	-96	173.4	168.1	-77.6	175.6	118.6	0	0	111.8
73	S	25.9	Very low	28.8	Very low	112 Å²	112	146.3 Å²	146.3	78%	0.783	76%	0.759	S	S	*	*			trans	95.2	146.8	147.3	82.4	0	0	0	0	120.2
74	S	29.5	Very low	28.7	Very low	108 Å²	108	148.5 Å²	148.5	76%	0.755	76%	0.761	S	S	*	*			trans	84.5	126.5	176.1	75.7	0	0	0	0	117.6
75	N	29.2	Very low	28.8	Very low	138 Å²	138	147.6 Å²	147.6	74%	0.738	76%	0.764	S	S	*	*			cis	172.6	138.4	-27	-113.5	-14.2	0	0	0	105.1
76	I	28.8	Very low	28.6	Very low	146 Å²	146	143.8 Å²	143.8	75%	0.749	74%	0.743	S	S	*	*			trans	67.9	131.8	153.7	-54.7	161.3	0	0	0	113.9
77	D	28.5	Very low	28.9	Very low	140 Å²	140	144.9 Å²	144.9	75%	0.749	75%	0.747	S	S	*	*			cis	-150.3	177.6	27.5	-140	-34.8	0	0	0	113.7
78	T	26.9	Very low	28.9	Very low	134 Å²	134	139.5 Å²	139.5	82%	0.822	73%	0.732	S	S	*	*			trans	-73	149.2	-172.4	58.7	0	0	0	0	116.5
79	G	25.8	Very low	28.8	Very low	71 Å²	71	139.2 Å²	139.2	73%	0.732	73%	0.729	S	S	*	*			trans	158	121.6	160.3	0	0	0	0	0	119.1
80	H	29	Very low	28.8	Very low	191 Å²	191	135.4 Å²	135.4	88%	0.884	71%	0.714	S	S	*	*			trans	65.2	100.9	158.8	-85.7	-73.3	0	0	0	121.9
81	Y	24.4	Very low	28.7	Very low	221 Å²	221	137.5 Å²	137.5	87%	0.867	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-67.3	132.1	159.4	-69.9	-91.9	0	0	0	113.1
82	P	33.8	Very low	28.5	Very low	112 Å²	112	130.5 Å²	130.5	73%	0.727	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-86.1	131	163.7	31.9	-29.6	0	0	0	111.4	H84	P82-H84 PolarHBondContact O-N 2.77Å
83	Y	30	Very low	28.4	Very low	217 Å²	217	125.1 Å²	125.1	85%	0.851	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-60	119.6	179.9	-80.2	-95.5	0	0	0	112.7	C85	Y83-C85 PolarHBondContact O-N 3.31Å
84	H	28.3	Very low	28.5	Very low	165 Å²	165	127.1 Å²	127.1	76%	0.764	69%	0.69	S	S	*	*			trans	-70.3	113.1	169.1	-109.1	-100.6	0	0	0	110.8	P82 D86	P82-H84 PolarHBondContact O-N 2.77Å; H84-D86 PolarHBondContact O-N 3.06Å
85	C	30.7	Very low	28.4	Very low	115 Å²	115	126 Å²	126	78%	0.777	68%	0.682	S	S	*	*			trans	-86.2	105.2	173.8	-79.9	0	0	0	0	111.3	Y83	Y83-C85 PolarHBondContact O-N 3.31Å
86	D	29.2	Very low	28.4	Very low	54 Å²	54	126.3 Å²	126.3	29%	0.289	68%	0.684	S	S	.	*			trans	-69.2	146.3	167	-89.4	-33.7	0	0	0	112.7	V39 M41 H84 D88 K174	V39-D86 HydrophobicContact CG1-CB 4.44Å; M41-D86 WeakPolarHBondContact CE-OD1 3.47Å; H84-D86 PolarHBondContact O-N 3.06Å; D86-D88 PolarHBondContact O-N 2.72Å; D86-K174 IonicContact OD2-NZ 3.19Å; D86-K174 PolarHBondContact OD2-NZ 3.3Å
87	T	31.4	Very low	28.2	Very low	96 Å²	96	127 Å²	127	59%	0.589	68%	0.678	S	S	*	*			trans	-48.4	115.8	-179.6	48.8	0	0	0	0	115.9
88	D	30.5	Very low	28.3	Very low	82 Å²	82	127.2 Å²	127.2	44%	0.439	68%	0.678	S	S	.	*			trans	-142.8	95	145	-97.4	-37.6	0	0	0	106	D86 E90 R172 R237	D86-D88 PolarHBondContact O-N 2.72Å; D88-E90 VanDerWaalsContact C-N 3.27Å; D88-E90 PolarHBondContact O-N 3.05Å; D88-R172 IonicContact OD2-CZ 3.79Å; D88-R172 IonicContact OD2-NH1 3.46Å; D88-R172 PolarHBondContact OD2-NH1 2.86Å; D88-R172 IonicContact OD2-NH2 3.92Å; D88-R172 PolarHBondContact OD2-NH2 3.25Å; D88-R237 IonicContact OD1-NH1 2.81Å; D88-R237 IonicContact OD2-CZ 3.54Å; D88-R237 VanDerWaalsContact OD2-CZ 3.31Å; D88-R237 IonicContact OD2-NH1 3.03Å; D88-R237 PolarHBondContact OD2-NH1 2.92Å; D88-R237 IonicContact OD2-NH2 3.63Å; D88-R237 PolarHBondContact OD2-NH2 2.92Å
89	L	30.5	Very low	28.4	Very low	131 Å²	131	126.1 Å²	126.1	69%	0.686	67%	0.667	S	S	*	*			trans	-84.5	60.8	-163.1	-142.2	152.7	0	0	0	112.8	V91 I463	L89-V91 HydrophobicContact CD2-CG2 4.03Å; L89-I463 HydrophobicContact CD2-CD1 4.09Å
90	E	28.4	Very low	28.4	Very low	115 Å²	115	129 Å²	129	54%	0.537	67%	0.67	S	S	.	*			trans	-71.9	122.3	155.4	-80.1	-171.8	156.6	0	0	108.3	D88 C92 S238	D88-E90 VanDerWaalsContact C-N 3.27Å; D88-E90 PolarHBondContact O-N 3.05Å; E90-C92 VanDerWaalsContact C-N 3.27Å; E90-C92 PolarHBondContact O-N 2.79Å; E90-S238 VanDerWaalsContact OE1-CB 3.24Å; E90-S238 WeakPolarHBondContact OE1-CB 3.46Å
91	V	26.5	Very low	28.3	Very low	127 Å²	127	129.3 Å²	129.3	77%	0.77	67%	0.665	S	S	*	*			trans	-71.7	82.1	-179.3	-177.8	0	0	0	0	110.2	L89	L89-V91 HydrophobicContact CD2-CG2 4.03Å
92	C	24.3	Very low	28.5	Very low	81 Å²	81	125.4 Å²	125.4	55%	0.547	66%	0.659	S	S	.	*			trans	-115.5	104	163.2	-161.8	0	0	0	0	107.8	E90 Q94 R140	E90-C92 VanDerWaalsContact C-N 3.27Å; E90-C92 PolarHBondContact O-N 2.79Å; C92-Q94 VanDerWaalsContact C-N 3.33Å; C92-Q94 PolarHBondContact O-N 3.45Å; C92-R140 PolarHBondContact SG-NH1 3.49Å
93	S	25.9	Very low	28.2	Very low	72 Å²	72	127.3 Å²	127.3	50%	0.503	66%	0.663	S	S	.	*			trans	-56.6	77.9	-169.4	45.9	0	0	0	0	114.7	S95 R140	S93-S95 VanDerWaalsContact C-N 3.34Å; S93-S95 PolarHBondContact O-N 2.8Å; S93-S95 VanDerWaalsContact O-N 3.07Å; S93-R140 VanDerWaalsContact O-CZ 3.28Å; S93-R140 PolarHBondContact O-NE 2.94Å; S93-R140 PolarHBondContact O-NH2 2.91Å; S93-R140 PolarHBondContact OG-NE 3Å
94	Q	27.8	Very low	28.3	Very low	154 Å²	154	124.7 Å²	124.7	72%	0.72	66%	0.664	S	S	*	*			trans	-76.6	90	168.1	-78.6	-179.9	-34.9	0	0	108.3	C92 N96	C92-Q94 VanDerWaalsContact C-N 3.33Å; C92-Q94 PolarHBondContact O-N 3.45Å; Q94-N96 PolarHBondContact O-N 3.23Å
95	S	27.6	Very low	28.4	Very low	83 Å²	83	123.3 Å²	123.3	58%	0.58	66%	0.662	S	S	*	*			trans	-64	116.3	159.9	172.6	0	0	0	0	107.4	S93 Y97	S93-S95 VanDerWaalsContact C-N 3.34Å; S93-S95 PolarHBondContact O-N 2.8Å; S93-S95 VanDerWaalsContact O-N 3.07Å; S95-Y97 PolarHBondContact O-N 2.85Å
96	N	27.7	Very low	28.6	Very low	146 Å²	146	124.6 Å²	124.6	78%	0.781	66%	0.661	S	S	*	*			trans	-65.5	111.7	166.9	-77.8	-14.3	0	0	0	107.8	Q94	Q94-N96 PolarHBondContact O-N 3.23Å
97	Y	25.7	Very low	28.8	Very low	161 Å²	161	128.4 Å²	128.4	63%	0.631	68%	0.682	S	S	*	*			trans	-91.4	107.6	164.3	-155.7	-117.3	0	0	0	105.7	S95 D99	S95-Y97 PolarHBondContact O-N 2.85Å; Y97-D99 WeakPolarHBondContact CD1-OD2 3.31Å; Y97-D99 WeakPolarHBondContact CE1-OD1 3.39Å
98	I	29.7	Very low	28.9	Very low	143 Å²	143	130.1 Å²	130.1	73%	0.733	69%	0.687	S	S	*	*			trans	-93.8	103.1	165.4	-65.1	178.7	0	0	0	104.9	V100	I98-V100 PolarHBondContact O-N 2.86Å
99	D	28.5	Very low	29	Very low	111 Å²	111	132.5 Å²	132.5	59%	0.594	70%	0.7	S	S	*	*			trans	-64.5	109.8	170.8	-81.4	-67.7	0	0	0	109.1	Y97 Y101	Y97-D99 WeakPolarHBondContact CD1-OD2 3.31Å; Y97-D99 WeakPolarHBondContact CE1-OD1 3.39Å; D99-Y101 PolarHBondContact O-N 3.05Å
100	V	27.2	Very low	29.1	Very low	133 Å²	133	133 Å²	133	81%	0.806	70%	0.703	S	S	*	*			trans	-90.7	92.3	165.4	179.9	0	0	0	0	107	I98	I98-V100 PolarHBondContact O-N 2.86Å
101	Y	27.2	Very low	29.1	Very low	197 Å²	197	134.1 Å²	134.1	77%	0.773	71%	0.713	S	S	*	*			trans	-136.1	122.5	171	-118.8	-84.3	0	0	0	111.1	D99	D99-Y101 PolarHBondContact O-N 3.05Å
102	N	27.2	Very low	29.2	Very low	139 Å²	139	132.9 Å²	132.9	74%	0.743	71%	0.709	S	S	*	*			trans	37.7	111.7	166.6	-80.1	-2.4	0	0	0	119.2
103	N	28.3	Very low	29.5	Very low	151 Å²	151	135.9 Å²	135.9	81%	0.807	72%	0.719	S	S	*	*				-142.6	90.1	124	-149.9	5.9	0	0	0	110.6
104	N	31.5	Very low	29.6	Very low	162 Å²	162	142.9 Å²	142.9	87%	0.866	74%	0.736	S	S	*	*			trans	-139.5	55.3	171.2	-114.2	8.7	0	0	0	108.7
105	N	31.1	Very low	29.8	Very low	136 Å²	136	145 Å²	145	73%	0.727	74%	0.743	S	S	*	*			trans	-97.3	109.7	163	-89.6	-4.9	0	0	0	108.1
106	N	34.3	Very low	30.1	Very low	143 Å²	143	150 Å²	150	77%	0.765	75%	0.754	S	S	*	*				-179.7	139.1	128	-89.9	-16.2	0	0	0	111
107	N	33.7	Very low	30.1	Very low	134 Å²	134	150.6 Å²	150.6	72%	0.717	75%	0.754	S	S	*	*			trans	64.4	113.3	155.2	-55.3	-5.6	0	0	0	116.4
108	N	33.1	Very low	30.7	Very low	132 Å²	132	148.1 Å²	148.1	71%	0.706	76%	0.758	S	S	*	*			cis	-171.6	139.2	31.6	-90.8	-25.2	0	0	0	111.7
109	N	32.1	Very low	30.7	Very low	131 Å²	131	148.6 Å²	148.6	70%	0.701	76%	0.757	S	S	*	*			trans	48.9	111.3	130.4	-62.4	-0.9	0	0	0	122
110	N	32.5	Very low	31	Very low	142 Å²	142	149.6 Å²	149.6	76%	0.759	76%	0.762	S	S	*	*				133	119.5	118.5	-71.1	-16	0	0	0	117.8
111	N	29.8	Very low	31.3	Very low	139 Å²	139	150 Å²	150	74%	0.743	76%	0.76	S	S	*	*			trans	49.9	115.7	140.2	-73.2	13	0	0	0	120.9
112	C	27.1	Very low	31.5	Very low	100 Å²	100	145.3 Å²	145.3	68%	0.676	76%	0.756	S	S	*	*				101.9	149.6	94.4	-78	0	0	0	0	111
113	D	32.4	Very low	31.7	Very low	144 Å²	144	144.7 Å²	144.7	77%	0.77	76%	0.757	S	S	*	*			cis	-156.7	172.7	-8.2	-128.3	-51.9	0	0	0	111.4
114	Y	26.5	Very low	31.8	Very low	220 Å²	220	146 Å²	146	86%	0.863	76%	0.759	S	S	*	*			trans	-92.5	147.6	-176.5	-83.2	-103.7	0	0	0	115.7
115	K	33	Very low	31.8	Very low	198 Å²	198	147.3 Å²	147.3	86%	0.861	76%	0.757	S	S	*	*			trans	-171.1	112.7	150.4	-104.6	156.6	-176.7	177.1	0	111.5
116	K	32.5	Very low	31.7	Very low	189 Å²	189	150.3 Å²	150.3	82%	0.822	76%	0.758	S	S	*	*				62.4	103.1	96.2	-81.8	-173.7	172.8	-178.2	0	115.4
117	M	29.7	Very low	31.8	Very low	157 Å²	157	152.1 Å²	152.1	77%	0.773	76%	0.762	S	S	*	*				83.6	162.6	94	-98.3	-173.8	157.4	0	0	114.1
118	P	36.5	Very low	31.6	Very low	110 Å²	110	153.3 Å²	153.3	71%	0.714	76%	0.76	S	S	*	*			cis	-140.3	170.7	12.9	30.6	-5.8	0	0	0	119.8
119	H	31.2	Very low	31.6	Very low	152 Å²	152	154.8 Å²	154.8	70%	0.704	77%	0.767	S	S	*	*			trans	28.3	129.9	144.9	-67.5	-86.6	0	0	0	124.9
120	N	34	Very low	31.7	Very low	133 Å²	133	153 Å²	153	71%	0.711	77%	0.772	S	S	*	*				-172.5	142.6	99.9	-105.6	-12.9	0	0	0	115.3
121	N	32.8	Very low	32	Very low	140 Å²	140	151.4 Å²	151.4	75%	0.749	77%	0.768	S	S	*	*			trans	46.3	139.3	146.6	-54.9	-14.5	0	0	0	121.4
122	S	32.6	Very low	32.3	Very low	99 Å²	99	150 Å²	150	69%	0.692	77%	0.767	S	S	*	*			cis	-164.7	151.6	-0.3	44.4	0	0	0	0	112.3
123	T	30.3	Very low	32.9	Very low	127 Å²	127	151.3 Å²	151.3	78%	0.779	77%	0.774	S	S	*	*			trans	49.3	100.9	150.7	54.3	0	0	0	0	120.8
124	E	32	Very low	33.1	Very low	178 Å²	178	153 Å²	153	83%	0.832	78%	0.777	S	S	*	*				-161.1	141.5	108.3	-106.7	-157	124.1	0	0	113.9
125	F	30	Very low	33.4	Very low	190 Å²	190	148.8 Å²	148.8	83%	0.833	77%	0.766	S	S	*	*			trans	34.9	111.5	164.1	-85.6	-91.4	0	0	0	123.7
126	R	29.7	Very low	33.1	Very low	199 Å²	199	144.2 Å²	144.2	75%	0.751	76%	0.758	S	S	*	*			trans	-69.5	144	160.8	-67	176.8	172.7	179.2	-2	112.2	F128	R126-F128 HydrophobicContact CB-CD2 4.22Å; R126-F128 HydrophobicContact CG-CD2 4.42Å; R126-F128 HydrophobicContact CG-CE2 4.28Å
127	H	35.5	Very low	33.3	Very low	181 Å²	181	140.5 Å²	140.5	84%	0.838	75%	0.751	S	S	*	*				-177.1	88.6	120.1	-106.9	-82.9	0	0	0	109.2
128	F	29.8	Very low	33.7	Very low	158 Å²	158	139.2 Å²	139.2	69%	0.693	74%	0.743	S	S	*	*				53.6	88.8	95.2	-85.2	-90.4	0	0	0	115.8	R126	R126-F128 HydrophobicContact CB-CD2 4.22Å; R126-F128 HydrophobicContact CG-CD2 4.42Å; R126-F128 HydrophobicContact CG-CE2 4.28Å
129	L	33.4	Very low	33.3	Very low	163 Å²	163	144.6 Å²	144.6	85%	0.853	75%	0.749	S	S	*	*				168.5	128	109.8	-87.1	165.1	0	0	0	109.7
130	A	34.3	Very low	33.7	Very low	95 Å²	95	140.8 Å²	140.8	79%	0.785	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-73.5	133	179.8	0	0	0	0	0	111.2
131	P	38.3	Very low	34.1	Very low	107 Å²	107	139.5 Å²	139.5	70%	0.695	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-72.7	147.2	175.1	30	-33.9	0	0	0	111.3
132	P	36.9	Very low	35	Very low	110 Å²	110	133.9 Å²	133.9	71%	0.714	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-63.3	160	176.2	27.5	-35	0	0	0	112	Q134	P132-Q134 PolarHBondContact O-N 3.47Å
133	P	39.6	Very low	35.8	Very low	128 Å²	128	134.9 Å²	134.9	83%	0.831	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-58.2	128.6	-170.4	22.6	-34.2	0	0	0	112.4	E135	P133-E135 PolarHBondContact O-N 3.08Å
134	Q	37.1	Very low	36.4	Very low	178 Å²	178	135.1 Å²	135.1	83%	0.832	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-66.4	118.2	-173.5	-69	-177.6	-9.1	0	0	111.9	P132 C136	P132-Q134 PolarHBondContact O-N 3.47Å; Q134-C136 PolarHBondContact O-N 2.76Å
135	E	32.3	Very low	37	Very low	132 Å²	132	129.2 Å²	129.2	62%	0.617	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-57.3	136.3	166.3	-71.2	-172.5	115.8	0	0	110.8	P133 T137 R154	P133-E135 PolarHBondContact O-N 3.08Å; E135-T137 PolarHBondContact O-N 3.42Å; E135-R154 IonicContact OE1-CZ 3.32Å; E135-R154 IonicContact OE1-NE 3.66Å; E135-R154 IonicContact OE1-NH1 3.61Å; E135-R154 PolarHBondContact OE1-NH1 3.45Å
136	C	27.3	Very low	37.6	Very low	103 Å²	103	127.9 Å²	127.9	70%	0.696	67%	0.667	S	S	*	*			trans	-59.2	103.7	-179.4	-178.8	0	0	0	0	112.1	Q134 Q138	Q134-C136 PolarHBondContact O-N 2.76Å; C136-Q138 PolarHBondContact O-N 2.76Å
137	T	36.4	Very low	38	Very low	110 Å²	110	122.8 Å²	122.8	68%	0.675	66%	0.658	S	S	*	*			trans	-90.6	102.8	-179.5	40.3	0	0	0	0	111	E135 R139	E135-T137 PolarHBondContact O-N 3.42Å; T137-R139 PolarHBondContact O-N 3.33Å
138	Q	37	Very low	38.4	Very low	131 Å²	131	117.3 Å²	117.3	61%	0.612	64%	0.635	S	S	*	*			trans	-68.7	101.9	-179	-164.2	172.2	28	0	0	111.2	C136 R140	C136-Q138 PolarHBondContact O-N 2.76Å; Q138-R140 PolarHBondContact O-N 3.38Å
139	R	29.1	Very low	38.8	Very low	223 Å²	223	115.6 Å²	115.6	84%	0.842	64%	0.637	S	S	*	*			trans	-69	111.3	-179.4	-62.9	-177.9	-176.5	-174.7	1.4	111	T137	T137-R139 PolarHBondContact O-N 3.33Å
140	R	38.9	Very low	39.6	Very low	72 Å²	72	111.9 Å²	111.9	27%	0.272	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.3	127.1	162.9	-81.7	179.6	167.6	170.4	-6.2	109.9	C92 S93 Q138 I148	C92-R140 PolarHBondContact SG-NH1 3.49Å; S93-R140 VanDerWaalsContact O-CZ 3.28Å; S93-R140 PolarHBondContact O-NE 2.94Å; S93-R140 PolarHBondContact O-NH2 2.91Å; S93-R140 PolarHBondContact OG-NE 3Å; Q138-R140 PolarHBondContact O-N 3.38Å; R140-I148 PolarHBondContact O-N 3.33Å
141	T	42	Very low	39.9	Very low	105 Å²	105	119 Å²	119	64%	0.644	62%	0.624	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.1	142.1	171.1	46.2	0	0	0	0	110.3
142	S	52.5	Low	40.8	Very low	22 Å²	22	117 Å²	117	15%	0.154	61%	0.607	C	S	.	*			trans	-63.8	165.7	167.7	63.6	0	0	0	0	111.3	H144 G145 K146	S142-H144 PolarHBondContact O-N 3.46Å; S142-H144 PolarHBondContact OG-N 3.23Å; S142-H144 VanDerWaalsContact OG-N 3.15Å; S142-G145 PolarHBondContact O-N 2.98Å; S142-G145 PolarHBondContact OG-N 3.11Å; S142-K146 VanDerWaalsContact CB-O 3.23Å; S142-K146 WeakPolarHBondContact CB-O 3.26Å; S142-K146 PolarHBondContact N-O 3.25Å; S142-K146 PolarHBondContact OG-N 2.94Å; S142-K146 PolarHBondContact OG-O 3.42Å
143	L	49.3	Very low	41.9	Very low	121 Å²	121	114.9 Å²	114.9	63%	0.634	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-20.3	165.5	-161.1	73	0	0	0	113.2	Y470	L143-Y470 HydrophobicContact CD1-CE1 4.45Å; L143-Y470 HydrophobicContact CD2-CE1 3.79Å; L143-Y470 HydrophobicContact CG-CE1 3.85Å
144	H	43.2	Very low	43.3	Very low	132 Å²	132	116.8 Å²	116.8	61%	0.611	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	14.2	178.1	-67.3	88.9	0	0	0	113.4	S142 K146	S142-H144 PolarHBondContact O-N 3.46Å; S142-H144 PolarHBondContact OG-N 3.23Å; S142-H144 VanDerWaalsContact OG-N 3.15Å; H144-K146 PolarHBondContact O-N 3.38Å
145	G	44.3	Very low	45.3	Very low	54 Å²	54	113.6 Å²	113.6	56%	0.557	57%	0.573	S	S	*	*	S	Bend	trans	72.3	-17.9	-178.9	0	0	0	0	0	115.6	S142 T147	S142-G145 PolarHBondContact O-N 2.98Å; S142-G145 PolarHBondContact OG-N 3.11Å; G145-T147 PolarHBondContact O-N 3.24Å
146	K	43.2	Very low	47.6	Very low	161 Å²	161	110.3 Å²	110.3	70%	0.7	56%	0.558	S	S	*	*			trans	-58.6	130.9	171.1	-60.4	-176.3	177.9	-176.4	0	110.2	S142 H144 I148	S142-K146 VanDerWaalsContact CB-O 3.23Å; S142-K146 WeakPolarHBondContact CB-O 3.26Å; S142-K146 PolarHBondContact N-O 3.25Å; S142-K146 PolarHBondContact OG-N 2.94Å; S142-K146 PolarHBondContact OG-O 3.42Å; H144-K146 PolarHBondContact O-N 3.38Å; K146-I148 PolarHBondContact O-N 3.47Å; K146-I148 VanDerWaalsContact O-N 3.17Å
147	T	38.4	Very low	50.1	Low	93 Å²	93	108 Å²	108	57%	0.571	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	112	170.5	-53.4	0	0	0	0	109	G145 T149	G145-T147 PolarHBondContact O-N 3.24Å; T147-T149 HydrophobicContact CG2-CG2 4.44Å; T147-T149 PolarHBondContact O-N 2.97Å
148	I	43.5	Very low	52.4	Low	66 Å²	66	111.4 Å²	111.4	34%	0.338	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	107.8	168.6	-43.6	-178.7	0	0	0	106.6	F10 R140 K146 I150	F10-I148 HydrophobicContact CE2-CD1 4.14Å; F10-I148 HydrophobicContact CZ-CD1 4.18Å; R140-I148 PolarHBondContact O-N 3.33Å; K146-I148 PolarHBondContact O-N 3.47Å; K146-I148 VanDerWaalsContact O-N 3.17Å; I148-I150 HydrophobicContact CB-CG1 3.86Å; I148-I150 HydrophobicContact CG2-CD1 4.26Å; I148-I150 HydrophobicContact CG2-CG1 3.38Å; I148-I150 PolarHBondContact O-N 3.48Å
149	T	38.8	Very low	54.8	Low	122 Å²	122	109.8 Å²	109.8	75%	0.748	53%	0.53	S	S	*	.			trans	-71.7	65.1	166.1	44.7	0	0	0	0	109.7	T147 R151	T147-T149 HydrophobicContact CG2-CG2 4.44Å; T147-T149 PolarHBondContact O-N 2.97Å; T149-R151 VanDerWaalsContact C-N 3.3Å; T149-R151 PolarHBondContact O-N 3.4Å
150	I	48.6	Very low	57.6	Low	84 Å²	84	103 Å²	103	43%	0.431	51%	0.505	S	S	.	.			trans	-68.2	96.9	169.1	-39.7	176	0	0	0	106.4	F10 I148 I152	F10-I150 HydrophobicContact CE2-CD1 4.26Å; I148-I150 HydrophobicContact CB-CG1 3.86Å; I148-I150 HydrophobicContact CG2-CD1 4.26Å; I148-I150 HydrophobicContact CG2-CG1 3.38Å; I148-I150 PolarHBondContact O-N 3.48Å; I150-I152 HydrophobicContact CB-CD1 4.5Å; I150-I152 HydrophobicContact CB-CG1 3.92Å; I150-I152 HydrophobicContact CG2-CD1 4.12Å; I150-I152 HydrophobicContact CG2-CG1 3.33Å; I150-I152 PolarHBondContact O-N 3.03Å
151	R	42.2	Very low	60	Low	246 Å²	246	106.8 Å²	106.8	93%	0.928	52%	0.523	S	S	*	.			trans	-68.7	68.5	162.4	-74.7	-169.6	178.5	-170.1	1.2	108.4	T149 S153	T149-R151 VanDerWaalsContact C-N 3.3Å; T149-R151 PolarHBondContact O-N 3.4Å; R151-S153 PolarHBondContact O-N 3.43Å; R151-S153 VanDerWaalsContact O-N 3.09Å
152	I	55.7	Low	62.3	Low	65 Å²	65	106 Å²	106	33%	0.333	52%	0.515	S	S	.	.			trans	-63.4	111.5	165.3	-54.1	-178.7	0	0	0	104.9	I150 R154 E156 T157	I150-I152 HydrophobicContact CB-CD1 4.5Å; I150-I152 HydrophobicContact CB-CG1 3.92Å; I150-I152 HydrophobicContact CG2-CD1 4.12Å; I150-I152 HydrophobicContact CG2-CG1 3.33Å; I150-I152 PolarHBondContact O-N 3.03Å; I152-R154 PolarHBondContact O-N 3.21Å; I152-E156 HydrophobicContact CG2-CB 3.91Å; I152-E156 HydrophobicContact CG2-CG 4.33Å; I152-T157 VanDerWaalsContact CG2-OG1 3.28Å; I152-T157 WeakPolarHBondContact CG2-OG1 3.17Å
153	S	61.6	Low	64.1	Low	65 Å²	65	105.3 Å²	105.3	46%	0.455	51%	0.509	S	S	.	.			trans	-54.1	140.6	175.9	174.7	0	0	0	0	109.2	R151 N155 E156 T157	R151-S153 PolarHBondContact O-N 3.43Å; R151-S153 VanDerWaalsContact O-N 3.09Å; S153-N155 PolarHBondContact O-N 3.24Å; S153-N155 PolarHBondContact OG-N 2.81Å; S153-E156 PolarHBondContact O-N 3.42Å; S153-T157 PolarHBondContact O-N 2.72Å
154	R	68.5	Low	66.1	Low	167 Å²	167	101.1 Å²	101.1	63%	0.63	49%	0.492	S	S	*	.	H	α-helix	trans	-52.8	-30.6	177.2	-60.7	178.7	103.7	165.4	-2	110.4	E135 I152 R158	E135-R154 IonicContact OE1-CZ 3.32Å; E135-R154 IonicContact OE1-NE 3.66Å; E135-R154 IonicContact OE1-NH1 3.61Å; E135-R154 PolarHBondContact OE1-NH1 3.45Å; I152-R154 PolarHBondContact O-N 3.21Å; R154-R158 WeakPolarHBondContact O-CG 3.43Å; R154-R158 PolarHBondContact O-N 3.32Å; R154-R158 VanDerWaalsContact O-N 3.09Å
155	N	78.8	Confident	68.4	Low	111 Å²	111	102 Å²	102	59%	0.594	49%	0.494	S	S	*	.	H	α-helix	trans	-68.3	-39.5	174.4	-66.3	-5.2	0	0	0	113.8	S153 R158 Y159	S153-N155 PolarHBondContact O-N 3.24Å; S153-N155 PolarHBondContact OG-N 2.81Å; N155-R158 PolarHBondContact O-N 2.87Å; N155-Y159 VanDerWaalsContact O-CB 3.31Å; N155-Y159 WeakPolarHBondContact O-CB 3.43Å; N155-Y159 PolarHBondContact O-N 2.98Å
156	E	79.9	Confident	70.7	Confident	64 Å²	64	101.6 Å²	101.6	30%	0.299	48%	0.478	S	S	.	.	H	α-helix	trans	-68	-37.7	177.3	-167.2	-165.7	159.7	0	0	111.2	I152 S153 Y159 R160	I152-E156 HydrophobicContact CG2-CB 3.91Å; I152-E156 HydrophobicContact CG2-CG 4.33Å; S153-E156 PolarHBondContact O-N 3.42Å; E156-Y159 PolarHBondContact O-N 3.15Å; E156-R160 WeakPolarHBondContact O-CG 3.4Å; E156-R160 PolarHBondContact O-N 3.47Å; E156-R160 IonicContact OE1-CZ 3.29Å; E156-R160 IonicContact OE1-NE 3.71Å; E156-R160 PolarHBondContact OE1-NE 3.08Å; E156-R160 IonicContact OE1-NH2 2.68Å; E156-R160 PolarHBondContact OE1-NH2 3.06Å
157	T	80.5	Confident	73	Confident	54 Å²	54	94.7 Å²	94.7	33%	0.331	45%	0.448	S	S	.	.	H	α-helix	trans	-64.8	-43	173.9	-60.9	0	0	0	0	111.3	I152 S153 R160 K161	I152-T157 VanDerWaalsContact CG2-OG1 3.28Å; I152-T157 WeakPolarHBondContact CG2-OG1 3.17Å; S153-T157 PolarHBondContact O-N 2.72Å; T157-R160 PolarHBondContact O-N 2.85Å; T157-K161 HydrophobicContact CG2-CD 4.36Å; T157-K161 WeakPolarHBondContact O-CB 3.4Å; T157-K161 WeakPolarHBondContact O-CG 3.43Å; T157-K161 PolarHBondContact O-N 2.91Å
158	R	84.8	Confident	75.4	Confident	181 Å²	181	93.9 Å²	93.9	68%	0.683	44%	0.44	S	S	*	.	H	α-helix	trans	-61.5	-45.9	173.7	-74.8	175.8	175.7	-173.5	-1.9	111.6	R154 N155 K161 L162	R154-R158 WeakPolarHBondContact O-CG 3.43Å; R154-R158 PolarHBondContact O-N 3.32Å; R154-R158 VanDerWaalsContact O-N 3.09Å; N155-R158 PolarHBondContact O-N 2.87Å; R158-K161 PolarHBondContact O-N 3.35Å; R158-L162 WeakPolarHBondContact O-CB 3.46Å; R158-L162 PolarHBondContact O-N 3.46Å
159	Y	88	Confident	77.8	Confident	97 Å²	97	94.1 Å²	94.1	38%	0.38	44%	0.439	S	S	.	.	H	α-helix	trans	-56	-51.7	175.5	173.9	-85.3	0	0	0	111.7	N155 E156 K161 L162 Q163 W232	N155-Y159 VanDerWaalsContact O-CB 3.31Å; N155-Y159 WeakPolarHBondContact O-CB 3.43Å; N155-Y159 PolarHBondContact O-N 2.98Å; E156-Y159 PolarHBondContact O-N 3.15Å; Y159-K161 PolarHBondContact O-N 2.79Å; Y159-L162 PolarHBondContact O-N 3.29Å; Y159-Q163 VanDerWaalsContact O-CB 3.29Å; Y159-Q163 WeakPolarHBondContact O-CB 3.19Å; Y159-Q163 PolarHBondContact O-N 3.03Å; Y159-W232 HydrophobicContact CD2-CZ2 4.24Å; Y159-W232 AromaticContact CE2-CZ2 3.54Å; Y159-W232 HydrophobicContact CE2-CZ2 3.54Å; Y159-W232 AromaticContact CZ-CZ2 3.86Å; Y159-W232 AromaticContact CZ-NE1 3.9Å; Y159-W232 PolarHBondContact OH-NE1 3.36Å; Y159-W232 VanDerWaalsContact OH-NE1 3.09Å
160	R	86.8	Confident	80.2	Confident	82 Å²	82	88.7 Å²	88.7	31%	0.309	41%	0.405	S	S	.	.	H	α-helix	trans	-65.2	-37.1	179.8	-69.6	178.4	-175.6	-83.4	1.4	112.5	E156 T157 A164	E156-R160 WeakPolarHBondContact O-CG 3.4Å; E156-R160 PolarHBondContact O-N 3.47Å; E156-R160 IonicContact OE1-CZ 3.29Å; E156-R160 IonicContact OE1-NE 3.71Å; E156-R160 PolarHBondContact OE1-NE 3.08Å; E156-R160 IonicContact OE1-NH2 2.68Å; E156-R160 PolarHBondContact OE1-NH2 3.06Å; T157-R160 PolarHBondContact O-N 2.85Å; R160-A164 WeakPolarHBondContact O-CB 3.33Å; R160-A164 PolarHBondContact O-N 3.29Å
161	K	88.7	Confident	82	Confident	151 Å²	151	85.6 Å²	85.6	66%	0.657	39%	0.389	S	S	*	.	H	α-helix	trans	-62.9	-44.9	172.7	-77.2	-178.8	176.8	-172.1	0	111.7	T157 R158 Y159 A164 K165	T157-K161 HydrophobicContact CG2-CD 4.36Å; T157-K161 WeakPolarHBondContact O-CB 3.4Å; T157-K161 WeakPolarHBondContact O-CG 3.43Å; T157-K161 PolarHBondContact O-N 2.91Å; R158-K161 PolarHBondContact O-N 3.35Å; Y159-K161 PolarHBondContact O-N 2.79Å; K161-A164 PolarHBondContact O-N 2.78Å; K161-K165 WeakPolarHBondContact O-CB 3.47Å; K161-K165 PolarHBondContact O-N 2.94Å
162	L	90.5	Very high	84	Confident	89 Å²	89	77.4 Å²	77.4	47%	0.466	36%	0.358	S	S	.	.	H	α-helix	trans	-63.8	-45.6	176.4	179.1	61.6	0	0	0	111.4	R158 Y159 A164 K165 I166	R158-L162 WeakPolarHBondContact O-CB 3.46Å; R158-L162 PolarHBondContact O-N 3.46Å; Y159-L162 PolarHBondContact O-N 3.29Å; L162-A164 VanDerWaalsContact C-N 3.32Å; L162-A164 PolarHBondContact O-N 2.96Å; L162-K165 PolarHBondContact O-N 3.09Å; L162-K165 VanDerWaalsContact O-N 3.14Å; L162-I166 HydrophobicContact CD1-CD1 3.77Å; L162-I166 HydrophobicContact CD1-CG1 4.23Å; L162-I166 HydrophobicContact CG-CD1 3.91Å; L162-I166 PolarHBondContact O-N 3.01Å
163	Q	91.6	Very high	85.4	Confident	6 Å²	6	77 Å²	77	3%	0.028	36%	0.359	C	S	.	.	H	α-helix	trans	-57.5	-44.4	176.7	-161.4	-174.3	12	0	0	111.4	Y159 Y167 W232 S233 G235 C236	Y159-Q163 VanDerWaalsContact O-CB 3.29Å; Y159-Q163 WeakPolarHBondContact O-CB 3.19Å; Y159-Q163 PolarHBondContact O-N 3.03Å; Q163-Y167 VanDerWaalsContact O-CB 3.29Å; Q163-Y167 WeakPolarHBondContact O-CB 2.93Å; Q163-Y167 PolarHBondContact O-N 3.48Å; Q163-W232 HydrophobicContact CB-CH2 4.45Å; Q163-W232 HydrophobicContact CG-CZ3 4.46Å; Q163-W232 PolarHBondContact NE2-O 3.18Å; Q163-S233 WeakPolarHBondContact CG-O 3.27Å; Q163-G235 VanDerWaalsContact NE2-CA 3.35Å; Q163-C236 HydrophobicContact CB-CB 4.26Å; Q163-C236 HydrophobicContact CG-CB 3.99Å
164	A	90.9	Very high	86.4	Confident	34 Å²	34	79.7 Å²	79.7	28%	0.281	36%	0.363	S	S	.	.	H	α-helix	trans	-69.7	-35.5	175	0	0	0	0	0	113.4	R160 K161 L162 N168 C236	R160-A164 WeakPolarHBondContact O-CB 3.33Å; R160-A164 PolarHBondContact O-N 3.29Å; K161-A164 PolarHBondContact O-N 2.78Å; L162-A164 VanDerWaalsContact C-N 3.32Å; L162-A164 PolarHBondContact O-N 2.96Å; A164-N168 WeakPolarHBondContact O-CB 3.44Å; A164-N168 PolarHBondContact O-N 2.92Å; A164-N168 PolarHBondContact O-ND2 3.02Å; A164-C236 HydrophobicContact CB-CB 4.17Å
165	K	90.9	Very high	87.4	Confident	151 Å²	151	75.4 Å²	75.4	66%	0.657	36%	0.355	S	S	*	.	H	α-helix	trans	-64.3	-46.6	175.2	-173.3	178.3	179.6	-177.9	0	111	K161 L162 N168 F169	K161-K165 WeakPolarHBondContact O-CB 3.47Å; K161-K165 PolarHBondContact O-N 2.94Å; L162-K165 PolarHBondContact O-N 3.09Å; L162-K165 VanDerWaalsContact O-N 3.14Å; K165-N168 PolarHBondContact O-N 2.79Å; K165-F169 WeakPolarHBondContact O-CB 3.17Å; K165-F169 PolarHBondContact O-N 3.06Å
166	I	92.5	Very high	87.9	Confident	44 Å²	44	80.1 Å²	80.1	23%	0.226	37%	0.365	C	S	.	.	H	α-helix	trans	-67.4	-42.4	176.9	-68.4	167.5	0	0	0	110.6	L162 N168 F169 L170 W232	L162-I166 HydrophobicContact CD1-CD1 3.77Å; L162-I166 HydrophobicContact CD1-CG1 4.23Å; L162-I166 HydrophobicContact CG-CD1 3.91Å; L162-I166 PolarHBondContact O-N 3.01Å; I166-N168 PolarHBondContact O-N 3.22Å; I166-F169 PolarHBondContact O-N 3.28Å; I166-L170 HydrophobicContact CG2-CD1 3.84Å; I166-L170 HydrophobicContact CG2-CG 4.33Å; I166-L170 WeakPolarHBondContact O-CB 3.3Å; I166-L170 PolarHBondContact O-N 3.18Å; I166-W232 HydrophobicContact CD1-CH2 4.45Å; I166-W232 HydrophobicContact CD1-CZ3 3.84Å
167	Y	91.6	Very high	88.6	Confident	17 Å²	17	81.1 Å²	81.1	7%	0.067	38%	0.377	C	S	.	.	H	α-helix	trans	-60.6	-43.6	174.6	-176.7	-97.8	0	0	0	111.6	Q163 E171 A234 C236 R237 F249	Q163-Y167 VanDerWaalsContact O-CB 3.29Å; Q163-Y167 WeakPolarHBondContact O-CB 2.93Å; Q163-Y167 PolarHBondContact O-N 3.48Å; Y167-E171 HydrophobicContact CD1-CB 4.26Å; Y167-E171 HydrophobicContact CD2-CB 4.12Å; Y167-E171 HydrophobicContact CE1-CB 4.03Å; Y167-E171 HydrophobicContact CE1-CG 4.03Å; Y167-E171 HydrophobicContact CE2-CB 3.93Å; Y167-E171 HydrophobicContact CE2-CG 3.89Å; Y167-E171 HydrophobicContact CG-CB 4.32Å; Y167-E171 VanDerWaalsContact O-CA 3.3Å; Y167-E171 WeakPolarHBondContact O-CA 3.4Å; Y167-E171 WeakPolarHBondContact O-CB 3.19Å; Y167-E171 PolarHBondContact O-N 3.29Å; Y167-A234 HydrophobicContact CD2-CB 4.33Å; Y167-A234 HydrophobicContact CE2-CB 4.09Å; Y167-C236 VanDerWaalsContact CB-SG 3.58Å; Y167-C236 VanDerWaalsContact CG-SG 3.59Å; Y167-R237 HydrophobicContact CE1-CG 4.27Å; Y167-F249 HydrophobicContact CE2-CE2 4.31Å
168	N	90	Very high	89.1	Confident	75 Å²	75	78.6 Å²	78.6	40%	0.401	36%	0.361	S	S	.	.	H	α-helix	trans	-67.8	-38.6	176.1	-73.4	-29.1	0	0	0	111.7	A164 K165 I166 R172	A164-N168 WeakPolarHBondContact O-CB 3.44Å; A164-N168 PolarHBondContact O-N 2.92Å; A164-N168 PolarHBondContact O-ND2 3.02Å; K165-N168 PolarHBondContact O-N 2.79Å; I166-N168 PolarHBondContact O-N 3.22Å; N168-R172 CarbonylContact O-C 3.59Å; N168-R172 WeakPolarHBondContact O-CA 3.38Å; N168-R172 PolarHBondContact O-N 3.37Å
169	F	92	Very high	89.3	Confident	71 Å²	71	72.9 Å²	72.9	31%	0.311	35%	0.346	S	S	.	.	H	α-helix	trans	-63	-42.7	175.2	-174.6	-87.5	0	0	0	113.1	K165 I166 P177 S178 Y181	K165-F169 WeakPolarHBondContact O-CB 3.17Å; K165-F169 PolarHBondContact O-N 3.06Å; I166-F169 PolarHBondContact O-N 3.28Å; F169-P177 HydrophobicContact CE2-CB 4.35Å; F169-S178 PolarHBondContact O-OG 3.21Å; F169-Y181 HydrophobicContact CE1-CD1 4Å; F169-Y181 HydrophobicContact CE1-CD2 4.08Å; F169-Y181 AromaticContact CE1-CG 3.71Å; F169-Y181 HydrophobicContact CE1-CG 3.71Å; F169-Y181 HydrophobicContact CZ-CD2 4.38Å; F169-Y181 AromaticContact CZ-CG 3.97Å; F169-Y181 HydrophobicContact CZ-CG 3.97Å
170	L	90.3	Very high	89.6	Confident	8 Å²	8	73.2 Å²	73.2	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-90.9	-16.2	-177.7	-68.9	-179.9	0	0	0	114.6	I166 Y181 E226 L229 R299	I166-L170 HydrophobicContact CG2-CD1 3.84Å; I166-L170 HydrophobicContact CG2-CG 4.33Å; I166-L170 WeakPolarHBondContact O-CB 3.3Å; I166-L170 PolarHBondContact O-N 3.18Å; L170-Y181 HydrophobicContact CD2-CE1 3.9Å; L170-E226 HydrophobicContact CD1-CG 4.35Å; L170-E226 HydrophobicContact CD2-CG 3.94Å; L170-L229 HydrophobicContact CD1-CB 3.8Å; L170-R299 VanDerWaalsContact O-CD 3.32Å; L170-R299 WeakPolarHBondContact O-CD 2.91Å; L170-R299 PolarHBondContact O-NE 2.73Å; L170-R299 PolarHBondContact O-NH2 2.86Å; L170-R299 VanDerWaalsContact O-NH2 3.12Å
171	E	85.9	Confident	89.9	Confident	20 Å²	20	71.5 Å²	71.5	9%	0.093	35%	0.348	C	S	.	.	H	α-helix	trans	-121.5	-16.9	-177	-166.1	45.3	-130.1	0	0	113.5	Y167 R299 R300	Y167-E171 HydrophobicContact CD1-CB 4.26Å; Y167-E171 HydrophobicContact CD2-CB 4.12Å; Y167-E171 HydrophobicContact CE1-CB 4.03Å; Y167-E171 HydrophobicContact CE1-CG 4.03Å; Y167-E171 HydrophobicContact CE2-CB 3.93Å; Y167-E171 HydrophobicContact CE2-CG 3.89Å; Y167-E171 HydrophobicContact CG-CB 4.32Å; Y167-E171 VanDerWaalsContact O-CA 3.3Å; Y167-E171 WeakPolarHBondContact O-CA 3.4Å; Y167-E171 WeakPolarHBondContact O-CB 3.19Å; Y167-E171 PolarHBondContact O-N 3.29Å; E171-R299 VanDerWaalsContact CA-CZ 3.5Å; E171-R299 VanDerWaalsContact CD-NH1 3.34Å; E171-R299 PolarHBondContact O-NH1 2.91Å; E171-R299 IonicContact OE1-NH1 3.76Å; E171-R299 PolarHBondContact OE1-NH1 3.3Å; E171-R299 IonicContact OE2-NH1 2.66Å; E171-R299 PolarHBondContact OE2-NH1 2.56Å; E171-R300 PolarHBondContact O-NE 2.79Å; E171-R300 PolarHBondContact O-NH2 2.77Å; E171-R300 WeakPolarHBondContact OE1-CG 3.37Å; E171-R300 IonicContact OE1-NE 3.62Å
172	R	84.3	Confident	90	Very high	74 Å²	74	66 Å²	66	28%	0.279	32%	0.324	S	S	.	.			trans	-140.9	79.6	-176.1	-52	-151	143.9	171.6	-4.6	113.3	D88 N168 K174 R237 R300	D88-R172 IonicContact OD2-CZ 3.79Å; D88-R172 IonicContact OD2-NH1 3.46Å; D88-R172 PolarHBondContact OD2-NH1 2.86Å; D88-R172 IonicContact OD2-NH2 3.92Å; D88-R172 PolarHBondContact OD2-NH2 3.25Å; N168-R172 CarbonylContact O-C 3.59Å; N168-R172 WeakPolarHBondContact O-CA 3.38Å; N168-R172 PolarHBondContact O-N 3.37Å; R172-K174 VanDerWaalsContact C-N 3.32Å; R172-K174 PolarHBondContact O-N 2.95Å; R172-R237 VanDerWaalsContact NH1-NH2 3.13Å; R172-R300 VanDerWaalsContact CA-NH2 3.28Å
173	P	85.1	Confident	90	Very high	55 Å²	55	66 Å²	66	36%	0.357	33%	0.328	S	S	.	.			trans	-77.6	84.5	-172.1	33.6	-28.8	0	0	0	110.8	S178 V179	P173-S178 VanDerWaalsContact CA-OG 3.26Å; P173-S178 WeakPolarHBondContact CA-OG 3.45Å; P173-S178 VanDerWaalsContact CB-OG 3.29Å; P173-S178 WeakPolarHBondContact CB-OG 3.44Å; P173-V179 HydrophobicContact CB-CG2 4.47Å
174	K	82.7	Confident	90	Very high	123 Å²	123	71.2 Å²	71.2	54%	0.535	35%	0.351	S	S	.	.			trans	-101.8	-10.5	175.8	-73.1	-161.7	167.7	-155.1	0	113.2	V39 D86 R172	V39-K174 PolarHBondContact O-NZ 3.49Å; D86-K174 IonicContact OD2-NZ 3.19Å; D86-K174 PolarHBondContact OD2-NZ 3.3Å; R172-K174 VanDerWaalsContact C-N 3.32Å; R172-K174 PolarHBondContact O-N 2.95Å
175	T	89.4	Confident	90	Very high	76 Å²	76	69.6 Å²	69.6	47%	0.466	34%	0.337	S	S	.	.	S	Bend	trans	-114.5	143.2	-175.1	60.6	0	0	0	0	110.7	S178 V179	T175-S178 WeakPolarHBondContact O-CA 3.13Å; T175-S178 WeakPolarHBondContact O-CB 3.39Å; T175-S178 PolarHBondContact O-N 3.38Å; T175-S178 WeakPolarHBondContact OG1-CB 3.49Å; T175-V179 PolarHBondContact O-N 3.38Å
176	W	90.5	Very high	89.9	Confident	211 Å²	211	66.6 Å²	66.6	80%	0.799	33%	0.325	S	S	*	.	H	α-helix	trans	-48.7	-46.3	179	-77.4	99.5	0	0	0	114	S178 V179 I180	W176-S178 VanDerWaalsContact C-N 3.28Å; W176-S178 PolarHBondContact O-N 3.2Å; W176-V179 PolarHBondContact O-N 2.87Å; W176-I180 VanDerWaalsContact O-CG1 3.28Å; W176-I180 WeakPolarHBondContact O-CG1 3.48Å; W176-I180 PolarHBondContact O-N 3.34Å
177	P	92.8	Very high	89.8	Confident	85 Å²	85	67 Å²	67	55%	0.552	33%	0.334	S	S	*	.	H	α-helix	trans	-62.5	-30.8	176.9	-24.9	35.9	0	0	0	114.5	F169 Y181	F169-P177 HydrophobicContact CE2-CB 4.35Å; P177-Y181 PolarHBondContact O-N 2.98Å; P177-Y181 VanDerWaalsContact O-N 3.08Å
178	S	90.8	Very high	89.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-76.4	-36.6	176.7	173.3	0	0	0	0	111.6	F169 P173 T175 W176 Y181 H182	F169-S178 PolarHBondContact O-OG 3.21Å; P173-S178 VanDerWaalsContact CA-OG 3.26Å; P173-S178 WeakPolarHBondContact CA-OG 3.45Å; P173-S178 VanDerWaalsContact CB-OG 3.29Å; P173-S178 WeakPolarHBondContact CB-OG 3.44Å; T175-S178 WeakPolarHBondContact O-CA 3.13Å; T175-S178 WeakPolarHBondContact O-CB 3.39Å; T175-S178 PolarHBondContact O-N 3.38Å; T175-S178 WeakPolarHBondContact OG1-CB 3.49Å; W176-S178 VanDerWaalsContact C-N 3.28Å; W176-S178 PolarHBondContact O-N 3.2Å; S178-Y181 PolarHBondContact O-N 3.26Å; S178-H182 PolarHBondContact O-CD2 3.41Å; S178-H182 PolarHBondContact O-N 3.07Å; S178-H182 VanDerWaalsContact O-N 3.13Å
179	V	90.4	Very high	89.6	Confident	61 Å²	61	64 Å²	64	37%	0.37	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-48	171.2	177	0	0	0	0	110.2	P173 T175 W176 Y181 H182 V183	P173-V179 HydrophobicContact CB-CG2 4.47Å; T175-V179 PolarHBondContact O-N 3.38Å; W176-V179 PolarHBondContact O-N 2.87Å; V179-Y181 VanDerWaalsContact C-N 3.33Å; V179-Y181 PolarHBondContact O-N 2.8Å; V179-H182 PolarHBondContact O-N 2.93Å; V179-H182 VanDerWaalsContact O-N 3.1Å; V179-V183 HydrophobicContact CG1-CG2 4.26Å; V179-V183 WeakPolarHBondContact O-CG2 3.45Å; V179-V183 PolarHBondContact O-N 2.88Å
180	I	93.1	Very high	89.4	Confident	105 Å²	105	65.5 Å²	65.5	54%	0.538	33%	0.328	S	S	.	.	H	α-helix	trans	-57.7	-43.7	177.2	-67.8	163.5	0	0	0	111.2	W176 H182 V183 F184	W176-I180 VanDerWaalsContact O-CG1 3.28Å; W176-I180 WeakPolarHBondContact O-CG1 3.48Å; W176-I180 PolarHBondContact O-N 3.34Å; I180-H182 PolarHBondContact O-N 3.1Å; I180-V183 PolarHBondContact O-N 3.39Å; I180-F184 WeakPolarHBondContact O-CB 3.28Å; I180-F184 PolarHBondContact O-N 3.48Å
181	Y	93.6	Very high	89.4	Confident	46 Å²	46	66.5 Å²	66.5	18%	0.18	34%	0.34	C	S	.	.	H	α-helix	trans	-57.1	-47.3	173.7	173.4	-91	0	0	0	112.4	F169 L170 P177 S178 V179 F184 V185 W222 E226	F169-Y181 HydrophobicContact CE1-CD1 4Å; F169-Y181 HydrophobicContact CE1-CD2 4.08Å; F169-Y181 AromaticContact CE1-CG 3.71Å; F169-Y181 HydrophobicContact CE1-CG 3.71Å; F169-Y181 HydrophobicContact CZ-CD2 4.38Å; F169-Y181 AromaticContact CZ-CG 3.97Å; F169-Y181 HydrophobicContact CZ-CG 3.97Å; L170-Y181 HydrophobicContact CD2-CE1 3.9Å; P177-Y181 PolarHBondContact O-N 2.98Å; P177-Y181 VanDerWaalsContact O-N 3.08Å; S178-Y181 PolarHBondContact O-N 3.26Å; V179-Y181 VanDerWaalsContact C-N 3.33Å; V179-Y181 PolarHBondContact O-N 2.8Å; Y181-F184 PolarHBondContact O-N 3.22Å; Y181-V185 HydrophobicContact CD1-CG2 4.36Å; Y181-V185 HydrophobicContact CE1-CG2 3.86Å; Y181-V185 HydrophobicContact CE2-CG2 4.22Å; Y181-V185 WeakPolarHBondContact O-CG2 3.16Å; Y181-V185 PolarHBondContact O-N 3.45Å; Y181-W222 HydrophobicContact CD2-CZ2 4.43Å; Y181-W222 AromaticContact CE2-CZ2 3.78Å; Y181-W222 HydrophobicContact CE2-CZ2 3.78Å; Y181-W222 AromaticContact CE2-NE1 3.78Å; Y181-W222 AromaticContact CZ-NE1 3.7Å; Y181-W222 PolarHBondContact OH-NE1 3.32Å; Y181-E226 VanDerWaalsContact OH-CD 3.25Å; Y181-E226 PolarHBondContact OH-OE2 2.99Å
182	H	90.9	Very high	89.4	Confident	35 Å²	35	65.8 Å²	65.8	16%	0.162	34%	0.337	C	S	.	.	H	α-helix	trans	-69.5	-33.7	179.3	-75.5	-56.2	0	0	0	113.2	S178 V179 I180 V185 F186 R299	S178-H182 PolarHBondContact O-CD2 3.41Å; S178-H182 PolarHBondContact O-N 3.07Å; S178-H182 VanDerWaalsContact O-N 3.13Å; V179-H182 PolarHBondContact O-N 2.93Å; V179-H182 VanDerWaalsContact O-N 3.1Å; I180-H182 PolarHBondContact O-N 3.1Å; H182-V185 PolarHBondContact O-N 2.87Å; H182-F186 WeakPolarHBondContact O-CB 3.42Å; H182-F186 PolarHBondContact O-N 2.78Å; H182-R299 PolarHBondContact CE1-NE 3.43Å; H182-R299 PolarHBondContact NE2-NH2 2.96Å
183	V	90.6	Very high	89.5	Confident	90 Å²	90	65.1 Å²	65.1	55%	0.545	34%	0.339	S	S	.	.	H	α-helix	trans	-65.5	-41.7	172.3	171.7	0	0	0	0	111	V179 I180 F186 A187	V179-V183 HydrophobicContact CG1-CG2 4.26Å; V179-V183 WeakPolarHBondContact O-CG2 3.45Å; V179-V183 PolarHBondContact O-N 2.88Å; I180-V183 PolarHBondContact O-N 3.39Å; V183-F186 PolarHBondContact O-N 3.35Å; V183-A187 WeakPolarHBondContact O-CB 3.32Å; V183-A187 PolarHBondContact O-N 2.92Å
184	F	92.4	Very high	89.6	Confident	114 Å²	114	66.1 Å²	66.1	50%	0.5	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-45.8	174.8	-175.1	-83	0	0	0	111.7	I180 Y181 F186 A187 S188 W222	I180-F184 WeakPolarHBondContact O-CB 3.28Å; I180-F184 PolarHBondContact O-N 3.48Å; Y181-F184 PolarHBondContact O-N 3.22Å; F184-F186 VanDerWaalsContact C-N 3.32Å; F184-F186 PolarHBondContact O-N 2.95Å; F184-A187 PolarHBondContact O-N 2.8Å; F184-S188 PolarHBondContact O-N 3.47Å; F184-S188 PolarHBondContact O-OG 3.22Å; F184-W222 AromaticContact CD1-CH2 3.48Å; F184-W222 HydrophobicContact CD1-CH2 3.48Å; F184-W222 VanDerWaalsContact CD1-CH2 3.48Å; F184-W222 HydrophobicContact CD1-CZ2 4.08Å; F184-W222 HydrophobicContact CD1-CZ3 4.19Å; F184-W222 AromaticContact CE1-CH2 3.26Å; F184-W222 HydrophobicContact CE1-CH2 3.26Å; F184-W222 HydrophobicContact CE1-CZ2 4.25Å; F184-W222 AromaticContact CE1-CZ3 3.53Å; F184-W222 HydrophobicContact CE1-CZ3 3.53Å; F184-W222 HydrophobicContact CZ-CH2 4.3Å; F184-W222 HydrophobicContact CZ-CZ3 4.41Å
185	V	90.2	Very high	89.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-36.9	176.2	169.4	0	0	0	0	111.8	Y181 H182 S188 V189 W222 F223 M297	Y181-V185 HydrophobicContact CD1-CG2 4.36Å; Y181-V185 HydrophobicContact CE1-CG2 3.86Å; Y181-V185 HydrophobicContact CE2-CG2 4.22Å; Y181-V185 WeakPolarHBondContact O-CG2 3.16Å; Y181-V185 PolarHBondContact O-N 3.45Å; H182-V185 PolarHBondContact O-N 2.87Å; V185-S188 PolarHBondContact O-OG 3.18Å; V185-S188 VanDerWaalsContact O-OG 3.13Å; V185-V189 VanDerWaalsContact O-CG2 3.31Å; V185-V189 WeakPolarHBondContact O-CG2 3.22Å; V185-V189 PolarHBondContact O-N 3.13Å; V185-W222 HydrophobicContact CG2-CZ2 4.13Å; V185-F223 HydrophobicContact CG1-CE1 3.84Å; V185-F223 HydrophobicContact CG1-CZ 4.04Å; V185-M297 HydrophobicContact CG1-CE 3.73Å; V185-M297 HydrophobicContact CG1-SD 4.12Å
186	F	89.1	Confident	89.6	Confident	89 Å²	89	59.9 Å²	59.9	39%	0.39	31%	0.312	S	S	.	.	H	α-helix	trans	-63.7	-48.6	172.6	174.7	-93.1	0	0	0	111.2	H182 V183 F184 S188 V189 F190 M297	H182-F186 WeakPolarHBondContact O-CB 3.42Å; H182-F186 PolarHBondContact O-N 2.78Å; V183-F186 PolarHBondContact O-N 3.35Å; F184-F186 VanDerWaalsContact C-N 3.32Å; F184-F186 PolarHBondContact O-N 2.95Å; F186-S188 PolarHBondContact O-N 3.17Å; F186-V189 PolarHBondContact O-N 3.38Å; F186-F190 WeakPolarHBondContact O-CB 3.48Å; F186-F190 PolarHBondContact O-N 3.06Å; F186-M297 HydrophobicContact CB-SD 4.12Å; F186-M297 HydrophobicContact CD2-CG 4.04Å; F186-M297 HydrophobicContact CD2-SD 4.47Å
187	A	90.9	Very high	89.4	Confident	52 Å²	52	53.8 Å²	53.8	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-39.2	-179.5	0	0	0	0	0	112.6	V183 F184 F190 G191	V183-A187 WeakPolarHBondContact O-CB 3.32Å; V183-A187 PolarHBondContact O-N 2.92Å; F184-A187 PolarHBondContact O-N 2.8Å; A187-F190 PolarHBondContact O-N 3.48Å; A187-G191 PolarHBondContact O-N 3.45Å
188	S	89.3	Confident	89.2	Confident	19 Å²	19	53 Å²	53	13%	0.133	29%	0.288	C	S	.	.	H	α-helix	trans	-68.8	-38.9	177	65.5	0	0	0	0	112.7	F184 V185 F186 C192	F184-S188 PolarHBondContact O-N 3.47Å; F184-S188 PolarHBondContact O-OG 3.22Å; V185-S188 PolarHBondContact O-OG 3.18Å; V185-S188 VanDerWaalsContact O-OG 3.13Å; F186-S188 PolarHBondContact O-N 3.17Å; S188-C192 PolarHBondContact O-N 3.42Å
189	V	88	Confident	88.9	Confident	11 Å²	11	53.7 Å²	53.7	7%	0.067	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-44.8	172.8	172.3	0	0	0	0	111.3	V185 F186 C192 L193 F223 R293	V185-V189 VanDerWaalsContact O-CG2 3.31Å; V185-V189 WeakPolarHBondContact O-CG2 3.22Å; V185-V189 PolarHBondContact O-N 3.13Å; F186-V189 PolarHBondContact O-N 3.38Å; V189-C192 PolarHBondContact O-N 3.26Å; V189-L193 PolarHBondContact O-N 2.89Å; V189-F223 HydrophobicContact CG2-CE2 3.92Å; V189-F223 HydrophobicContact CG2-CZ 3.46Å; V189-F223 VanDerWaalsContact CG2-CZ 3.46Å; V189-R293 HydrophobicContact CG1-CB 3.71Å; V189-R293 HydrophobicContact CG2-CB 4.31Å
190	F	88	Confident	88.6	Confident	102 Å²	102	55.9 Å²	55.9	45%	0.447	31%	0.307	S	S	.	.	H	α-helix	trans	-65.1	-41.6	179.6	-173.6	-110.9	0	0	0	111.8	F186 A187 C192 L193 I194	F186-F190 WeakPolarHBondContact O-CB 3.48Å; F186-F190 PolarHBondContact O-N 3.06Å; A187-F190 PolarHBondContact O-N 3.48Å; F190-C192 PolarHBondContact O-N 3.22Å; F190-L193 WeakPolarHBondContact O-CB 3.11Å; F190-L193 PolarHBondContact O-N 3.22Å; F190-L193 VanDerWaalsContact O-N 3.15Å; F190-I194 HydrophobicContact CD1-CD1 3.89Å; F190-I194 HydrophobicContact CE1-CD1 3.57Å; F190-I194 HydrophobicContact CE1-CG1 4.44Å; F190-I194 HydrophobicContact CZ-CD1 4.07Å; F190-I194 PolarHBondContact O-N 3.45Å
191	G	89	Confident	88.5	Confident	28 Å²	28	54.4 Å²	54.4	29%	0.289	30%	0.299	S	S	.	.	H	α-helix	trans	-60.3	-41.6	172.7	0	0	0	0	0	112.9	A187 I194 L195	A187-G191 PolarHBondContact O-N 3.45Å; G191-I194 PolarHBondContact O-N 2.91Å; G191-L195 WeakPolarHBondContact O-CG 3.24Å; G191-L195 PolarHBondContact O-N 3.35Å
192	C	86.8	Confident	88.4	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.034	33%	0.33	C	S	.	.	H	α-helix	trans	-66.8	-32.9	173	-78.3	0	0	0	0	113.6	S188 V189 F190 L195 S196 L212 I219	S188-C192 PolarHBondContact O-N 3.42Å; V189-C192 PolarHBondContact O-N 3.26Å; F190-C192 PolarHBondContact O-N 3.22Å; C192-L195 PolarHBondContact O-N 3.25Å; C192-S196 WeakPolarHBondContact O-CB 3.27Å; C192-S196 PolarHBondContact O-N 3.31Å; C192-L212 HydrophobicContact CB-CD1 4.41Å; C192-L212 WeakPolarHBondContact O-CD1 3.41Å; C192-I219 HydrophobicContact CB-CD1 4.38Å; C192-I219 WeakPolarHBondContact SG-CD1 3.4Å
193	L	85.7	Confident	88.3	Confident	61 Å²	61	65.6 Å²	65.6	32%	0.319	36%	0.358	S	S	.	.	H	α-helix	trans	-64.5	-45.1	173	-171.9	154.1	0	0	0	110.6	V189 F190 S196 V197	V189-L193 PolarHBondContact O-N 2.89Å; F190-L193 WeakPolarHBondContact O-CB 3.11Å; F190-L193 PolarHBondContact O-N 3.22Å; F190-L193 VanDerWaalsContact O-N 3.15Å; L193-S196 WeakPolarHBondContact O-CB 3.22Å; L193-S196 PolarHBondContact O-N 3.46Å; L193-V197 HydrophobicContact CD2-CG2 4.42Å; L193-V197 WeakPolarHBondContact O-CG2 3.25Å; L193-V197 PolarHBondContact O-N 3.31Å
194	I	87.8	Confident	88.3	Confident	76 Å²	76	67.6 Å²	67.6	39%	0.39	36%	0.357	S	S	.	.	H	α-helix	trans	-60.1	-49	174.3	-66.7	168.5	0	0	0	110.8	F190 G191 S196 V197 L198	F190-I194 HydrophobicContact CD1-CD1 3.89Å; F190-I194 HydrophobicContact CE1-CD1 3.57Å; F190-I194 HydrophobicContact CE1-CG1 4.44Å; F190-I194 HydrophobicContact CZ-CD1 4.07Å; F190-I194 PolarHBondContact O-N 3.45Å; G191-I194 PolarHBondContact O-N 2.91Å; I194-S196 VanDerWaalsContact C-N 3.26Å; I194-S196 PolarHBondContact O-N 2.9Å; I194-V197 PolarHBondContact O-N 3.21Å; I194-V197 VanDerWaalsContact O-N 3.08Å; I194-L198 HydrophobicContact CG2-CD1 4.02Å; I194-L198 HydrophobicContact CG2-CG 4.33Å; I194-L198 WeakPolarHBondContact O-CG 3.37Å; I194-L198 PolarHBondContact O-N 2.97Å
195	L	87.7	Confident	88	Confident	40 Å²	40	63.8 Å²	63.8	21%	0.209	35%	0.347	C	S	.	.	H	α-helix	trans	-60.3	-35	177	-73.5	168.3	0	0	0	112.5	G191 C192 L198 S199 V211 L212 M215	G191-L195 WeakPolarHBondContact O-CG 3.24Å; G191-L195 PolarHBondContact O-N 3.35Å; C192-L195 PolarHBondContact O-N 3.25Å; L195-L198 PolarHBondContact O-N 2.88Å; L195-S199 WeakPolarHBondContact O-CB 3.3Å; L195-S199 PolarHBondContact O-N 2.76Å; L195-V211 HydrophobicContact CD1-CG1 4.03Å; L195-V211 HydrophobicContact CD2-CG1 4.32Å; L195-L212 HydrophobicContact CB-CD1 3.98Å; L195-M215 HydrophobicContact CD1-CG 4.46Å
196	S	83.1	Confident	87.8	Confident	27 Å²	27	71.2 Å²	71.2	19%	0.189	38%	0.381	C	S	.	.	H	α-helix	trans	-64.8	-40.3	173.9	-172.9	0	0	0	0	112	C192 L193 I194 S199	C192-S196 WeakPolarHBondContact O-CB 3.27Å; C192-S196 PolarHBondContact O-N 3.31Å; L193-S196 WeakPolarHBondContact O-CB 3.22Å; L193-S196 PolarHBondContact O-N 3.46Å; I194-S196 VanDerWaalsContact C-N 3.26Å; I194-S196 PolarHBondContact O-N 2.9Å; S196-S199 PolarHBondContact O-N 3.29Å; S196-S199 PolarHBondContact O-OG 3.26Å
197	V	86.7	Confident	87.8	Confident	83 Å²	83	70.2 Å²	70.2	50%	0.503	39%	0.385	S	S	.	.	H	α-helix	trans	-68.7	-41.2	174.7	175.5	0	0	0	0	111.2	L193 I194 S199 T200	L193-V197 HydrophobicContact CD2-CG2 4.42Å; L193-V197 WeakPolarHBondContact O-CG2 3.25Å; L193-V197 PolarHBondContact O-N 3.31Å; I194-V197 PolarHBondContact O-N 3.21Å; I194-V197 VanDerWaalsContact O-N 3.08Å; V197-S199 PolarHBondContact O-N 3.32Å; V197-T200 PolarHBondContact O-N 3.22Å; V197-T200 VanDerWaalsContact O-N 3.09Å; V197-T200 PolarHBondContact O-OG1 3.43Å
198	L	88.7	Confident	87.8	Confident	68 Å²	68	68.2 Å²	68.2	36%	0.356	37%	0.369	S	S	.	.	H	α-helix	trans	-62.4	-32.7	173.9	-66.7	174.7	0	0	0	111.8	I194 L195 T200 I201 A208	I194-L198 HydrophobicContact CG2-CD1 4.02Å; I194-L198 HydrophobicContact CG2-CG 4.33Å; I194-L198 WeakPolarHBondContact O-CG 3.37Å; I194-L198 PolarHBondContact O-N 2.97Å; L195-L198 PolarHBondContact O-N 2.88Å; L198-T200 PolarHBondContact O-N 3.31Å; L198-I201 HydrophobicContact CD2-CD1 4.18Å; L198-I201 PolarHBondContact O-N 2.7Å; L198-I201 VanDerWaalsContact O-N 3.13Å; L198-A208 HydrophobicContact CB-CB 4.08Å
199	S	84.4	Confident	87.5	Confident	15 Å²	15	68.2 Å²	68.2	11%	0.105	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.9	175.6	81.9	0	0	0	0	114.7	L195 S196 V197	L195-S199 WeakPolarHBondContact O-CB 3.3Å; L195-S199 PolarHBondContact O-N 2.76Å; S196-S199 PolarHBondContact O-N 3.29Å; S196-S199 PolarHBondContact O-OG 3.26Å; V197-S199 PolarHBondContact O-N 3.32Å
200	T	85.6	Confident	87.5	Confident	107 Å²	107	74.9 Å²	74.9	66%	0.656	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-6.7	172.1	60.7	0	0	0	0	113.9	V197 L198	V197-T200 PolarHBondContact O-N 3.22Å; V197-T200 VanDerWaalsContact O-N 3.09Å; V197-T200 PolarHBondContact O-OG1 3.43Å; L198-T200 PolarHBondContact O-N 3.31Å
201	I	90.4	Very high	87.6	Confident	74 Å²	74	73.5 Å²	73.5	38%	0.379	40%	0.395	S	S	.	.	S	Bend	trans	-89.8	120	174.8	-56.4	175.9	0	0	0	108.3	L198 E203 Y204 A205	L198-I201 HydrophobicContact CD2-CD1 4.18Å; L198-I201 PolarHBondContact O-N 2.7Å; L198-I201 VanDerWaalsContact O-N 3.13Å; I201-E203 HydrophobicContact CG2-CB 4.35Å; I201-E203 PolarHBondContact O-N 3.29Å; I201-E203 VanDerWaalsContact O-N 3.12Å; I201-Y204 HydrophobicContact CB-CD2 4.48Å; I201-Y204 HydrophobicContact CG2-CD2 4.1Å; I201-Y204 PolarHBondContact O-N 3.29Å; I201-A205 PolarHBondContact O-N 3.33Å
202	N	90.1	Very high	87.5	Confident	155 Å²	155	72.2 Å²	72.2	83%	0.829	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-38.6	-173.5	-69.1	-23	0	0	0	113.7	Y204	N202-Y204 VanDerWaalsContact C-N 3.3Å; N202-Y204 PolarHBondContact O-N 2.99Å
203	E	90.6	Very high	87.4	Confident	162 Å²	162	75 Å²	75	76%	0.757	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.2	178.6	-63.9	174.4	-171.8	0	0	113.8	I201	I201-E203 HydrophobicContact CG2-CB 4.35Å; I201-E203 PolarHBondContact O-N 3.29Å; I201-E203 VanDerWaalsContact O-N 3.12Å
204	Y	89.7	Confident	87.5	Confident	131 Å²	131	80.2 Å²	80.2	51%	0.514	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-2.8	-175.4	-61.2	-79.5	0	0	0	113.1	I201 N202 E206 S207 A208	I201-Y204 HydrophobicContact CB-CD2 4.48Å; I201-Y204 HydrophobicContact CG2-CD2 4.1Å; I201-Y204 PolarHBondContact O-N 3.29Å; N202-Y204 VanDerWaalsContact C-N 3.3Å; N202-Y204 PolarHBondContact O-N 2.99Å; Y204-E206 PolarHBondContact O-N 2.85Å; Y204-S207 PolarHBondContact O-N 3.43Å; Y204-S207 VanDerWaalsContact O-N 3.17Å; Y204-A208 VanDerWaalsContact O-CB 3.26Å; Y204-A208 WeakPolarHBondContact O-CB 3.38Å; Y204-A208 PolarHBondContact O-N 3.46Å
205	A	86.1	Confident	87.5	Confident	34 Å²	34	80.1 Å²	80.1	28%	0.281	41%	0.412	S	S	.	.	H	α-helix	trans	-52.8	-47.8	-168.4	0	0	0	0	0	113.8	I201 G209	I201-A205 PolarHBondContact O-N 3.33Å; A205-G209 VanDerWaalsContact O-CA 3.31Å; A205-G209 WeakPolarHBondContact O-CA 3.47Å; A205-G209 PolarHBondContact O-N 3.33Å
206	E	86.3	Confident	87.4	Confident	156 Å²	156	78.5 Å²	78.5	73%	0.729	40%	0.403	S	S	*	.	H	α-helix	trans	-72.2	-37.8	-179.2	-62.8	-166	166.9	0	0	113.5	Y204 R210	Y204-E206 PolarHBondContact O-N 2.85Å; E206-R210 WeakPolarHBondContact O-CB 3.4Å; E206-R210 VanDerWaalsContact O-CG 3.29Å; E206-R210 WeakPolarHBondContact O-CG 3.44Å; E206-R210 PolarHBondContact O-N 2.89Å; E206-R210 VanDerWaalsContact O-N 3.12Å; E206-R210 PolarHBondContact O-NE 3.33Å; E206-R210 VanDerWaalsContact O-NE 3.1Å
207	S	89.6	Confident	87.7	Confident	68 Å²	68	80.5 Å²	80.5	48%	0.476	41%	0.411	S	S	.	.	H	α-helix	trans	-77.3	-48.5	-178.2	-68.7	0	0	0	0	111.3	Y204 G209 R210 V211	Y204-S207 PolarHBondContact O-N 3.43Å; Y204-S207 VanDerWaalsContact O-N 3.17Å; S207-G209 VanDerWaalsContact C-N 3.33Å; S207-G209 PolarHBondContact O-N 3.32Å; S207-R210 PolarHBondContact O-N 3.42Å; S207-R210 PolarHBondContact OG-NH2 3.22Å; S207-V211 WeakPolarHBondContact O-CG2 3.36Å; S207-V211 PolarHBondContact O-N 2.86Å; S207-V211 VanDerWaalsContact O-N 3.14Å
208	A	89.2	Confident	87.9	Confident	11 Å²	11	80.4 Å²	80.4	9%	0.091	41%	0.411	C	S	.	.	H	α-helix	trans	-63.3	-39.5	172.8	0	0	0	0	0	111.3	L198 Y204 V211 L212	L198-A208 HydrophobicContact CB-CB 4.08Å; Y204-A208 VanDerWaalsContact O-CB 3.26Å; Y204-A208 WeakPolarHBondContact O-CB 3.38Å; Y204-A208 PolarHBondContact O-N 3.46Å; A208-V211 PolarHBondContact O-N 3.49Å; A208-L212 WeakPolarHBondContact O-CB 3.39Å; A208-L212 PolarHBondContact O-N 3.21Å
209	G	84	Confident	88	Confident	18 Å²	18	77.4 Å²	77.4	19%	0.186	40%	0.395	C	S	.	.	H	α-helix	trans	-60.7	-45.4	176.6	0	0	0	0	0	113.5	A205 S207 L212 L213	A205-G209 VanDerWaalsContact O-CA 3.31Å; A205-G209 WeakPolarHBondContact O-CA 3.47Å; A205-G209 PolarHBondContact O-N 3.33Å; S207-G209 VanDerWaalsContact C-N 3.33Å; S207-G209 PolarHBondContact O-N 3.32Å; G209-L212 PolarHBondContact O-N 3.01Å; G209-L213 PolarHBondContact O-N 3.42Å
210	R	87.1	Confident	88.3	Confident	151 Å²	151	77.6 Å²	77.6	57%	0.57	40%	0.395	S	S	*	.	H	α-helix	trans	-63.2	-47.4	175.3	-75.6	178.8	-66.5	174.3	0.6	112.2	E206 S207 L212 L213 Y214	E206-R210 WeakPolarHBondContact O-CB 3.4Å; E206-R210 VanDerWaalsContact O-CG 3.29Å; E206-R210 WeakPolarHBondContact O-CG 3.44Å; E206-R210 PolarHBondContact O-N 2.89Å; E206-R210 VanDerWaalsContact O-N 3.12Å; E206-R210 PolarHBondContact O-NE 3.33Å; E206-R210 VanDerWaalsContact O-NE 3.1Å; S207-R210 PolarHBondContact O-N 3.42Å; S207-R210 PolarHBondContact OG-NH2 3.22Å; R210-L212 VanDerWaalsContact C-N 3.33Å; R210-L212 PolarHBondContact O-N 2.93Å; R210-L213 PolarHBondContact O-N 2.83Å; R210-Y214 WeakPolarHBondContact O-CD2 3.4Å; R210-Y214 PolarHBondContact O-N 2.87Å
211	V	90.6	Very high	88.7	Confident	73 Å²	73	79 Å²	79	44%	0.442	39%	0.392	S	S	.	.	H	α-helix	trans	-63.1	-40.6	177.8	175.7	0	0	0	0	111.1	L195 S207 A208 L213 Y214 M215	L195-V211 HydrophobicContact CD1-CG1 4.03Å; L195-V211 HydrophobicContact CD2-CG1 4.32Å; S207-V211 WeakPolarHBondContact O-CG2 3.36Å; S207-V211 PolarHBondContact O-N 2.86Å; S207-V211 VanDerWaalsContact O-N 3.14Å; A208-V211 PolarHBondContact O-N 3.49Å; V211-L213 PolarHBondContact O-N 2.72Å; V211-Y214 PolarHBondContact O-N 3.35Å; V211-M215 HydrophobicContact CG1-CG 4.23Å; V211-M215 WeakPolarHBondContact O-CB 3.33Å; V211-M215 VanDerWaalsContact O-CG 3.3Å; V211-M215 WeakPolarHBondContact O-CG 3.4Å; V211-M215 PolarHBondContact O-N 3.45Å
212	L	87.3	Confident	88.9	Confident	2 Å²	2	79.6 Å²	79.6	1%	0.01	39%	0.389	C	S	.	.	H	α-helix	trans	-60.3	-43.8	176.8	-177.1	68.8	0	0	0	111.6	C192 L195 A208 G209 R210 M215 E216	C192-L212 HydrophobicContact CB-CD1 4.41Å; C192-L212 WeakPolarHBondContact O-CD1 3.41Å; L195-L212 HydrophobicContact CB-CD1 3.98Å; A208-L212 WeakPolarHBondContact O-CB 3.39Å; A208-L212 PolarHBondContact O-N 3.21Å; G209-L212 PolarHBondContact O-N 3.01Å; R210-L212 VanDerWaalsContact C-N 3.33Å; R210-L212 PolarHBondContact O-N 2.93Å; L212-M215 PolarHBondContact O-N 3.31Å; L212-E216 WeakPolarHBondContact O-CB 3.44Å; L212-E216 PolarHBondContact O-N 3.31Å
213	L	84.2	Confident	89	Confident	63 Å²	63	72.4 Å²	72.4	33%	0.33	35%	0.351	S	S	.	.	H	α-helix	trans	-60.9	-49.4	178.2	-169.1	164.4	0	0	0	111.4	G209 R210 V211 M215 E216 L217 L269	G209-L213 PolarHBondContact O-N 3.42Å; R210-L213 PolarHBondContact O-N 2.83Å; V211-L213 PolarHBondContact O-N 2.72Å; L213-M215 PolarHBondContact O-N 3.31Å; L213-E216 PolarHBondContact O-N 3.43Å; L213-L217 WeakPolarHBondContact O-CB 3.37Å; L213-L217 PolarHBondContact O-N 3.32Å; L213-L269 HydrophobicContact CG-CD2 4.38Å
214	Y	89.1	Confident	89.1	Confident	171 Å²	171	70.1 Å²	70.1	67%	0.671	34%	0.339	S	S	*	.	H	α-helix	trans	-60.9	-45.1	177.1	-73.2	-64	0	0	0	112.3	R210 V211 L217 V218	R210-Y214 WeakPolarHBondContact O-CD2 3.4Å; R210-Y214 PolarHBondContact O-N 2.87Å; V211-Y214 PolarHBondContact O-N 3.35Å; Y214-L217 PolarHBondContact O-N 2.97Å; Y214-V218 WeakPolarHBondContact O-CG2 3.41Å; Y214-V218 PolarHBondContact O-N 2.89Å; Y214-V218 VanDerWaalsContact O-N 3.1Å
215	M	86.5	Confident	89.3	Confident	74 Å²	74	66.1 Å²	66.1	37%	0.365	33%	0.333	S	S	.	.	H	α-helix	trans	-66.4	-38.7	178.3	-71.6	-63	-65.3	0	0	112.3	L195 V211 L212 L213 V218 I219	L195-M215 HydrophobicContact CD1-CG 4.46Å; V211-M215 HydrophobicContact CG1-CG 4.23Å; V211-M215 WeakPolarHBondContact O-CB 3.33Å; V211-M215 VanDerWaalsContact O-CG 3.3Å; V211-M215 WeakPolarHBondContact O-CG 3.4Å; V211-M215 PolarHBondContact O-N 3.45Å; L212-M215 PolarHBondContact O-N 3.31Å; L213-M215 PolarHBondContact O-N 3.31Å; M215-V218 PolarHBondContact O-N 2.72Å; M215-I219 WeakPolarHBondContact O-CB 3.15Å; M215-I219 WeakPolarHBondContact O-CG1 3.47Å; M215-I219 PolarHBondContact O-N 3.21Å
216	E	86.7	Confident	89.7	Confident	5 Å²	5	64.9 Å²	64.9	2%	0.023	32%	0.321	C	S	.	.	H	α-helix	trans	-64	-43.1	175.9	172	155.1	-143.2	0	0	111.8	L212 L213 I219 L220 Q290 R293	L212-E216 WeakPolarHBondContact O-CB 3.44Å; L212-E216 PolarHBondContact O-N 3.31Å; L213-E216 PolarHBondContact O-N 3.43Å; E216-I219 PolarHBondContact O-N 3.14Å; E216-L220 VanDerWaalsContact O-CB 3.25Å; E216-L220 WeakPolarHBondContact O-CB 3.34Å; E216-L220 PolarHBondContact O-N 3.02Å; E216-Q290 PolarHBondContact OE1-NE2 2.94Å; E216-Q290 PolarHBondContact OE2-NE2 3.38Å; E216-R293 IonicContact OE1-CZ 3.7Å; E216-R293 IonicContact OE1-NH1 3.54Å; E216-R293 IonicContact OE1-NH2 2.81Å; E216-R293 PolarHBondContact OE1-NH2 3.49Å
217	L	88.4	Confident	90.1	Very high	69 Å²	69	59 Å²	59	36%	0.361	29%	0.293	S	S	.	.	H	α-helix	trans	-60.6	-46.7	175.3	-178.1	150	0	0	0	111.2	L213 Y214 L220 F221	L213-L217 WeakPolarHBondContact O-CB 3.37Å; L213-L217 PolarHBondContact O-N 3.32Å; Y214-L217 PolarHBondContact O-N 2.97Å; L217-L220 PolarHBondContact O-N 3.37Å; L217-F221 HydrophobicContact CD2-CD2 3.81Å; L217-F221 HydrophobicContact CD2-CE2 3.74Å; L217-F221 HydrophobicContact CG-CD2 4.17Å; L217-F221 HydrophobicContact CG-CE2 3.91Å; L217-F221 VanDerWaalsContact O-CD2 3.23Å; L217-F221 WeakPolarHBondContact O-CD2 3.39Å; L217-F221 PolarHBondContact O-N 2.73Å; L217-F221 VanDerWaalsContact O-N 3.14Å
218	V	91.8	Very high	90.3	Very high	82 Å²	82	58.4 Å²	58.4	50%	0.497	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-45.7	177.2	171.7	0	0	0	0	111.6	Y214 M215 F221 W222	Y214-V218 WeakPolarHBondContact O-CG2 3.41Å; Y214-V218 PolarHBondContact O-N 2.89Å; Y214-V218 VanDerWaalsContact O-N 3.1Å; M215-V218 PolarHBondContact O-N 2.72Å; V218-F221 PolarHBondContact O-N 3.39Å; V218-W222 PolarHBondContact O-N 2.97Å
219	I	90.7	Very high	90.5	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-35.1	178.6	-71.5	177.4	0	0	0	111.7	C192 M215 E216 W222 F223	C192-I219 HydrophobicContact CB-CD1 4.38Å; C192-I219 WeakPolarHBondContact SG-CD1 3.4Å; M215-I219 WeakPolarHBondContact O-CB 3.15Å; M215-I219 WeakPolarHBondContact O-CG1 3.47Å; M215-I219 PolarHBondContact O-N 3.21Å; E216-I219 PolarHBondContact O-N 3.14Å; I219-W222 WeakPolarHBondContact O-CB 3.44Å; I219-W222 PolarHBondContact O-N 3.5Å; I219-F223 HydrophobicContact CG2-CD1 4.14Å; I219-F223 HydrophobicContact CG2-CD2 3.82Å; I219-F223 HydrophobicContact CG2-CE1 3.96Å; I219-F223 HydrophobicContact CG2-CE2 3.62Å; I219-F223 HydrophobicContact CG2-CG 4.09Å; I219-F223 HydrophobicContact CG2-CZ 3.71Å; I219-F223 WeakPolarHBondContact O-CB 3.34Å; I219-F223 WeakPolarHBondContact O-CG 3.38Å; I219-F223 PolarHBondContact O-N 3.23Å
220	L	91.2	Very high	91	Very high	19 Å²	19	61.3 Å²	61.3	10%	0.099	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-49.2	176	176.6	57.4	0	0	0	111.4	E216 L217 W222 F223 F224 I262 V266 L269	E216-L220 VanDerWaalsContact O-CB 3.25Å; E216-L220 WeakPolarHBondContact O-CB 3.34Å; E216-L220 PolarHBondContact O-N 3.02Å; L217-L220 PolarHBondContact O-N 3.37Å; L220-W222 VanDerWaalsContact C-N 3.32Å; L220-W222 PolarHBondContact O-N 2.73Å; L220-F223 PolarHBondContact O-N 3.22Å; L220-F224 WeakPolarHBondContact O-CB 3.44Å; L220-F224 PolarHBondContact O-N 3.43Å; L220-I262 HydrophobicContact CD1-CB 4.4Å; L220-I262 HydrophobicContact CD1-CG1 4.44Å; L220-I262 HydrophobicContact CD1-CG2 4.03Å; L220-V266 HydrophobicContact CD1-CG2 4.3Å; L220-V266 HydrophobicContact CD2-CG2 3.9Å; L220-L269 HydrophobicContact CD2-CD1 3.54Å
221	F	93	Very high	91.2	Very high	136 Å²	136	56.3 Å²	56.3	60%	0.596	28%	0.281	S	S	*	.	H	α-helix	trans	-61.7	-40.4	176	-78.6	-65.8	0	0	0	111.9	L217 V218 A225	L217-F221 HydrophobicContact CD2-CD2 3.81Å; L217-F221 HydrophobicContact CD2-CE2 3.74Å; L217-F221 HydrophobicContact CG-CD2 4.17Å; L217-F221 HydrophobicContact CG-CE2 3.91Å; L217-F221 VanDerWaalsContact O-CD2 3.23Å; L217-F221 WeakPolarHBondContact O-CD2 3.39Å; L217-F221 PolarHBondContact O-N 2.73Å; L217-F221 VanDerWaalsContact O-N 3.14Å; V218-F221 PolarHBondContact O-N 3.39Å; F221-A225 WeakPolarHBondContact O-CB 3.15Å; F221-A225 PolarHBondContact O-N 2.8Å
222	W	94.1	Very high	91.4	Very high	87 Å²	87	56.2 Å²	56.2	33%	0.33	27%	0.272	S	S	.	.	H	α-helix	trans	-59	-51.2	173.1	-169.2	-41	0	0	0	111.3	Y181 F184 V185 V218 I219 L220 F224 A225 E226	Y181-W222 HydrophobicContact CD2-CZ2 4.43Å; Y181-W222 AromaticContact CE2-CZ2 3.78Å; Y181-W222 HydrophobicContact CE2-CZ2 3.78Å; Y181-W222 AromaticContact CE2-NE1 3.78Å; Y181-W222 AromaticContact CZ-NE1 3.7Å; Y181-W222 PolarHBondContact OH-NE1 3.32Å; F184-W222 AromaticContact CD1-CH2 3.48Å; F184-W222 HydrophobicContact CD1-CH2 3.48Å; F184-W222 VanDerWaalsContact CD1-CH2 3.48Å; F184-W222 HydrophobicContact CD1-CZ2 4.08Å; F184-W222 HydrophobicContact CD1-CZ3 4.19Å; F184-W222 AromaticContact CE1-CH2 3.26Å; F184-W222 HydrophobicContact CE1-CH2 3.26Å; F184-W222 HydrophobicContact CE1-CZ2 4.25Å; F184-W222 AromaticContact CE1-CZ3 3.53Å; F184-W222 HydrophobicContact CE1-CZ3 3.53Å; F184-W222 HydrophobicContact CZ-CH2 4.3Å; F184-W222 HydrophobicContact CZ-CZ3 4.41Å; V185-W222 HydrophobicContact CG2-CZ2 4.13Å; V218-W222 PolarHBondContact O-N 2.97Å; I219-W222 WeakPolarHBondContact O-CB 3.44Å; I219-W222 PolarHBondContact O-N 3.5Å; L220-W222 VanDerWaalsContact C-N 3.32Å; L220-W222 PolarHBondContact O-N 2.73Å; W222-F224 PolarHBondContact O-N 3.41Å; W222-A225 PolarHBondContact O-N 2.87Å; W222-E226 PolarHBondContact O-N 3.18Å
223	F	92.1	Very high	91.7	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-70	-35.3	-174.4	-75.1	5.8	0	0	0	112.5	V185 V189 I219 L220 E226 Y227 I262 R293 R296	V185-F223 HydrophobicContact CG1-CE1 3.84Å; V185-F223 HydrophobicContact CG1-CZ 4.04Å; V189-F223 HydrophobicContact CG2-CE2 3.92Å; V189-F223 HydrophobicContact CG2-CZ 3.46Å; V189-F223 VanDerWaalsContact CG2-CZ 3.46Å; I219-F223 HydrophobicContact CG2-CD1 4.14Å; I219-F223 HydrophobicContact CG2-CD2 3.82Å; I219-F223 HydrophobicContact CG2-CE1 3.96Å; I219-F223 HydrophobicContact CG2-CE2 3.62Å; I219-F223 HydrophobicContact CG2-CG 4.09Å; I219-F223 HydrophobicContact CG2-CZ 3.71Å; I219-F223 WeakPolarHBondContact O-CB 3.34Å; I219-F223 WeakPolarHBondContact O-CG 3.38Å; I219-F223 PolarHBondContact O-N 3.23Å; L220-F223 PolarHBondContact O-N 3.22Å; F223-E226 PolarHBondContact O-N 3.33Å; F223-Y227 VanDerWaalsContact O-CB 3.27Å; F223-Y227 WeakPolarHBondContact O-CB 3.33Å; F223-Y227 PolarHBondContact O-N 2.95Å; F223-I262 HydrophobicContact CB-CG1 4.5Å; F223-R293 HydrophobicContact CE2-CG 4.31Å; F223-R296 VanDerWaalsContact CD1-NH2 3.31Å; F223-R296 VanDerWaalsContact CE1-NH2 3.27Å
224	F	93.7	Very high	92	Very high	114 Å²	114	53.1 Å²	53.1	50%	0.5	26%	0.256	S	S	.	.	H	α-helix	trans	-59.8	-49.4	168.8	-179.8	-101	0	0	0	111.3	L220 W222 E226 Y227 C228 I262	L220-F224 WeakPolarHBondContact O-CB 3.44Å; L220-F224 PolarHBondContact O-N 3.43Å; W222-F224 PolarHBondContact O-N 3.41Å; F224-E226 PolarHBondContact O-N 2.83Å; F224-Y227 PolarHBondContact O-N 3.32Å; F224-C228 WeakPolarHBondContact O-CB 3.46Å; F224-C228 PolarHBondContact O-N 2.84Å; F224-C228 PolarHBondContact O-SG 3.47Å; F224-C228 VanDerWaalsContact O-SG 3.39Å; F224-I262 HydrophobicContact CD2-CG2 4.37Å
225	A	94.8	Very high	92	Very high	48 Å²	48	45.2 Å²	45.2	40%	0.397	23%	0.227	S	C	.	.	H	α-helix	trans	-61.2	-43.4	177	0	0	0	0	0	112.2	F221 W222 C228 L229	F221-A225 WeakPolarHBondContact O-CB 3.15Å; F221-A225 PolarHBondContact O-N 2.8Å; W222-A225 PolarHBondContact O-N 2.87Å; A225-C228 PolarHBondContact O-N 3.05Å; A225-L229 WeakPolarHBondContact O-CB 3.32Å; A225-L229 VanDerWaalsContact O-CG 3.28Å; A225-L229 WeakPolarHBondContact O-CG 3.17Å; A225-L229 PolarHBondContact O-N 3.14Å
226	E	94	Very high	92.1	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.033	22%	0.221	C	C	.	.	H	α-helix	trans	-63.7	-43.5	175.9	-167.6	-171.1	142.4	0	0	111.6	L170 Y181 W222 F223 F224 L229 R230 R296	L170-E226 HydrophobicContact CD1-CG 4.35Å; L170-E226 HydrophobicContact CD2-CG 3.94Å; Y181-E226 VanDerWaalsContact OH-CD 3.25Å; Y181-E226 PolarHBondContact OH-OE2 2.99Å; W222-E226 PolarHBondContact O-N 3.18Å; F223-E226 PolarHBondContact O-N 3.33Å; F224-E226 PolarHBondContact O-N 2.83Å; E226-L229 PolarHBondContact O-N 3.35Å; E226-R230 WeakPolarHBondContact O-CB 3.28Å; E226-R230 PolarHBondContact O-N 3.45Å; E226-R230 IonicContact OE1-CZ 2.86Å; E226-R230 IonicContact OE1-NE 3.7Å; E226-R230 IonicContact OE1-NH2 3.85Å; E226-R230 PolarHBondContact OE1-NH2 3.41Å; E226-R296 VanDerWaalsContact CD-NH2 3.34Å; E226-R296 IonicContact OE1-NH2 3.42Å; E226-R296 IonicContact OE2-CZ 3.26Å; E226-R296 IonicContact OE2-NH1 2.71Å; E226-R296 IonicContact OE2-NH2 2.83Å; E226-R296 PolarHBondContact OE2-NH2 3.37Å
227	Y	93.6	Very high	91.9	Very high	33 Å²	33	45.6 Å²	45.6	13%	0.129	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-45.8	177.3	178.1	-101.6	0	0	0	111.3	F223 F224 R230 L231 C255 D258 V259 I262	F223-Y227 VanDerWaalsContact O-CB 3.27Å; F223-Y227 WeakPolarHBondContact O-CB 3.33Å; F223-Y227 PolarHBondContact O-N 2.95Å; F224-Y227 PolarHBondContact O-N 3.32Å; Y227-R230 PolarHBondContact O-N 3.23Å; Y227-L231 HydrophobicContact CE1-CD2 4.33Å; Y227-L231 WeakPolarHBondContact O-CB 3.37Å; Y227-L231 PolarHBondContact O-N 2.84Å; Y227-C255 HydrophobicContact CE2-CB 4.4Å; Y227-D258 HydrophobicContact CD2-CB 4.15Å; Y227-D258 WeakPolarHBondContact CD2-OD2 3.18Å; Y227-V259 HydrophobicContact CD2-CG2 4.46Å; Y227-V259 HydrophobicContact CE1-CG2 3.9Å; Y227-V259 HydrophobicContact CE2-CG2 3.67Å; Y227-V259 VanDerWaalsContact OH-CG2 3.28Å; Y227-V259 WeakPolarHBondContact OH-CG2 3.48Å; Y227-I262 HydrophobicContact CG-CD1 4.22Å
228	C	94.5	Very high	91.6	Very high	55 Å²	55	45.4 Å²	45.4	37%	0.372	23%	0.233	S	C	.	.	H	α-helix	trans	-59.5	-45.7	173.7	-72.9	0	0	0	0	112.2	F224 A225 L231 W232	F224-C228 WeakPolarHBondContact O-CB 3.46Å; F224-C228 PolarHBondContact O-N 2.84Å; F224-C228 PolarHBondContact O-SG 3.47Å; F224-C228 VanDerWaalsContact O-SG 3.39Å; A225-C228 PolarHBondContact O-N 3.05Å; C228-L231 PolarHBondContact O-N 2.93Å; C228-W232 VanDerWaalsContact O-CB 3.27Å; C228-W232 WeakPolarHBondContact O-CB 3.26Å; C228-W232 PolarHBondContact O-N 2.88Å
229	L	94	Very high	91.2	Very high	82 Å²	82	48.6 Å²	48.6	43%	0.429	24%	0.237	S	C	.	.	H	α-helix	trans	-64.5	-38.1	176.3	-73.9	170.8	0	0	0	112.3	L170 A225 E226 S233	L170-L229 HydrophobicContact CD1-CB 3.8Å; A225-L229 WeakPolarHBondContact O-CB 3.32Å; A225-L229 VanDerWaalsContact O-CG 3.28Å; A225-L229 WeakPolarHBondContact O-CG 3.17Å; A225-L229 PolarHBondContact O-N 3.14Å; E226-L229 PolarHBondContact O-N 3.35Å; L229-S233 WeakPolarHBondContact O-CB 3.17Å; L229-S233 PolarHBondContact O-N 3.05Å; L229-S233 PolarHBondContact O-OG 3.04Å
230	R	92.7	Very high	91.1	Very high	8 Å²	8	49.1 Å²	49.1	3%	0.03	24%	0.238	C	C	.	.	H	α-helix	trans	-67.8	-45.8	177.2	-153.4	-176.4	-51.1	113.3	-5.4	111.1	E226 Y227 S233 A234 F249 D258 R296	E226-R230 WeakPolarHBondContact O-CB 3.28Å; E226-R230 PolarHBondContact O-N 3.45Å; E226-R230 IonicContact OE1-CZ 2.86Å; E226-R230 IonicContact OE1-NE 3.7Å; E226-R230 IonicContact OE1-NH2 3.85Å; E226-R230 PolarHBondContact OE1-NH2 3.41Å; Y227-R230 PolarHBondContact O-N 3.23Å; R230-S233 WeakPolarHBondContact CA-OG 3.12Å; R230-S233 PolarHBondContact O-N 3.44Å; R230-S233 PolarHBondContact O-OG 3.39Å; R230-A234 WeakPolarHBondContact O-CB 3.29Å; R230-A234 PolarHBondContact O-N 3.48Å; R230-F249 HydrophobicContact CG-CE1 4.33Å; R230-F249 HydrophobicContact CG-CZ 4.24Å; R230-D258 IonicContact CZ-OD2 3.35Å; R230-D258 IonicContact NH1-OD2 3.99Å; R230-D258 PolarHBondContact NH1-OD2 3.24Å; R230-D258 IonicContact NH2-OD2 3.83Å; R230-D258 PolarHBondContact NH2-OD2 3.42Å; R230-R296 VanDerWaalsContact NH2-NH1 3.12Å
231	L	93.3	Very high	90.6	Very high	46 Å²	46	51.7 Å²	51.7	24%	0.241	25%	0.25	C	C	.	.	H	α-helix	trans	-66.3	-37.8	177.4	-175.7	61.9	0	0	0	112.5	Y227 C228 R246 F249 A250	Y227-L231 HydrophobicContact CE1-CD2 4.33Å; Y227-L231 WeakPolarHBondContact O-CB 3.37Å; Y227-L231 PolarHBondContact O-N 2.84Å; C228-L231 PolarHBondContact O-N 2.93Å; L231-R246 HydrophobicContact CD1-CB 4.01Å; L231-R246 WeakPolarHBondContact CD1-O 3.48Å; L231-R246 PolarHBondContact O-NE 3.49Å; L231-F249 HydrophobicContact CD1-CD1 4.04Å; L231-A250 HydrophobicContact CD1-CB 4.24Å
232	W	93.9	Very high	90.4	Very high	71 Å²	71	50 Å²	50	27%	0.269	25%	0.251	S	S	.	.	H	α-helix	trans	-68.3	-48.7	174	172.9	85.9	0	0	0	111.6	Y159 Q163 I166 C228 A234 G235 R246	Y159-W232 HydrophobicContact CD2-CZ2 4.24Å; Y159-W232 AromaticContact CE2-CZ2 3.54Å; Y159-W232 HydrophobicContact CE2-CZ2 3.54Å; Y159-W232 AromaticContact CZ-CZ2 3.86Å; Y159-W232 AromaticContact CZ-NE1 3.9Å; Y159-W232 PolarHBondContact OH-NE1 3.36Å; Y159-W232 VanDerWaalsContact OH-NE1 3.09Å; Q163-W232 HydrophobicContact CB-CH2 4.45Å; Q163-W232 HydrophobicContact CG-CZ3 4.46Å; Q163-W232 PolarHBondContact NE2-O 3.18Å; I166-W232 HydrophobicContact CD1-CH2 4.45Å; I166-W232 HydrophobicContact CD1-CZ3 3.84Å; C228-W232 VanDerWaalsContact O-CB 3.27Å; C228-W232 WeakPolarHBondContact O-CB 3.26Å; C228-W232 PolarHBondContact O-N 2.88Å; W232-A234 PolarHBondContact O-N 3.42Å; W232-G235 PolarHBondContact O-N 3.09Å; W232-R246 PolarHBondContact O-NH2 3.32Å
233	S	93.4	Very high	90.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-30.1	-177.2	63.6	0	0	0	0	113.3	Q163 L229 R230 G235 C236	Q163-S233 WeakPolarHBondContact CG-O 3.27Å; L229-S233 WeakPolarHBondContact O-CB 3.17Å; L229-S233 PolarHBondContact O-N 3.05Å; L229-S233 PolarHBondContact O-OG 3.04Å; R230-S233 WeakPolarHBondContact CA-OG 3.12Å; R230-S233 PolarHBondContact O-N 3.44Å; R230-S233 PolarHBondContact O-OG 3.39Å; S233-G235 PolarHBondContact O-N 2.81Å; S233-C236 WeakPolarHBondContact O-CB 3.29Å; S233-C236 PolarHBondContact O-N 2.81Å; S233-C236 PolarHBondContact O-SG 2.78Å; S233-C236 VanDerWaalsContact O-SG 3.38Å
234	A	91.2	Very high	89.9	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-51.9	-28.5	174.7	0	0	0	0	0	114.3	Y167 R230 W232 C236 R237 F249	Y167-A234 HydrophobicContact CD2-CB 4.33Å; Y167-A234 HydrophobicContact CE2-CB 4.09Å; R230-A234 WeakPolarHBondContact O-CB 3.29Å; R230-A234 PolarHBondContact O-N 3.48Å; W232-A234 PolarHBondContact O-N 3.42Å; A234-C236 PolarHBondContact O-N 2.61Å; A234-R237 PolarHBondContact O-N 3.44Å; A234-F249 HydrophobicContact CB-CB 4.4Å; A234-F249 HydrophobicContact CB-CD1 3.73Å; A234-F249 HydrophobicContact CB-CD2 3.79Å; A234-F249 HydrophobicContact CB-CE1 3.87Å; A234-F249 HydrophobicContact CB-CE2 3.93Å; A234-F249 HydrophobicContact CB-CG 3.69Å; A234-F249 HydrophobicContact CB-CZ 3.97Å
235	G	89.5	Confident	89.7	Confident	6 Å²	6	57.7 Å²	57.7	6%	0.062	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-64.3	-2.9	175.3	0	0	0	0	0	115.6	Q163 W232 S233 R237	Q163-G235 VanDerWaalsContact NE2-CA 3.35Å; W232-G235 PolarHBondContact O-N 3.09Å; S233-G235 PolarHBondContact O-N 2.81Å; G235-R237 VanDerWaalsContact C-N 3.29Å
236	C	86.7	Confident	89.6	Confident	34 Å²	34	58.9 Å²	58.9	23%	0.23	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-70.4	-26.8	170.7	74.5	0	0	0	0	112.2	Q163 A164 Y167 S233 A234	Q163-C236 HydrophobicContact CB-CB 4.26Å; Q163-C236 HydrophobicContact CG-CB 3.99Å; A164-C236 HydrophobicContact CB-CB 4.17Å; Y167-C236 VanDerWaalsContact CB-SG 3.58Å; Y167-C236 VanDerWaalsContact CG-SG 3.59Å; S233-C236 WeakPolarHBondContact O-CB 3.29Å; S233-C236 PolarHBondContact O-N 2.81Å; S233-C236 PolarHBondContact O-SG 2.78Å; S233-C236 VanDerWaalsContact O-SG 3.38Å; A234-C236 PolarHBondContact O-N 2.61Å
237	R	83.6	Confident	89.5	Confident	53 Å²	53	62 Å²	62	20%	0.2	29%	0.289	C	S	.	.	S	Bend	trans	-79.1	133.1	175.2	-75	-75.4	-177.6	169.5	-2.4	110.5	D88 Y167 R172 A234 G235 R239 Y240 Q241	D88-R237 IonicContact OD1-NH1 2.81Å; D88-R237 IonicContact OD2-CZ 3.54Å; D88-R237 VanDerWaalsContact OD2-CZ 3.31Å; D88-R237 IonicContact OD2-NH1 3.03Å; D88-R237 PolarHBondContact OD2-NH1 2.92Å; D88-R237 IonicContact OD2-NH2 3.63Å; D88-R237 PolarHBondContact OD2-NH2 2.92Å; Y167-R237 HydrophobicContact CE1-CG 4.27Å; R172-R237 VanDerWaalsContact NH1-NH2 3.13Å; A234-R237 PolarHBondContact O-N 3.44Å; G235-R237 VanDerWaalsContact C-N 3.29Å; R237-R239 PolarHBondContact O-N 2.68Å; R237-Y240 HydrophobicContact CB-CD2 3.76Å; R237-Y240 HydrophobicContact CB-CE2 4.28Å; R237-Y240 HydrophobicContact CG-CD2 4.25Å; R237-Y240 HydrophobicContact CG-CE2 4.41Å; R237-Y240 PolarHBondContact O-N 2.75Å; R237-Q241 WeakPolarHBondContact O-CG 3.08Å; R237-Q241 PolarHBondContact O-N 2.97Å
238	S	82.4	Confident	89.3	Confident	64 Å²	64	64.5 Å²	64.5	45%	0.448	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-48.8	-46.5	175.6	-167.6	0	0	0	0	112.4	E90 Y240 Q241	E90-S238 VanDerWaalsContact OE1-CB 3.24Å; E90-S238 WeakPolarHBondContact OE1-CB 3.46Å; S238-Y240 PolarHBondContact O-N 3.21Å; S238-Y240 VanDerWaalsContact O-N 3.13Å; S238-Q241 PolarHBondContact O-N 2.89Å
239	R	83.4	Confident	89.2	Confident	150 Å²	150	62.2 Å²	62.2	57%	0.566	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-57.4	-25.7	178.8	-171	173.9	179	163.2	1.8	115.5	R237	R237-R239 PolarHBondContact O-N 2.68Å
240	Y	88.4	Confident	89	Confident	14 Å²	14	59.1 Å²	59.1	6%	0.055	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-115.9	17.7	-176.4	-47	-52.3	0	0	0	113.5	R237 S238 G245 H248 F249 R252	R237-Y240 HydrophobicContact CB-CD2 3.76Å; R237-Y240 HydrophobicContact CB-CE2 4.28Å; R237-Y240 HydrophobicContact CG-CD2 4.25Å; R237-Y240 HydrophobicContact CG-CE2 4.41Å; R237-Y240 PolarHBondContact O-N 2.75Å; S238-Y240 PolarHBondContact O-N 3.21Å; S238-Y240 VanDerWaalsContact O-N 3.13Å; Y240-G245 CarbonylContact O-C 3.03Å; Y240-H248 AromaticContact CE1-ND1 3.97Å; Y240-F249 HydrophobicContact CD1-CB 4.02Å; Y240-F249 HydrophobicContact CD2-CB 4.5Å; Y240-F249 AromaticContact CD2-CD2 3.87Å; Y240-F249 HydrophobicContact CD2-CD2 3.87Å; Y240-F249 HydrophobicContact CE1-CB 4.48Å; Y240-F249 AromaticContact CE2-CD2 3.85Å; Y240-F249 HydrophobicContact CE2-CD2 3.85Å; Y240-F249 HydrophobicContact CE2-CE2 4.49Å; Y240-F249 HydrophobicContact CG-CB 4.06Å; Y240-F249 HydrophobicContact CG-CD2 4.27Å; Y240-R252 PolarHBondContact OH-NE 2.91Å; Y240-R252 PolarHBondContact OH-NH2 3.15Å
241	Q	80.6	Confident	89	Confident	74 Å²	74	67.4 Å²	67.4	35%	0.346	30%	0.304	S	S	.	.			trans	-66.9	154.2	170.7	-65.2	-174.9	6.4	0	0	111.1	R237 S238 G245	R237-Q241 WeakPolarHBondContact O-CG 3.08Å; R237-Q241 PolarHBondContact O-N 2.97Å; S238-Q241 PolarHBondContact O-N 2.89Å; Q241-G245 WeakPolarHBondContact O-CA 3.07Å; Q241-G245 PolarHBondContact O-N 3.04Å
242	T	87.7	Confident	88.8	Confident	101 Å²	101	70.1 Å²	70.1	62%	0.62	31%	0.311	S	S	*	.	H	α-helix	trans	64.7	171.2	-173.4	81.7	0	0	0	0	115	R244 G245 R246	T242-R244 VanDerWaalsContact C-N 3.33Å; T242-R244 PolarHBondContact O-N 3.46Å; T242-G245 PolarHBondContact O-N 3.08Å; T242-R246 PolarHBondContact O-N 3.27Å
243	W	87.8	Confident	88.5	Confident	176 Å²	176	71 Å²	71	67%	0.667	33%	0.326	S	S	*	.	H	α-helix	trans	-63	-36.6	-179.8	82.1	-93.7	0	0	0	112.8	R246 L247	W243-R246 PolarHBondContact O-N 3.19Å; W243-L247 HydrophobicContact CZ3-CD2 3.96Å; W243-L247 PolarHBondContact O-N 2.88Å
244	R	89.5	Confident	88.2	Confident	181 Å²	181	73.1 Å²	73.1	68%	0.683	34%	0.335	S	S	*	.	H	α-helix	trans	-66.3	-39.3	177	-67	-176.9	177.5	155.7	-1.5	111.7	T242 L247 H248	T242-R244 VanDerWaalsContact C-N 3.33Å; T242-R244 PolarHBondContact O-N 3.46Å; R244-L247 PolarHBondContact O-N 2.86Å; R244-H248 PolarHBondContact O-N 3.1Å
245	G	89.2	Confident	88.1	Confident	8 Å²	8	73.5 Å²	73.5	8%	0.082	34%	0.338	C	S	.	.	H	α-helix	trans	-65.9	-40.2	174.4	0	0	0	0	0	112.5	Y240 Q241 T242 H248 F249	Y240-G245 CarbonylContact O-C 3.03Å; Q241-G245 WeakPolarHBondContact O-CA 3.07Å; Q241-G245 PolarHBondContact O-N 3.04Å; T242-G245 PolarHBondContact O-N 3.08Å; G245-H248 PolarHBondContact O-N 3.13Å; G245-F249 PolarHBondContact O-N 2.9Å
246	R	92	Very high	88.1	Confident	74 Å²	74	76.9 Å²	76.9	28%	0.279	35%	0.354	S	S	.	.	H	α-helix	trans	-66.2	-39.4	173.1	-73.2	-177.8	172.1	-179.1	-3	113	L231 W232 T242 W243 H248 F249 A250	L231-R246 HydrophobicContact CD1-CB 4.01Å; L231-R246 WeakPolarHBondContact CD1-O 3.48Å; L231-R246 PolarHBondContact O-NE 3.49Å; W232-R246 PolarHBondContact O-NH2 3.32Å; T242-R246 PolarHBondContact O-N 3.27Å; W243-R246 PolarHBondContact O-N 3.19Å; R246-H248 VanDerWaalsContact C-N 3.34Å; R246-H248 PolarHBondContact O-N 3.37Å; R246-F249 WeakPolarHBondContact O-CA 3.39Å; R246-F249 WeakPolarHBondContact O-CB 3.45Å; R246-F249 PolarHBondContact O-N 3.47Å; R246-F249 VanDerWaalsContact O-N 3.09Å; R246-A250 PolarHBondContact O-N 3.01Å
247	L	91.2	Very high	88.2	Confident	71 Å²	71	76.9 Å²	76.9	37%	0.372	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-38.1	173.1	-176.5	62.2	0	0	0	111.9	W243 R244 F249 A250 R251	W243-L247 HydrophobicContact CZ3-CD2 3.96Å; W243-L247 PolarHBondContact O-N 2.88Å; R244-L247 PolarHBondContact O-N 2.86Å; L247-F249 VanDerWaalsContact C-N 3.3Å; L247-F249 PolarHBondContact O-N 2.97Å; L247-A250 PolarHBondContact O-N 3.31Å; L247-R251 WeakPolarHBondContact O-CG 3.44Å; L247-R251 PolarHBondContact O-N 3.37Å; L247-R251 VanDerWaalsContact O-N 3.1Å
248	H	91	Very high	88.5	Confident	87 Å²	87	74.3 Å²	74.3	40%	0.403	34%	0.343	S	S	.	.	H	α-helix	trans	-63.1	-34.9	170.5	-178.6	-42.3	0	0	0	111.7	Y240 R244 G245 R246	Y240-H248 AromaticContact CE1-ND1 3.97Å; R244-H248 PolarHBondContact O-N 3.1Å; G245-H248 PolarHBondContact O-N 3.13Å; R246-H248 VanDerWaalsContact C-N 3.34Å; R246-H248 PolarHBondContact O-N 3.37Å
249	F	90.9	Very high	88.9	Confident	6 Å²	6	73.8 Å²	73.8	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-66.9	-47	173.4	-178.5	-96.4	0	0	0	111.8	Y167 R230 L231 A234 Y240 G245 R246 L247 R251 R252	Y167-F249 HydrophobicContact CE2-CE2 4.31Å; R230-F249 HydrophobicContact CG-CE1 4.33Å; R230-F249 HydrophobicContact CG-CZ 4.24Å; L231-F249 HydrophobicContact CD1-CD1 4.04Å; A234-F249 HydrophobicContact CB-CB 4.4Å; A234-F249 HydrophobicContact CB-CD1 3.73Å; A234-F249 HydrophobicContact CB-CD2 3.79Å; A234-F249 HydrophobicContact CB-CE1 3.87Å; A234-F249 HydrophobicContact CB-CE2 3.93Å; A234-F249 HydrophobicContact CB-CG 3.69Å; A234-F249 HydrophobicContact CB-CZ 3.97Å; Y240-F249 HydrophobicContact CD1-CB 4.02Å; Y240-F249 HydrophobicContact CD2-CB 4.5Å; Y240-F249 AromaticContact CD2-CD2 3.87Å; Y240-F249 HydrophobicContact CD2-CD2 3.87Å; Y240-F249 HydrophobicContact CE1-CB 4.48Å; Y240-F249 AromaticContact CE2-CD2 3.85Å; Y240-F249 HydrophobicContact CE2-CD2 3.85Å; Y240-F249 HydrophobicContact CE2-CE2 4.49Å; Y240-F249 HydrophobicContact CG-CB 4.06Å; Y240-F249 HydrophobicContact CG-CD2 4.27Å; G245-F249 PolarHBondContact O-N 2.9Å; R246-F249 WeakPolarHBondContact O-CA 3.39Å; R246-F249 WeakPolarHBondContact O-CB 3.45Å; R246-F249 PolarHBondContact O-N 3.47Å; R246-F249 VanDerWaalsContact O-N 3.09Å; L247-F249 VanDerWaalsContact C-N 3.3Å; L247-F249 PolarHBondContact O-N 2.97Å; F249-R251 PolarHBondContact O-N 3.04Å; F249-R252 WeakPolarHBondContact O-CB 3.05Å; F249-R252 WeakPolarHBondContact O-CG 3.43Å; F249-R252 PolarHBondContact O-N 3.24Å
250	A	91.7	Very high	89.2	Confident	18 Å²	18	70.3 Å²	70.3	15%	0.149	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-29	178.5	0	0	0	0	0	113.5	L231 R246 L247 R252 C255	L231-A250 HydrophobicContact CD1-CB 4.24Å; R246-A250 PolarHBondContact O-N 3.01Å; L247-A250 PolarHBondContact O-N 3.31Å; A250-R252 PolarHBondContact O-N 3.14Å; A250-C255 WeakPolarHBondContact O-CB 3.14Å
251	R	92.2	Very high	89.2	Confident	181 Å²	181	69.8 Å²	69.8	68%	0.683	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	4.6	174.3	-73.1	176.4	178	-178.5	-2.1	115	L247 F249	L247-R251 WeakPolarHBondContact O-CG 3.44Å; L247-R251 PolarHBondContact O-N 3.37Å; L247-R251 VanDerWaalsContact O-N 3.1Å; F249-R251 PolarHBondContact O-N 3.04Å
252	R	89.2	Confident	89.7	Confident	103 Å²	103	67 Å²	67	39%	0.389	31%	0.314	S	S	.	.	S	Bend	trans	-73.1	141.9	170.1	-73.2	178.9	164	-88.4	-7.8	109.9	Y240 F249 A250 F254 C255 I256	Y240-R252 PolarHBondContact OH-NE 2.91Å; Y240-R252 PolarHBondContact OH-NH2 3.15Å; F249-R252 WeakPolarHBondContact O-CB 3.05Å; F249-R252 WeakPolarHBondContact O-CG 3.43Å; F249-R252 PolarHBondContact O-N 3.24Å; A250-R252 PolarHBondContact O-N 3.14Å; R252-F254 PolarHBondContact O-N 2.98Å; R252-C255 HydrophobicContact CB-CB 4.49Å; R252-C255 WeakPolarHBondContact O-CA 3.26Å; R252-C255 WeakPolarHBondContact O-CB 3.44Å; R252-C255 PolarHBondContact O-N 3.23Å; R252-I256 PolarHBondContact O-N 3.47Å
253	P	86.6	Confident	89.8	Confident	89 Å²	89	66.1 Å²	66.1	58%	0.578	31%	0.308	S	S	*	.	H	α-helix	trans	-55.5	-45.9	-171.2	19.4	-32.4	0	0	0	113.3	C255 I256 V257	P253-C255 VanDerWaalsContact C-N 3.29Å; P253-C255 PolarHBondContact O-N 2.92Å; P253-I256 WeakPolarHBondContact O-CB 3.25Å; P253-I256 PolarHBondContact O-N 3.34Å; P253-I256 VanDerWaalsContact O-N 3.09Å; P253-V257 WeakPolarHBondContact O-CG2 3.42Å; P253-V257 PolarHBondContact O-N 2.83Å
254	F	86.8	Confident	89.7	Confident	46 Å²	46	58.4 Å²	58.4	20%	0.202	28%	0.282	C	S	.	.	H	α-helix	trans	-64.5	-28	177.2	-61.4	-74.1	0	0	0	114.2	R252 D258 D298 G301	R252-F254 PolarHBondContact O-N 2.98Å; F254-D258 PolarHBondContact O-N 2.85Å; F254-D298 VanDerWaalsContact CE1-O 3.26Å; F254-D298 WeakPolarHBondContact CE1-O 3.41Å; F254-D298 WeakPolarHBondContact CZ-O 3.46Å; F254-G301 VanDerWaalsContact CE2-N 3.26Å; F254-G301 VanDerWaalsContact CZ-CA 3.41Å
255	C	89.4	Confident	89.5	Confident	8 Å²	8	50 Å²	50	5%	0.054	25%	0.251	C	S	.	.	H	α-helix	trans	-75.5	-35.2	172.8	-66.8	0	0	0	0	111.5	Y227 A250 R252 P253 D258 V259	Y227-C255 HydrophobicContact CE2-CB 4.4Å; A250-C255 WeakPolarHBondContact O-CB 3.14Å; R252-C255 HydrophobicContact CB-CB 4.49Å; R252-C255 WeakPolarHBondContact O-CA 3.26Å; R252-C255 WeakPolarHBondContact O-CB 3.44Å; R252-C255 PolarHBondContact O-N 3.23Å; P253-C255 VanDerWaalsContact C-N 3.29Å; P253-C255 PolarHBondContact O-N 2.92Å; C255-D258 PolarHBondContact O-N 3.28Å; C255-V259 WeakPolarHBondContact O-CG2 3.29Å; C255-V259 PolarHBondContact O-N 2.67Å; C255-V259 VanDerWaalsContact O-N 3.09Å
256	I	90.5	Very high	89.4	Confident	77 Å²	77	53.3 Å²	53.3	40%	0.395	27%	0.269	S	S	.	.	H	α-helix	trans	-64.8	-44	173.1	-62.5	170.5	0	0	0	110.3	R252 P253 D258 V259 I260	R252-I256 PolarHBondContact O-N 3.47Å; P253-I256 WeakPolarHBondContact O-CB 3.25Å; P253-I256 PolarHBondContact O-N 3.34Å; P253-I256 VanDerWaalsContact O-N 3.09Å; I256-D258 VanDerWaalsContact C-N 3.35Å; I256-D258 PolarHBondContact O-N 2.84Å; I256-V259 PolarHBondContact O-N 2.96Å; I256-I260 HydrophobicContact CG2-CD1 3.78Å; I256-I260 HydrophobicContact CG2-CG1 4.32Å; I256-I260 WeakPolarHBondContact O-CG1 3.38Å; I256-I260 PolarHBondContact O-N 3.07Å
257	V	88.9	Confident	89	Confident	33 Å²	33	52.6 Å²	52.6	20%	0.2	27%	0.273	C	S	.	.	H	α-helix	trans	-59	-44.4	175.2	173.3	0	0	0	0	111.4	P253 V259 I260 V261 L292	P253-V257 WeakPolarHBondContact O-CG2 3.42Å; P253-V257 PolarHBondContact O-N 2.83Å; V257-V259 VanDerWaalsContact C-N 3.34Å; V257-V259 PolarHBondContact O-N 3.29Å; V257-I260 PolarHBondContact O-N 3.24Å; V257-V261 HydrophobicContact CG1-CG2 4.41Å; V257-V261 WeakPolarHBondContact O-CB 3.39Å; V257-V261 VanDerWaalsContact O-CG2 3.31Å; V257-V261 WeakPolarHBondContact O-CG2 3.4Å; V257-V261 PolarHBondContact O-N 3.2Å; V257-L292 HydrophobicContact CG1-CB 4.35Å
258	D	89.7	Confident	88.5	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-42.4	176.5	-153.9	15.9	0	0	0	111.7	Y227 R230 F254 C255 I256 V261 I262 R296	Y227-D258 HydrophobicContact CD2-CB 4.15Å; Y227-D258 WeakPolarHBondContact CD2-OD2 3.18Å; R230-D258 IonicContact CZ-OD2 3.35Å; R230-D258 IonicContact NH1-OD2 3.99Å; R230-D258 PolarHBondContact NH1-OD2 3.24Å; R230-D258 IonicContact NH2-OD2 3.83Å; R230-D258 PolarHBondContact NH2-OD2 3.42Å; F254-D258 PolarHBondContact O-N 2.85Å; C255-D258 PolarHBondContact O-N 3.28Å; I256-D258 VanDerWaalsContact C-N 3.35Å; I256-D258 PolarHBondContact O-N 2.84Å; D258-V261 PolarHBondContact O-N 2.93Å; D258-I262 WeakPolarHBondContact O-CB 3.23Å; D258-I262 WeakPolarHBondContact O-CD1 3.45Å; D258-I262 VanDerWaalsContact O-CG1 3.24Å; D258-I262 WeakPolarHBondContact O-CG1 3.41Å; D258-I262 PolarHBondContact O-N 3.3Å; D258-R296 VanDerWaalsContact CG-NH1 3.3Å; D258-R296 WeakPolarHBondContact OD1-CD 3.36Å; D258-R296 IonicContact OD1-CZ 2.68Å; D258-R296 IonicContact OD1-NE 2.84Å; D258-R296 IonicContact OD1-NH1 3.57Å; D258-R296 PolarHBondContact OD1-NH1 2.83Å; D258-R296 IonicContact OD2-NH1 3.56Å; D258-R296 PolarHBondContact OD2-NH1 2.86Å
259	V	90.9	Very high	88	Confident	52 Å²	52	47.4 Å²	47.4	32%	0.315	25%	0.249	S	C	.	.	H	α-helix	trans	-65.6	-45.5	175.2	172.7	0	0	0	0	112	Y227 C255 I256 V257 V261 I262 V263	Y227-V259 HydrophobicContact CD2-CG2 4.46Å; Y227-V259 HydrophobicContact CE1-CG2 3.9Å; Y227-V259 HydrophobicContact CE2-CG2 3.67Å; Y227-V259 VanDerWaalsContact OH-CG2 3.28Å; Y227-V259 WeakPolarHBondContact OH-CG2 3.48Å; C255-V259 WeakPolarHBondContact O-CG2 3.29Å; C255-V259 PolarHBondContact O-N 2.67Å; C255-V259 VanDerWaalsContact O-N 3.09Å; I256-V259 PolarHBondContact O-N 2.96Å; V257-V259 VanDerWaalsContact C-N 3.34Å; V257-V259 PolarHBondContact O-N 3.29Å; V259-V261 VanDerWaalsContact C-N 3.31Å; V259-V261 PolarHBondContact O-N 2.95Å; V259-I262 PolarHBondContact O-N 3.15Å; V259-V263 HydrophobicContact CG1-CG2 4.2Å; V259-V263 WeakPolarHBondContact O-CB 3.5Å; V259-V263 VanDerWaalsContact O-CG2 3.3Å; V259-V263 WeakPolarHBondContact O-CG2 3.37Å; V259-V263 PolarHBondContact O-N 2.93Å
260	I	89.1	Confident	87.5	Confident	78 Å²	78	49.8 Å²	49.8	40%	0.4	27%	0.27	S	S	.	.	H	α-helix	trans	-59	-45.4	177.6	-70.8	168.5	0	0	0	110.2	I256 V257 V263 A264 L292	I256-I260 HydrophobicContact CG2-CD1 3.78Å; I256-I260 HydrophobicContact CG2-CG1 4.32Å; I256-I260 WeakPolarHBondContact O-CG1 3.38Å; I256-I260 PolarHBondContact O-N 3.07Å; V257-I260 PolarHBondContact O-N 3.24Å; I260-V263 PolarHBondContact O-N 3.45Å; I260-A264 VanDerWaalsContact O-CB 3.28Å; I260-A264 WeakPolarHBondContact O-CB 3.47Å; I260-A264 PolarHBondContact O-N 2.95Å; I260-L292 HydrophobicContact CG2-CD1 4.49Å
261	V	88.3	Confident	86.8	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-49.6	176.5	163.4	0	0	0	0	111.2	V257 D258 V259 A264 S265 L292 R293	V257-V261 HydrophobicContact CG1-CG2 4.41Å; V257-V261 WeakPolarHBondContact O-CB 3.39Å; V257-V261 VanDerWaalsContact O-CG2 3.31Å; V257-V261 WeakPolarHBondContact O-CG2 3.4Å; V257-V261 PolarHBondContact O-N 3.2Å; D258-V261 PolarHBondContact O-N 2.93Å; V259-V261 VanDerWaalsContact C-N 3.31Å; V259-V261 PolarHBondContact O-N 2.95Å; V261-A264 PolarHBondContact O-N 3.08Å; V261-S265 WeakPolarHBondContact O-CB 3.36Å; V261-S265 PolarHBondContact O-N 2.95Å; V261-S265 PolarHBondContact O-OG 3.41Å; V261-L292 HydrophobicContact CG2-CB 3.78Å; V261-R293 HydrophobicContact CG1-CG 3.46Å; V261-R293 VanDerWaalsContact CG1-CG 3.46Å; V261-R293 HydrophobicContact CG2-CG 4.38Å
262	I	90.6	Very high	85.8	Confident	16 Å²	16	46 Å²	46	8%	0.082	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-47.4	179.2	-71	163.8	0	0	0	110.6	L220 F223 F224 Y227 D258 V259 S265 V266	L220-I262 HydrophobicContact CD1-CB 4.4Å; L220-I262 HydrophobicContact CD1-CG1 4.44Å; L220-I262 HydrophobicContact CD1-CG2 4.03Å; F223-I262 HydrophobicContact CB-CG1 4.5Å; F224-I262 HydrophobicContact CD2-CG2 4.37Å; Y227-I262 HydrophobicContact CG-CD1 4.22Å; D258-I262 WeakPolarHBondContact O-CB 3.23Å; D258-I262 WeakPolarHBondContact O-CD1 3.45Å; D258-I262 VanDerWaalsContact O-CG1 3.24Å; D258-I262 WeakPolarHBondContact O-CG1 3.41Å; D258-I262 PolarHBondContact O-N 3.3Å; V259-I262 PolarHBondContact O-N 3.15Å; I262-S265 PolarHBondContact O-N 3.02Å; I262-V266 WeakPolarHBondContact O-CG2 3.25Å; I262-V266 PolarHBondContact O-N 2.95Å
263	V	89.5	Confident	84.9	Confident	82 Å²	82	45.8 Å²	45.8	50%	0.497	28%	0.276	S	S	.	.	H	α-helix	trans	-63.4	-46.3	179.7	171.5	0	0	0	0	111.5	V259 I260 S265 V266 V267	V259-V263 HydrophobicContact CG1-CG2 4.2Å; V259-V263 WeakPolarHBondContact O-CB 3.5Å; V259-V263 VanDerWaalsContact O-CG2 3.3Å; V259-V263 WeakPolarHBondContact O-CG2 3.37Å; V259-V263 PolarHBondContact O-N 2.93Å; I260-V263 PolarHBondContact O-N 3.45Å; V263-S265 VanDerWaalsContact C-N 3.29Å; V263-S265 PolarHBondContact O-N 3.45Å; V263-V266 PolarHBondContact O-N 3.3Å; V263-V267 HydrophobicContact CG1-CG2 4.44Å; V263-V267 WeakPolarHBondContact O-CG2 3.34Å; V263-V267 PolarHBondContact O-N 3.08Å
264	A	85.5	Confident	83.9	Confident	15 Å²	15	45.9 Å²	45.9	12%	0.124	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-40.1	176.9	0	0	0	0	0	111.9	I260 V261 V267 V268 F289	I260-A264 VanDerWaalsContact O-CB 3.28Å; I260-A264 WeakPolarHBondContact O-CB 3.47Å; I260-A264 PolarHBondContact O-N 2.95Å; V261-A264 PolarHBondContact O-N 3.08Å; A264-V267 PolarHBondContact O-N 2.61Å; A264-V268 WeakPolarHBondContact O-CG2 3.24Å; A264-V268 PolarHBondContact O-N 3.01Å; A264-F289 HydrophobicContact CB-CB 3.95Å; A264-F289 HydrophobicContact CB-CD2 4.39Å; A264-F289 HydrophobicContact CB-CG 4.33Å
265	S	85.5	Confident	82.6	Confident	4 Å²	4	55.2 Å²	55.2	3%	0.028	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-41.8	177.3	-48.3	0	0	0	0	112	V261 I262 V263 V268 L269 R293	V261-S265 WeakPolarHBondContact O-CB 3.36Å; V261-S265 PolarHBondContact O-N 2.95Å; V261-S265 PolarHBondContact O-OG 3.41Å; I262-S265 PolarHBondContact O-N 3.02Å; V263-S265 VanDerWaalsContact C-N 3.29Å; V263-S265 PolarHBondContact O-N 3.45Å; S265-V268 PolarHBondContact O-N 2.85Å; S265-L269 WeakPolarHBondContact O-CG 3.39Å; S265-L269 PolarHBondContact O-N 3.46Å; S265-L269 VanDerWaalsContact O-N 3.09Å; S265-R293 PolarHBondContact OG-NH2 2.92Å
266	V	87.7	Confident	81.2	Confident	77 Å²	77	59.5 Å²	59.5	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-42.7	174.6	171.6	0	0	0	0	111.1	L220 I262 V263 L269 A270	L220-V266 HydrophobicContact CD1-CG2 4.3Å; L220-V266 HydrophobicContact CD2-CG2 3.9Å; I262-V266 WeakPolarHBondContact O-CG2 3.25Å; I262-V266 PolarHBondContact O-N 2.95Å; V263-V266 PolarHBondContact O-N 3.3Å; V266-L269 PolarHBondContact O-N 3.45Å; V266-A270 WeakPolarHBondContact O-CB 3.37Å; V266-A270 PolarHBondContact O-N 2.82Å
267	V	83.9	Confident	79.8	Confident	60 Å²	60	63.5 Å²	63.5	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-63.6	-41.5	177.8	170.6	0	0	0	0	111.5	V263 A264 V271 L286	V263-V267 HydrophobicContact CG1-CG2 4.44Å; V263-V267 WeakPolarHBondContact O-CG2 3.34Å; V263-V267 PolarHBondContact O-N 3.08Å; A264-V267 PolarHBondContact O-N 2.61Å; V267-V271 WeakPolarHBondContact O-CG2 3.4Å; V267-V271 PolarHBondContact O-N 3.49Å; V267-L286 HydrophobicContact CB-CD1 4.47Å; V267-L286 HydrophobicContact CG1-CD1 3.82Å
268	V	80.1	Confident	78.5	Confident	16 Å²	16	71.4 Å²	71.4	10%	0.097	38%	0.379	C	S	.	.	H	α-helix	trans	-59.8	-52	175.1	168.6	0	0	0	0	111	A264 S265 A270 V271 D272 L286	A264-V268 WeakPolarHBondContact O-CG2 3.24Å; A264-V268 PolarHBondContact O-N 3.01Å; S265-V268 PolarHBondContact O-N 2.85Å; V268-A270 PolarHBondContact O-N 3.21Å; V268-V271 PolarHBondContact O-N 2.89Å; V268-D272 WeakPolarHBondContact O-CB 3.4Å; V268-D272 PolarHBondContact O-N 2.85Å; V268-L286 HydrophobicContact CG2-CB 3.49Å; V268-L286 VanDerWaalsContact CG2-CB 3.49Å; V268-L286 HydrophobicContact CG2-CD1 3.92Å; V268-L286 HydrophobicContact CG2-CG 4.33Å
269	L	80.8	Confident	77.2	Confident	33 Å²	33	73 Å²	73	17%	0.173	39%	0.393	C	S	.	.	H	α-helix	trans	-67.8	-35.4	-178	-67.1	172.6	0	0	0	113.3	L213 L220 S265 V266 S273	L213-L269 HydrophobicContact CG-CD2 4.38Å; L220-L269 HydrophobicContact CD2-CD1 3.54Å; S265-L269 WeakPolarHBondContact O-CG 3.39Å; S265-L269 PolarHBondContact O-N 3.46Å; S265-L269 VanDerWaalsContact O-N 3.09Å; V266-L269 PolarHBondContact O-N 3.45Å; L269-S273 PolarHBondContact O-N 3.27Å; L269-S273 PolarHBondContact O-OG 3.25Å
270	A	81.3	Confident	75.8	Confident	56 Å²	56	71.9 Å²	71.9	46%	0.463	39%	0.389	S	S	.	.	H	α-helix	trans	-64.8	-39.9	178.9	0	0	0	0	0	112	V266 V268 S273	V266-A270 WeakPolarHBondContact O-CB 3.37Å; V266-A270 PolarHBondContact O-N 2.82Å; V268-A270 PolarHBondContact O-N 3.21Å; A270-S273 WeakPolarHBondContact O-CB 3.15Å
271	V	76.7	Confident	74.7	Confident	31 Å²	31	71.2 Å²	71.2	19%	0.188	39%	0.391	C	S	.	.	H	α-helix	trans	-87.7	-24.9	-177.9	-172.8	0	0	0	0	112.9	V267 V268 S273 D274 A279 L283	V267-V271 WeakPolarHBondContact O-CG2 3.4Å; V267-V271 PolarHBondContact O-N 3.49Å; V268-V271 PolarHBondContact O-N 2.89Å; V271-S273 PolarHBondContact O-N 2.97Å; V271-D274 PolarHBondContact O-N 3.3Å; V271-A279 HydrophobicContact CG1-CB 3.59Å; V271-L283 HydrophobicContact CB-CD1 3.35Å; V271-L283 HydrophobicContact CG1-CD1 3.32Å; V271-L283 HydrophobicContact CG2-CD1 3.6Å
272	D	70	Confident	73.5	Confident	87 Å²	87	74.9 Å²	74.9	47%	0.465	42%	0.421	S	S	.	.	H	α-helix	trans	-65.2	-19.1	169.3	-154.5	54.8	0	0	0	112.1	V268	V268-D272 WeakPolarHBondContact O-CB 3.4Å; V268-D272 PolarHBondContact O-N 2.85Å
273	S	70.6	Confident	72.5	Confident	99 Å²	99	76 Å²	76	69%	0.692	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-25.3	171.9	-56.2	0	0	0	0	113.2	L269 A270 V271	L269-S273 PolarHBondContact O-N 3.27Å; L269-S273 PolarHBondContact O-OG 3.25Å; A270-S273 WeakPolarHBondContact O-CB 3.15Å; V271-S273 PolarHBondContact O-N 2.97Å
274	D	65.6	Low	71.4	Confident	92 Å²	92	78.7 Å²	78.7	49%	0.492	43%	0.428	S	S	.	.	S	Bend	trans	-86.4	134.7	176.2	-77	-26.5	0	0	0	110.1	V271 N276	V271-D274 PolarHBondContact O-N 3.3Å; D274-N276 HydrophobicContact CB-CB 4.27Å; D274-N276 PolarHBondContact O-N 2.99Å
275	R	59.5	Low	70.7	Confident	241 Å²	241	80.3 Å²	80.3	91%	0.909	45%	0.447	S	S	*	.			trans	-69.8	17.2	176.7	-54.8	-174.1	-167.1	-151.9	3.3	113.9	M277	R275-M277 VanDerWaalsContact C-N 3.29Å; R275-M277 PolarHBondContact O-N 3.38Å
276	N	61.6	Low	70.1	Confident	99 Å²	99	82 Å²	82	53%	0.529	46%	0.455	S	S	.	.			trans	-77.5	76.3	-178.7	-69.3	-28	0	0	0	110	D274 F278 A279 A280	D274-N276 HydrophobicContact CB-CB 4.27Å; D274-N276 PolarHBondContact O-N 2.99Å; N276-F278 PolarHBondContact O-N 2.93Å; N276-A279 HydrophobicContact CB-CB 4.3Å; N276-A279 PolarHBondContact O-N 3.47Å; N276-A280 PolarHBondContact O-N 2.7Å
277	M	59.4	Low	69.2	Low	160 Å²	160	81.7 Å²	81.7	79%	0.788	45%	0.446	S	S	*	.	H	α-helix	trans	-49	-30.1	-175.7	-61.9	172.6	70.6	0	0	114.3	R275 S281	R275-M277 VanDerWaalsContact C-N 3.29Å; R275-M277 PolarHBondContact O-N 3.38Å; M277-S281 PolarHBondContact O-N 2.87Å; M277-S281 PolarHBondContact O-OG 3.36Å
278	F	62.1	Low	68.6	Low	200 Å²	200	85.7 Å²	85.7	88%	0.877	46%	0.458	S	S	*	.	H	α-helix	trans	-68.1	-41.7	176.6	-130.7	-88.4	0	0	0	112.7	N276	N276-F278 PolarHBondContact O-N 2.93Å
279	A	62.1	Low	68.3	Low	34 Å²	34	89 Å²	89	28%	0.281	47%	0.472	S	S	.	.	H	α-helix	trans	-71.9	-39.4	177.7	0	0	0	0	0	111.5	V271 N276 S281 A282 L283	V271-A279 HydrophobicContact CG1-CB 3.59Å; N276-A279 HydrophobicContact CB-CB 4.3Å; N276-A279 PolarHBondContact O-N 3.47Å; A279-S281 PolarHBondContact O-N 2.75Å; A279-A282 PolarHBondContact O-N 2.71Å; A279-L283 HydrophobicContact CB-CD1 4.29Å; A279-L283 WeakPolarHBondContact O-CB 3.28Å; A279-L283 VanDerWaalsContact O-CG 3.24Å; A279-L283 WeakPolarHBondContact O-CG 3.11Å; A279-L283 PolarHBondContact O-N 3.03Å
280	A	61.1	Low	67.8	Low	28 Å²	28	88.4 Å²	88.4	23%	0.231	47%	0.468	C	S	.	.	H	α-helix	trans	-55.6	-34.2	176.8	0	0	0	0	0	113.1	N276 R284	N276-A280 PolarHBondContact O-N 2.7Å; A280-R284 PolarHBondContact O-N 2.81Å
281	S	66.7	Low	67.7	Low	64 Å²	64	89.6 Å²	89.6	45%	0.448	47%	0.466	S	S	.	.	H	α-helix	trans	-76.1	-41.6	178.4	-65.2	0	0	0	0	113.4	M277 A279 R284	M277-S281 PolarHBondContact O-N 2.87Å; M277-S281 PolarHBondContact O-OG 3.36Å; A279-S281 PolarHBondContact O-N 2.75Å; S281-R284 WeakPolarHBondContact O-CB 3.37Å; S281-R284 PolarHBondContact OG-NH2 2.92Å
282	A	64.3	Low	67.8	Low	78 Å²	78	90.4 Å²	90.4	65%	0.645	47%	0.469	S	S	*	.	H	α-helix	trans	-66.2	-41	175	0	0	0	0	0	111.9	A279 R284 G285	A279-A282 PolarHBondContact O-N 2.71Å; A282-R284 VanDerWaalsContact C-N 3.3Å; A282-R284 PolarHBondContact O-N 3.29Å; A282-G285 PolarHBondContact O-N 3.49Å
283	L	67.7	Low	68.2	Low	39 Å²	39	86.5 Å²	86.5	20%	0.204	45%	0.447	C	S	.	.	H	α-helix	trans	-79.1	-12	-176.8	-59.3	170.3	0	0	0	113.3	V271 A279 G285 L286	V271-L283 HydrophobicContact CB-CD1 3.35Å; V271-L283 HydrophobicContact CG1-CD1 3.32Å; V271-L283 HydrophobicContact CG2-CD1 3.6Å; A279-L283 HydrophobicContact CB-CD1 4.29Å; A279-L283 WeakPolarHBondContact O-CB 3.28Å; A279-L283 VanDerWaalsContact O-CG 3.24Å; A279-L283 WeakPolarHBondContact O-CG 3.11Å; A279-L283 PolarHBondContact O-N 3.03Å; L283-G285 PolarHBondContact O-N 2.93Å; L283-L286 HydrophobicContact CB-CD1 4.38Å; L283-L286 HydrophobicContact CB-CG 4.47Å; L283-L286 HydrophobicContact CD2-CD1 3.44Å; L283-L286 VanDerWaalsContact CD2-CD1 3.44Å; L283-L286 HydrophobicContact CD2-CG 3.91Å; L283-L286 HydrophobicContact CG-CD1 4.47Å; L283-L286 VanDerWaalsContact O-CB 3.3Å; L283-L286 WeakPolarHBondContact O-CB 3.19Å; L283-L286 PolarHBondContact O-N 3.21Å
284	R	66.9	Low	68.7	Low	139 Å²	139	86.4 Å²	86.4	53%	0.525	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-55	-32.5	164.8	-155.8	176.8	-61.3	122.7	6.4	111.4	A280 S281 A282 L286 R287	A280-R284 PolarHBondContact O-N 2.81Å; S281-R284 WeakPolarHBondContact O-CB 3.37Å; S281-R284 PolarHBondContact OG-NH2 2.92Å; A282-R284 VanDerWaalsContact C-N 3.3Å; A282-R284 PolarHBondContact O-N 3.29Å; R284-L286 VanDerWaalsContact C-N 3.32Å; R284-L286 PolarHBondContact O-N 2.96Å; R284-R287 WeakPolarHBondContact O-CB 3.38Å; R284-R287 WeakPolarHBondContact O-CG 3.39Å; R284-R287 PolarHBondContact O-N 3.44Å
285	G	70.3	Confident	69.3	Low	50 Å²	50	85.8 Å²	85.8	52%	0.515	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-65.8	-26.5	172.1	0	0	0	0	0	114.4	A282 L283 R287 F288	A282-G285 PolarHBondContact O-N 3.49Å; L283-G285 PolarHBondContact O-N 2.93Å; G285-R287 PolarHBondContact O-N 3.49Å; G285-F288 WeakPolarHBondContact O-CB 3.3Å; G285-F288 PolarHBondContact O-N 2.99Å
286	L	73.5	Confident	70.2	Confident	39 Å²	39	74.8 Å²	74.8	20%	0.204	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-66.9	-16.7	175	-63.1	-172.4	0	0	0	112.8	V267 V268 L283 R284 F288 F289	V267-L286 HydrophobicContact CB-CD1 4.47Å; V267-L286 HydrophobicContact CG1-CD1 3.82Å; V268-L286 HydrophobicContact CG2-CB 3.49Å; V268-L286 VanDerWaalsContact CG2-CB 3.49Å; V268-L286 HydrophobicContact CG2-CD1 3.92Å; V268-L286 HydrophobicContact CG2-CG 4.33Å; L283-L286 HydrophobicContact CB-CD1 4.38Å; L283-L286 HydrophobicContact CB-CG 4.47Å; L283-L286 HydrophobicContact CD2-CD1 3.44Å; L283-L286 VanDerWaalsContact CD2-CD1 3.44Å; L283-L286 HydrophobicContact CD2-CG 3.91Å; L283-L286 HydrophobicContact CG-CD1 4.47Å; L283-L286 VanDerWaalsContact O-CB 3.3Å; L283-L286 WeakPolarHBondContact O-CB 3.19Å; L283-L286 PolarHBondContact O-N 3.21Å; R284-L286 VanDerWaalsContact C-N 3.32Å; R284-L286 PolarHBondContact O-N 2.96Å; L286-F288 PolarHBondContact O-N 2.78Å; L286-F288 VanDerWaalsContact O-N 3.15Å; L286-F289 HydrophobicContact CB-CD2 4.27Å; L286-F289 HydrophobicContact CD2-CD2 3.69Å; L286-F289 HydrophobicContact CD2-CE2 3.53Å; L286-F289 WeakPolarHBondContact O-CB 3.28Å; L286-F289 PolarHBondContact O-N 2.93Å
287	R	69.7	Low	70.9	Confident	71 Å²	71	72.6 Å²	72.6	27%	0.268	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-57.7	-24.7	169.6	-62.9	-173.1	-178.4	178.6	1.5	111.8	R284 G285 F289 Q290	R284-R287 WeakPolarHBondContact O-CB 3.38Å; R284-R287 WeakPolarHBondContact O-CG 3.39Å; R284-R287 PolarHBondContact O-N 3.44Å; G285-R287 PolarHBondContact O-N 3.49Å; R287-F289 PolarHBondContact O-N 3.31Å; R287-Q290 WeakPolarHBondContact O-CA 3.31Å; R287-Q290 WeakPolarHBondContact O-CB 3.07Å; R287-Q290 VanDerWaalsContact O-CG 3.28Å; R287-Q290 WeakPolarHBondContact O-CG 3.47Å; R287-Q290 PolarHBondContact O-N 3.1Å
288	F	71.8	Confident	71.6	Confident	144 Å²	144	67 Å²	67	63%	0.632	35%	0.352	S	S	*	.	H	α-helix	trans	-58.1	-34.4	170.8	-170.2	-96.8	0	0	0	113	G285 L286 Q290 I291	G285-F288 WeakPolarHBondContact O-CB 3.3Å; G285-F288 PolarHBondContact O-N 2.99Å; L286-F288 PolarHBondContact O-N 2.78Å; L286-F288 VanDerWaalsContact O-N 3.15Å; F288-Q290 PolarHBondContact O-N 3.14Å; F288-I291 HydrophobicContact CD2-CD1 3.74Å; F288-I291 HydrophobicContact CE2-CD1 3.87Å; F288-I291 HydrophobicContact CG-CD1 4.42Å; F288-I291 VanDerWaalsContact O-CB 3.31Å; F288-I291 WeakPolarHBondContact O-CB 3.31Å; F288-I291 WeakPolarHBondContact O-CG1 3.5Å; F288-I291 PolarHBondContact O-N 2.9Å
289	F	73.6	Confident	72	Confident	85 Å²	85	59 Å²	59	37%	0.373	32%	0.316	S	S	.	.	H	α-helix	trans	-66.4	-18.1	174	-69.2	-67.5	0	0	0	113.2	A264 L286 R287 I291 L292	A264-F289 HydrophobicContact CB-CB 3.95Å; A264-F289 HydrophobicContact CB-CD2 4.39Å; A264-F289 HydrophobicContact CB-CG 4.33Å; L286-F289 HydrophobicContact CB-CD2 4.27Å; L286-F289 HydrophobicContact CD2-CD2 3.69Å; L286-F289 HydrophobicContact CD2-CE2 3.53Å; L286-F289 WeakPolarHBondContact O-CB 3.28Å; L286-F289 PolarHBondContact O-N 2.93Å; R287-F289 PolarHBondContact O-N 3.31Å; F289-I291 PolarHBondContact O-N 3.16Å; F289-L292 HydrophobicContact CD1-CD1 3.74Å; F289-L292 HydrophobicContact CD1-CG 4.49Å; F289-L292 HydrophobicContact CE1-CD1 4.48Å; F289-L292 VanDerWaalsContact O-CB 3.32Å; F289-L292 WeakPolarHBondContact O-CB 3.33Å; F289-L292 PolarHBondContact O-N 3.06Å; F289-L292 VanDerWaalsContact O-N 3.14Å
290	Q	70	Confident	72.6	Confident	20 Å²	20	60.9 Å²	60.9	9%	0.093	32%	0.316	C	S	.	.	H	α-helix	trans	-65.6	-26.4	171.7	-54.7	170.9	-7.2	0	0	111.4	E216 R287 F288 L292 R293	E216-Q290 PolarHBondContact OE1-NE2 2.94Å; E216-Q290 PolarHBondContact OE2-NE2 3.38Å; R287-Q290 WeakPolarHBondContact O-CA 3.31Å; R287-Q290 WeakPolarHBondContact O-CB 3.07Å; R287-Q290 VanDerWaalsContact O-CG 3.28Å; R287-Q290 WeakPolarHBondContact O-CG 3.47Å; R287-Q290 PolarHBondContact O-N 3.1Å; F288-Q290 PolarHBondContact O-N 3.14Å; Q290-L292 PolarHBondContact O-N 3.25Å; Q290-R293 WeakPolarHBondContact O-CB 3.37Å; Q290-R293 WeakPolarHBondContact O-CD 3.24Å; Q290-R293 WeakPolarHBondContact O-CG 3.32Å; Q290-R293 PolarHBondContact O-N 3.25Å
291	I	78.1	Confident	73.4	Confident	82 Å²	82	59.8 Å²	59.8	42%	0.421	31%	0.307	S	S	.	.	H	α-helix	trans	-63.1	-30.8	174.5	-56.2	175.7	0	0	0	110.7	F288 F289 R293 M294	F288-I291 HydrophobicContact CD2-CD1 3.74Å; F288-I291 HydrophobicContact CE2-CD1 3.87Å; F288-I291 HydrophobicContact CG-CD1 4.42Å; F288-I291 VanDerWaalsContact O-CB 3.31Å; F288-I291 WeakPolarHBondContact O-CB 3.31Å; F288-I291 WeakPolarHBondContact O-CG1 3.5Å; F288-I291 PolarHBondContact O-N 2.9Å; F289-I291 PolarHBondContact O-N 3.16Å; I291-R293 PolarHBondContact O-N 3.18Å; I291-R293 VanDerWaalsContact O-N 3.1Å; I291-M294 WeakPolarHBondContact O-CB 3.26Å; I291-M294 PolarHBondContact O-N 3.19Å
292	L	80.1	Confident	74	Confident	47 Å²	47	58.1 Å²	58.1	25%	0.246	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-17.3	173.7	-55.2	-176.2	0	0	0	113.2	V257 I260 V261 F289 Q290 M294 I295	V257-L292 HydrophobicContact CG1-CB 4.35Å; I260-L292 HydrophobicContact CG2-CD1 4.49Å; V261-L292 HydrophobicContact CG2-CB 3.78Å; F289-L292 HydrophobicContact CD1-CD1 3.74Å; F289-L292 HydrophobicContact CD1-CG 4.49Å; F289-L292 HydrophobicContact CE1-CD1 4.48Å; F289-L292 VanDerWaalsContact O-CB 3.32Å; F289-L292 WeakPolarHBondContact O-CB 3.33Å; F289-L292 PolarHBondContact O-N 3.06Å; F289-L292 VanDerWaalsContact O-N 3.14Å; Q290-L292 PolarHBondContact O-N 3.25Å; L292-M294 PolarHBondContact O-N 3.21Å; L292-I295 HydrophobicContact CD2-CD1 3.68Å; L292-I295 PolarHBondContact O-N 2.7Å; L292-I295 VanDerWaalsContact O-N 3.14Å
293	R	78.6	Confident	74.9	Confident	6 Å²	6	57.8 Å²	57.8	2%	0.023	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-29.8	170.8	-66.1	168.7	178.5	168.8	3.8	111.8	V189 E216 F223 V261 S265 Q290 I291	V189-R293 HydrophobicContact CG1-CB 3.71Å; V189-R293 HydrophobicContact CG2-CB 4.31Å; E216-R293 IonicContact OE1-CZ 3.7Å; E216-R293 IonicContact OE1-NH1 3.54Å; E216-R293 IonicContact OE1-NH2 2.81Å; E216-R293 PolarHBondContact OE1-NH2 3.49Å; F223-R293 HydrophobicContact CE2-CG 4.31Å; V261-R293 HydrophobicContact CG1-CG 3.46Å; V261-R293 VanDerWaalsContact CG1-CG 3.46Å; V261-R293 HydrophobicContact CG2-CG 4.38Å; S265-R293 PolarHBondContact OG-NH2 2.92Å; Q290-R293 WeakPolarHBondContact O-CB 3.37Å; Q290-R293 WeakPolarHBondContact O-CD 3.24Å; Q290-R293 WeakPolarHBondContact O-CG 3.32Å; Q290-R293 PolarHBondContact O-N 3.25Å; I291-R293 PolarHBondContact O-N 3.18Å; I291-R293 VanDerWaalsContact O-N 3.1Å
294	M	79.6	Confident	75.8	Confident	97 Å²	97	61.4 Å²	61.4	48%	0.478	31%	0.307	S	S	.	.	H	α-helix	trans	-70	-40.2	176.8	-169.8	177.6	179.8	0	0	111.8	I291 L292 R296 M297	I291-M294 WeakPolarHBondContact O-CB 3.26Å; I291-M294 PolarHBondContact O-N 3.19Å; L292-M294 PolarHBondContact O-N 3.21Å; M294-R296 PolarHBondContact O-N 2.91Å; M294-M297 VanDerWaalsContact O-CB 3.3Å; M294-M297 WeakPolarHBondContact O-CB 3.33Å; M294-M297 WeakPolarHBondContact O-CG 3.26Å; M294-M297 PolarHBondContact O-N 3.34Å
295	I	79.3	Confident	76.7	Confident	79 Å²	79	60.1 Å²	60.1	41%	0.405	31%	0.305	S	S	.	.	H	α-helix	trans	-62	-32.7	-179	-57.5	-179.6	0	0	0	111.5	L292 M297 D298	L292-I295 HydrophobicContact CD2-CD1 3.68Å; L292-I295 PolarHBondContact O-N 2.7Å; L292-I295 VanDerWaalsContact O-N 3.14Å; I295-M297 PolarHBondContact O-N 3.35Å; I295-M297 VanDerWaalsContact O-N 3.16Å; I295-D298 PolarHBondContact O-N 2.68Å
296	R	78.5	Confident	77.5	Confident	10 Å²	10	61.6 Å²	61.6	4%	0.038	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25	175.2	169.1	177.4	124.1	126.8	8.8	113.7	F223 E226 R230 D258 M294 D298	F223-R296 VanDerWaalsContact CD1-NH2 3.31Å; F223-R296 VanDerWaalsContact CE1-NH2 3.27Å; E226-R296 VanDerWaalsContact CD-NH2 3.34Å; E226-R296 IonicContact OE1-NH2 3.42Å; E226-R296 IonicContact OE2-CZ 3.26Å; E226-R296 IonicContact OE2-NH1 2.71Å; E226-R296 IonicContact OE2-NH2 2.83Å; E226-R296 PolarHBondContact OE2-NH2 3.37Å; R230-R296 VanDerWaalsContact NH2-NH1 3.12Å; D258-R296 VanDerWaalsContact CG-NH1 3.3Å; D258-R296 WeakPolarHBondContact OD1-CD 3.36Å; D258-R296 IonicContact OD1-CZ 2.68Å; D258-R296 IonicContact OD1-NE 2.84Å; D258-R296 IonicContact OD1-NH1 3.57Å; D258-R296 PolarHBondContact OD1-NH1 2.83Å; D258-R296 IonicContact OD2-NH1 3.56Å; D258-R296 PolarHBondContact OD2-NH1 2.86Å; M294-R296 PolarHBondContact O-N 2.91Å; R296-D298 PolarHBondContact O-N 3.43Å
297	M	75	Confident	78.2	Confident	53 Å²	53	63.2 Å²	63.2	26%	0.261	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-30	-178.6	-62.1	-63.6	102.4	0	0	112	V185 F186 M294 I295 R299	V185-M297 HydrophobicContact CG1-CE 3.73Å; V185-M297 HydrophobicContact CG1-SD 4.12Å; F186-M297 HydrophobicContact CB-SD 4.12Å; F186-M297 HydrophobicContact CD2-CG 4.04Å; F186-M297 HydrophobicContact CD2-SD 4.47Å; M294-M297 VanDerWaalsContact O-CB 3.3Å; M294-M297 WeakPolarHBondContact O-CB 3.33Å; M294-M297 WeakPolarHBondContact O-CG 3.26Å; M294-M297 PolarHBondContact O-N 3.34Å; I295-M297 PolarHBondContact O-N 3.35Å; I295-M297 VanDerWaalsContact O-N 3.16Å; M297-R299 PolarHBondContact O-N 2.77Å
298	D	74.3	Confident	79.1	Confident	43 Å²	43	62.6 Å²	62.6	23%	0.23	32%	0.32	C	S	.	.	S	Bend	trans	-81.3	55.5	177.2	-147.6	-29.1	0	0	0	111.7	F254 I295 R296 R300 G301 G302 S303 F304	F254-D298 VanDerWaalsContact CE1-O 3.26Å; F254-D298 WeakPolarHBondContact CE1-O 3.41Å; F254-D298 WeakPolarHBondContact CZ-O 3.46Å; I295-D298 PolarHBondContact O-N 2.68Å; R296-D298 PolarHBondContact O-N 3.43Å; D298-R300 PolarHBondContact O-N 3.28Å; D298-G301 PolarHBondContact O-N 3.13Å; D298-G302 PolarHBondContact OD1-N 3.45Å; D298-S303 VanDerWaalsContact CG-OG 3.29Å; D298-S303 PolarHBondContact OD1-OG 3.13Å; D298-S303 WeakPolarHBondContact OD2-CB 3.35Å; D298-S303 PolarHBondContact OD2-OG 3.35Å; D298-F304 HydrophobicContact CB-CE2 4.28Å
299	R	71.3	Confident	79.9	Confident	32 Å²	32	58.6 Å²	58.6	12%	0.121	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-17.8	-158.6	-172.4	167	42.8	58.6	-17.8	116.6	L170 E171 H182 M297	L170-R299 VanDerWaalsContact O-CD 3.32Å; L170-R299 WeakPolarHBondContact O-CD 2.91Å; L170-R299 PolarHBondContact O-NE 2.73Å; L170-R299 PolarHBondContact O-NH2 2.86Å; L170-R299 VanDerWaalsContact O-NH2 3.12Å; E171-R299 VanDerWaalsContact CA-CZ 3.5Å; E171-R299 VanDerWaalsContact CD-NH1 3.34Å; E171-R299 PolarHBondContact O-NH1 2.91Å; E171-R299 IonicContact OE1-NH1 3.76Å; E171-R299 PolarHBondContact OE1-NH1 3.3Å; E171-R299 IonicContact OE2-NH1 2.66Å; E171-R299 PolarHBondContact OE2-NH1 2.56Å; H182-R299 PolarHBondContact CE1-NE 3.43Å; H182-R299 PolarHBondContact NE2-NH2 2.96Å; M297-R299 PolarHBondContact O-N 2.77Å
300	R	73.9	Confident	80.7	Confident	73 Å²	73	54.7 Å²	54.7	28%	0.275	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-6.8	172.3	-70.6	-164.3	-160.9	141.9	21.7	115.1	D38 E171 R172 D298 G302 K305	D38-R300 IonicContact OD1-CZ 4Å; D38-R300 IonicContact OD1-NH1 2.71Å; D38-R300 PolarHBondContact OD1-NH1 3.28Å; E171-R300 PolarHBondContact O-NE 2.79Å; E171-R300 PolarHBondContact O-NH2 2.77Å; E171-R300 WeakPolarHBondContact OE1-CG 3.37Å; E171-R300 IonicContact OE1-NE 3.62Å; R172-R300 VanDerWaalsContact CA-NH2 3.28Å; D298-R300 PolarHBondContact O-N 3.28Å; R300-G302 VanDerWaalsContact C-N 3.31Å; R300-K305 PolarHBondContact O-NZ 3.46Å
301	G	77.5	Confident	81.6	Confident	4 Å²	4	56 Å²	56	4%	0.041	30%	0.302	C	S	.	.			trans	58.7	42	-165.4	0	0	0	0	0	111.9	F254 D298 K305	F254-G301 VanDerWaalsContact CE2-N 3.26Å; F254-G301 VanDerWaalsContact CZ-CA 3.41Å; D298-G301 PolarHBondContact O-N 3.13Å; G301-K305 WeakPolarHBondContact O-CB 3.18Å; G301-K305 WeakPolarHBondContact O-CD 3.18Å; G301-K305 VanDerWaalsContact O-CG 3.27Å; G301-K305 WeakPolarHBondContact O-CG 3.17Å; G301-K305 PolarHBondContact O-N 3.03Å
302	G	80.3	Confident	82.3	Confident	30 Å²	30	57.5 Å²	57.5	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-49.2	180	0	0	0	0	0	110.4	D298 R300 K305 L306	D298-G302 PolarHBondContact OD1-N 3.45Å; R300-G302 VanDerWaalsContact C-N 3.31Å; G302-K305 PolarHBondContact O-N 2.96Å; G302-L306 WeakPolarHBondContact O-CB 3.39Å; G302-L306 PolarHBondContact O-N 3.06Å
303	S	83.6	Confident	82.7	Confident	70 Å²	70	58.6 Å²	58.6	49%	0.49	32%	0.318	S	S	.	.	H	α-helix	trans	-57.7	-49.5	175.6	-27.8	0	0	0	0	111.3	D298 K305 L306 L307	D298-S303 VanDerWaalsContact CG-OG 3.29Å; D298-S303 PolarHBondContact OD1-OG 3.13Å; D298-S303 WeakPolarHBondContact OD2-CB 3.35Å; D298-S303 PolarHBondContact OD2-OG 3.35Å; S303-K305 PolarHBondContact O-N 3.34Å; S303-L306 PolarHBondContact O-N 3.01Å; S303-L307 WeakPolarHBondContact O-CB 3.32Å; S303-L307 PolarHBondContact O-N 3.1Å
304	F	86	Confident	83.3	Confident	116 Å²	116	60 Å²	60	51%	0.509	33%	0.325	S	S	.	.	H	α-helix	trans	-60.8	-40.5	177.7	-72.8	-79.1	0	0	0	113.3	D298 A308	D298-F304 HydrophobicContact CB-CE2 4.28Å; F304-A308 WeakPolarHBondContact O-CB 3.47Å; F304-A308 PolarHBondContact O-N 3.02Å
305	K	85.6	Confident	83.8	Confident	111 Å²	111	60.5 Å²	60.5	48%	0.483	32%	0.322	S	S	.	.	H	α-helix	trans	-68.4	-39.7	174.5	-75.2	166.7	-177.7	153.7	0	112.5	R300 G301 G302 S303 S309	R300-K305 PolarHBondContact O-NZ 3.46Å; G301-K305 WeakPolarHBondContact O-CB 3.18Å; G301-K305 WeakPolarHBondContact O-CD 3.18Å; G301-K305 VanDerWaalsContact O-CG 3.27Å; G301-K305 WeakPolarHBondContact O-CG 3.17Å; G301-K305 PolarHBondContact O-N 3.03Å; G302-K305 PolarHBondContact O-N 2.96Å; S303-K305 PolarHBondContact O-N 3.34Å; K305-S309 WeakPolarHBondContact O-CB 3.38Å; K305-S309 PolarHBondContact O-N 3.45Å
306	L	86.8	Confident	84.1	Confident	81 Å²	81	63.3 Å²	63.3	42%	0.424	33%	0.333	S	S	.	.	H	α-helix	trans	-61	-51.5	178.3	-172	76	0	0	0	109.8	G302 S303 S309 V310 F439 K442	G302-L306 WeakPolarHBondContact O-CB 3.39Å; G302-L306 PolarHBondContact O-N 3.06Å; S303-L306 PolarHBondContact O-N 3.01Å; L306-S309 PolarHBondContact O-N 3.46Å; L306-V310 WeakPolarHBondContact O-CG2 3.46Å; L306-V310 PolarHBondContact O-N 3.36Å; L306-V310 VanDerWaalsContact O-N 3.15Å; L306-F439 HydrophobicContact CD2-CD1 4.12Å; L306-F439 HydrophobicContact CD2-CE1 3.89Å; L306-F439 HydrophobicContact CG-CD1 4.31Å; L306-F439 HydrophobicContact CG-CE1 3.93Å; L306-K442 HydrophobicContact CD1-CD 3.92Å; L306-K442 PolarHBondContact O-NZ 2.95Å; L306-K442 VanDerWaalsContact O-NZ 3.07Å
307	L	88.5	Confident	84.5	Confident	74 Å²	74	67.3 Å²	67.3	39%	0.387	35%	0.352	S	S	.	.	H	α-helix	trans	-58.9	-54.4	175.7	177.5	65.6	0	0	0	111.6	S303 S309 V310 V311 F439	S303-L307 WeakPolarHBondContact O-CB 3.32Å; S303-L307 PolarHBondContact O-N 3.1Å; L307-S309 VanDerWaalsContact C-N 3.27Å; L307-S309 PolarHBondContact O-N 3.39Å; L307-V310 PolarHBondContact O-N 2.78Å; L307-V311 HydrophobicContact CD1-CG2 4.01Å; L307-V311 HydrophobicContact CG-CG2 4.31Å; L307-V311 WeakPolarHBondContact O-CG2 3.01Å; L307-V311 PolarHBondContact O-N 3.28Å; L307-F439 HydrophobicContact CB-CZ 4.4Å; L307-F439 HydrophobicContact CD1-CE2 4.31Å; L307-F439 HydrophobicContact CD1-CZ 3.81Å
308	A	88.9	Confident	84.9	Confident	58 Å²	58	66.7 Å²	66.7	48%	0.479	35%	0.35	S	S	.	.	H	α-helix	trans	-57	-39.6	-178.5	0	0	0	0	0	112.3	F304 W312	F304-A308 WeakPolarHBondContact O-CB 3.47Å; F304-A308 PolarHBondContact O-N 3.02Å; A308-W312 WeakPolarHBondContact O-CB 3.36Å; A308-W312 PolarHBondContact O-N 3.28Å
309	S	88	Confident	85.4	Confident	59 Å²	59	71.5 Å²	71.5	41%	0.413	37%	0.369	S	S	.	.	H	α-helix	trans	-74.9	-25.5	177.1	154.2	0	0	0	0	113.8	K305 L306 L307 A313 K442	K305-S309 WeakPolarHBondContact O-CB 3.38Å; K305-S309 PolarHBondContact O-N 3.45Å; L306-S309 PolarHBondContact O-N 3.46Å; L307-S309 VanDerWaalsContact C-N 3.27Å; L307-S309 PolarHBondContact O-N 3.39Å; S309-A313 WeakPolarHBondContact O-CB 3.34Å; S309-A313 PolarHBondContact O-N 2.9Å; S309-K442 PolarHBondContact OG-NZ 3.02Å
310	V	90.1	Very high	85.9	Confident	3 Å²	3	73 Å²	73	2%	0.018	38%	0.381	C	S	.	.	H	α-helix	trans	-73.4	-47.7	170.1	172.3	0	0	0	0	110.2	L306 L307 W312 A313 H314 L435 F439 K442	L306-V310 WeakPolarHBondContact O-CG2 3.46Å; L306-V310 PolarHBondContact O-N 3.36Å; L306-V310 VanDerWaalsContact O-N 3.15Å; L307-V310 PolarHBondContact O-N 2.78Å; V310-W312 VanDerWaalsContact C-N 3.28Å; V310-W312 PolarHBondContact O-N 3.29Å; V310-A313 PolarHBondContact O-N 3.44Å; V310-H314 PolarHBondContact O-CD2 3.43Å; V310-H314 PolarHBondContact O-N 3.41Å; V310-L435 HydrophobicContact CG1-CD2 4.06Å; V310-F439 HydrophobicContact CB-CE1 4.37Å; V310-F439 HydrophobicContact CB-CZ 4.45Å; V310-F439 HydrophobicContact CG1-CD2 4.45Å; V310-F439 HydrophobicContact CG1-CE2 4.46Å; V310-F439 HydrophobicContact CG2-CD1 3.81Å; V310-F439 HydrophobicContact CG2-CE1 3.87Å; V310-F439 HydrophobicContact CG2-CG 4.31Å; V310-F439 HydrophobicContact CG2-CZ 4.43Å; V310-K442 HydrophobicContact CG2-CD 3.6Å
311	V	90.2	Very high	86	Confident	49 Å²	49	70.3 Å²	70.3	30%	0.297	37%	0.373	S	S	.	.	H	α-helix	trans	-57.8	-40.8	175	171.3	0	0	0	0	111.4	L307 H314 R315 L318 L435	L307-V311 HydrophobicContact CD1-CG2 4.01Å; L307-V311 HydrophobicContact CG-CG2 4.31Å; L307-V311 WeakPolarHBondContact O-CG2 3.01Å; L307-V311 PolarHBondContact O-N 3.28Å; V311-H314 CarbonylContact O-C 3.6Å; V311-H314 PolarHBondContact O-N 2.89Å; V311-R315 VanDerWaalsContact O-CA 3.26Å; V311-R315 WeakPolarHBondContact O-CA 3.26Å; V311-R315 WeakPolarHBondContact O-CB 3.36Å; V311-R315 PolarHBondContact O-N 2.93Å; V311-L318 HydrophobicContact CG1-CD2 3.88Å; V311-L435 HydrophobicContact CG2-CD2 4Å
312	W	92.8	Very high	86.1	Confident	113 Å²	113	74.4 Å²	74.4	43%	0.428	40%	0.397	S	S	.	.	H	α-helix	trans	-67.8	-38.9	177.5	-177.3	-97.4	0	0	0	113.5	A308 V310 R315 L1034 D1035	A308-W312 WeakPolarHBondContact O-CB 3.36Å; A308-W312 PolarHBondContact O-N 3.28Å; V310-W312 VanDerWaalsContact C-N 3.28Å; V310-W312 PolarHBondContact O-N 3.29Å; W312-R315 WeakPolarHBondContact O-CB 3.27Å; W312-R315 WeakPolarHBondContact O-CD 3.2Å; W312-R315 WeakPolarHBondContact O-CG 3.37Å; W312-R315 PolarHBondContact O-NH1 2.83Å; W312-L1034 HydrophobicContact CH2-CD2 4.48Å; W312-D1035 HydrophobicContact CZ2-CB 4.13Å; W312-D1035 PolarHBondContact NE1-OD2 2.88Å
313	A	89.1	Confident	86.2	Confident	69 Å²	69	79.9 Å²	79.9	57%	0.57	41%	0.41	S	S	*	.	H	α-helix	trans	-64.1	-42.7	175.8	0	0	0	0	0	111.4	S309 V310	S309-A313 WeakPolarHBondContact O-CB 3.34Å; S309-A313 PolarHBondContact O-N 2.9Å; V310-A313 PolarHBondContact O-N 3.44Å
314	H	89.2	Confident	86	Confident	35 Å²	35	79.7 Å²	79.7	16%	0.162	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	20	-178.8	-66	-83.5	0	0	0	113.8	V310 V311 Q316 E317 L318 I434 G438	V310-H314 PolarHBondContact O-CD2 3.43Å; V310-H314 PolarHBondContact O-N 3.41Å; V311-H314 CarbonylContact O-C 3.6Å; V311-H314 PolarHBondContact O-N 2.89Å; H314-Q316 VanDerWaalsContact C-N 3.29Å; H314-Q316 PolarHBondContact O-N 3.23Å; H314-E317 IonicContact CE1-OE2 2.75Å; H314-E317 IonicContact CG-OE2 3.4Å; H314-E317 IonicContact ND1-OE2 3.21Å; H314-E317 PolarHBondContact ND1-OE2 3.3Å; H314-E317 PolarHBondContact O-N 3.44Å; H314-L318 PolarHBondContact O-N 3.45Å; H314-I434 HydrophobicContact CB-CG2 3.54Å; H314-G438 WeakPolarHBondContact NE2-CA 3.49Å
315	R	90.9	Very high	85.6	Confident	109 Å²	109	74.3 Å²	74.3	41%	0.411	38%	0.38	S	S	.	.	H	α-helix	trans	-59.3	-37.1	-170.6	70.2	-174.1	179.1	-79.8	-1	113.5	V311 W312 L318 F319	V311-R315 VanDerWaalsContact O-CA 3.26Å; V311-R315 WeakPolarHBondContact O-CA 3.26Å; V311-R315 WeakPolarHBondContact O-CB 3.36Å; V311-R315 PolarHBondContact O-N 2.93Å; W312-R315 WeakPolarHBondContact O-CB 3.27Å; W312-R315 WeakPolarHBondContact O-CD 3.2Å; W312-R315 WeakPolarHBondContact O-CG 3.37Å; W312-R315 PolarHBondContact O-NH1 2.83Å; R315-L318 PolarHBondContact O-N 2.79Å; R315-F319 HydrophobicContact CB-CD2 4.21Å; R315-F319 HydrophobicContact CB-CE2 4.21Å; R315-F319 WeakPolarHBondContact O-CB 3.24Å; R315-F319 WeakPolarHBondContact O-CD2 3.28Å; R315-F319 WeakPolarHBondContact O-CG 3.41Å; R315-F319 PolarHBondContact O-N 3.45Å
316	Q	86.8	Confident	85.5	Confident	138 Å²	138	74.8 Å²	74.8	65%	0.645	38%	0.382	S	S	*	.	H	α-helix	trans	-65.5	-49.1	-178.6	-173.6	64.8	18.5	0	0	110.8	H314 L318 F319 T320	H314-Q316 VanDerWaalsContact C-N 3.29Å; H314-Q316 PolarHBondContact O-N 3.23Å; Q316-L318 VanDerWaalsContact C-N 3.32Å; Q316-L318 PolarHBondContact O-N 2.74Å; Q316-F319 PolarHBondContact O-N 3.29Å; Q316-T320 WeakPolarHBondContact O-CB 3.48Å; Q316-T320 PolarHBondContact O-N 2.68Å; Q316-T320 PolarHBondContact O-OG1 3.09Å; Q316-T320 VanDerWaalsContact O-OG1 3.09Å
317	E	85.9	Confident	85.3	Confident	94 Å²	94	74.8 Å²	74.8	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-63	-40.4	179.7	-53.9	167	165.5	0	0	110.8	H314 T321 I434	H314-E317 IonicContact CE1-OE2 2.75Å; H314-E317 IonicContact CG-OE2 3.4Å; H314-E317 IonicContact ND1-OE2 3.21Å; H314-E317 PolarHBondContact ND1-OE2 3.3Å; H314-E317 PolarHBondContact O-N 3.44Å; E317-T321 WeakPolarHBondContact O-CG2 3.4Å; E317-T321 PolarHBondContact O-N 3.21Å; E317-T321 VanDerWaalsContact O-N 3.08Å; E317-T321 PolarHBondContact O-OG1 2.87Å; E317-I434 HydrophobicContact CB-CD1 3.81Å; E317-I434 HydrophobicContact CB-CG2 4.45Å; E317-I434 WeakPolarHBondContact OE2-CG2 3.47Å
318	L	83.1	Confident	84.9	Confident	40 Å²	40	72.3 Å²	72.3	21%	0.209	38%	0.375	C	S	.	.	H	α-helix	trans	-70.6	-40.4	177.1	-168.9	67.6	0	0	0	113	V311 H314 R315 Q316 T321 V322	V311-L318 HydrophobicContact CG1-CD2 3.88Å; H314-L318 PolarHBondContact O-N 3.45Å; R315-L318 PolarHBondContact O-N 2.79Å; Q316-L318 VanDerWaalsContact C-N 3.32Å; Q316-L318 PolarHBondContact O-N 2.74Å; L318-T321 WeakPolarHBondContact CA-OG1 3.35Å; L318-T321 PolarHBondContact O-OG1 3.34Å; L318-V322 WeakPolarHBondContact O-CB 3.48Å; L318-V322 WeakPolarHBondContact O-CG2 3.26Å; L318-V322 PolarHBondContact O-N 2.85Å
319	F	85	Confident	84.7	Confident	143 Å²	143	70.1 Å²	70.1	63%	0.627	36%	0.355	S	S	*	.	H	α-helix	trans	-68.9	-42.2	175.9	-80.7	-55.9	0	0	0	111.9	R315 Q316 T321 V322 Y323	R315-F319 HydrophobicContact CB-CD2 4.21Å; R315-F319 HydrophobicContact CB-CE2 4.21Å; R315-F319 WeakPolarHBondContact O-CB 3.24Å; R315-F319 WeakPolarHBondContact O-CD2 3.28Å; R315-F319 WeakPolarHBondContact O-CG 3.41Å; R315-F319 PolarHBondContact O-N 3.45Å; Q316-F319 PolarHBondContact O-N 3.29Å; F319-T321 VanDerWaalsContact C-N 3.32Å; F319-T321 PolarHBondContact O-N 3.18Å; F319-V322 PolarHBondContact O-N 3.24Å; F319-Y323 WeakPolarHBondContact O-CB 3.31Å; F319-Y323 PolarHBondContact O-N 3.12Å
320	T	81.6	Confident	84.7	Confident	63 Å²	63	70 Å²	70	39%	0.387	35%	0.349	S	S	.	.	H	α-helix	trans	-59.7	-43.3	175.8	-65.4	0	0	0	0	111.3	Q316 I324	Q316-T320 WeakPolarHBondContact O-CB 3.48Å; Q316-T320 PolarHBondContact O-N 2.68Å; Q316-T320 PolarHBondContact O-OG1 3.09Å; Q316-T320 VanDerWaalsContact O-OG1 3.09Å; T320-I324 HydrophobicContact CG2-CD1 3.78Å; T320-I324 WeakPolarHBondContact O-CG1 3.43Å; T320-I324 PolarHBondContact O-N 2.89Å; T320-I324 VanDerWaalsContact O-N 3.1Å
321	T	76.4	Confident	84.5	Confident	17 Å²	17	76.4 Å²	76.4	10%	0.104	38%	0.377	C	S	.	.	H	α-helix	trans	-63.8	-58.1	174.4	47.1	0	0	0	0	110.9	E317 L318 F319 Y323 I324 G325 Y391 P431	E317-T321 WeakPolarHBondContact O-CG2 3.4Å; E317-T321 PolarHBondContact O-N 3.21Å; E317-T321 VanDerWaalsContact O-N 3.08Å; E317-T321 PolarHBondContact O-OG1 2.87Å; L318-T321 WeakPolarHBondContact CA-OG1 3.35Å; L318-T321 PolarHBondContact O-OG1 3.34Å; F319-T321 VanDerWaalsContact C-N 3.32Å; F319-T321 PolarHBondContact O-N 3.18Å; T321-Y323 PolarHBondContact O-N 2.91Å; T321-Y323 VanDerWaalsContact O-N 3.12Å; T321-I324 PolarHBondContact O-N 2.8Å; T321-G325 PolarHBondContact O-N 2.81Å; T321-G325 VanDerWaalsContact O-N 3.1Å; T321-Y391 WeakPolarHBondContact O-CE1 3.29Å; T321-Y391 PolarHBondContact O-OH 2.9Å; T321-P431 HydrophobicContact CG2-CG 4.25Å
322	V	79.7	Confident	84.2	Confident	91 Å²	91	74.2 Å²	74.2	55%	0.552	36%	0.364	S	S	*	.	H	α-helix	trans	-54.1	-38.3	-179.7	172.6	0	0	0	0	112.8	L318 F319 F326	L318-V322 WeakPolarHBondContact O-CB 3.48Å; L318-V322 WeakPolarHBondContact O-CG2 3.26Å; L318-V322 PolarHBondContact O-N 2.85Å; F319-V322 PolarHBondContact O-N 3.24Å; V322-F326 WeakPolarHBondContact O-CB 3.29Å; V322-F326 PolarHBondContact O-N 2.91Å
323	Y	82.8	Confident	83.9	Confident	145 Å²	145	68.8 Å²	68.8	57%	0.569	34%	0.344	S	S	*	.	H	α-helix	trans	-65.4	-51.1	178.3	177.3	-105.5	0	0	0	113.5	F319 T321 G325 F326 L327	F319-Y323 WeakPolarHBondContact O-CB 3.31Å; F319-Y323 PolarHBondContact O-N 3.12Å; T321-Y323 PolarHBondContact O-N 2.91Å; T321-Y323 VanDerWaalsContact O-N 3.12Å; Y323-G325 PolarHBondContact O-N 3.12Å; Y323-F326 PolarHBondContact O-N 3.42Å; Y323-L327 HydrophobicContact CD1-CD1 4.13Å; Y323-L327 HydrophobicContact CE1-CD1 3.5Å; Y323-L327 VanDerWaalsContact CE1-CD1 3.5Å; Y323-L327 HydrophobicContact CE1-CG 4.32Å; Y323-L327 HydrophobicContact CE2-CD1 4.31Å; Y323-L327 HydrophobicContact CE2-CG 4.38Å; Y323-L327 PolarHBondContact O-N 2.91Å
324	I	79.8	Confident	84	Confident	65 Å²	65	70.1 Å²	70.1	33%	0.333	34%	0.336	S	S	.	.	H	α-helix	trans	-63	-34.3	179.6	-69.4	167.2	0	0	0	110.5	T320 T321 L327 G328 F390 Y391	T320-I324 HydrophobicContact CG2-CD1 3.78Å; T320-I324 WeakPolarHBondContact O-CG1 3.43Å; T320-I324 PolarHBondContact O-N 2.89Å; T320-I324 VanDerWaalsContact O-N 3.1Å; T321-I324 PolarHBondContact O-N 2.8Å; I324-L327 PolarHBondContact O-N 3.29Å; I324-G328 PolarHBondContact O-N 2.89Å; I324-F390 HydrophobicContact CG2-CD1 4.04Å; I324-F390 HydrophobicContact CG2-CE1 4.24Å; I324-Y391 WeakPolarHBondContact CB-OH 3.33Å; I324-Y391 HydrophobicContact CG2-CE2 4.25Å; I324-Y391 WeakPolarHBondContact CG2-OH 3.39Å
325	G	76.6	Confident	83.9	Confident	4 Å²	4	70.8 Å²	70.8	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-71	-38.8	177.3	0	0	0	0	0	113.6	T321 Y323 G328 L329 Y391	T321-G325 PolarHBondContact O-N 2.81Å; T321-G325 VanDerWaalsContact O-N 3.1Å; Y323-G325 PolarHBondContact O-N 3.12Å; G325-G328 PolarHBondContact O-N 3Å; G325-L329 WeakPolarHBondContact O-CB 3.16Å; G325-L329 PolarHBondContact O-N 3.21Å; G325-Y391 VanDerWaalsContact CA-CD2 3.41Å; G325-Y391 PolarHBondContact N-OH 3.46Å; G325-Y391 VanDerWaalsContact N-OH 3.13Å
326	F	82.8	Confident	83.9	Confident	121 Å²	121	65.6 Å²	65.6	53%	0.531	32%	0.321	S	S	.	.	H	α-helix	trans	-63.8	-42.8	172.8	-173.9	-108.4	0	0	0	111.9	V322 Y323 L329 L330	V322-F326 WeakPolarHBondContact O-CB 3.29Å; V322-F326 PolarHBondContact O-N 2.91Å; Y323-F326 PolarHBondContact O-N 3.42Å; F326-L329 PolarHBondContact O-N 3.15Å; F326-L330 HydrophobicContact CD1-CD1 3.97Å; F326-L330 HydrophobicContact CE1-CD1 3.5Å; F326-L330 VanDerWaalsContact CE1-CD1 3.5Å; F326-L330 HydrophobicContact CE1-CG 4.24Å; F326-L330 HydrophobicContact CZ-CD1 3.84Å; F326-L330 HydrophobicContact CZ-CD2 4.35Å; F326-L330 HydrophobicContact CZ-CG 4.23Å; F326-L330 WeakPolarHBondContact O-CG 3.32Å; F326-L330 PolarHBondContact O-N 3.49Å
327	L	83.3	Confident	84.1	Confident	80 Å²	80	60.4 Å²	60.4	42%	0.419	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-47.2	174	-73.2	-178.3	0	0	0	112.5	Y323 I324 L329 L330 F331	Y323-L327 HydrophobicContact CD1-CD1 4.13Å; Y323-L327 HydrophobicContact CE1-CD1 3.5Å; Y323-L327 VanDerWaalsContact CE1-CD1 3.5Å; Y323-L327 HydrophobicContact CE1-CG 4.32Å; Y323-L327 HydrophobicContact CE2-CD1 4.31Å; Y323-L327 HydrophobicContact CE2-CG 4.38Å; Y323-L327 PolarHBondContact O-N 2.91Å; I324-L327 PolarHBondContact O-N 3.29Å; L327-L329 VanDerWaalsContact C-N 3.34Å; L327-L329 PolarHBondContact O-N 3.5Å; L327-L330 PolarHBondContact O-N 3.31Å; L327-F331 WeakPolarHBondContact O-CB 3.3Å; L327-F331 PolarHBondContact O-N 2.85Å
328	G	80	Confident	84.3	Confident	23 Å²	23	60.8 Å²	60.8	24%	0.237	30%	0.301	C	S	.	.	H	α-helix	trans	-57.8	-46.8	177.3	0	0	0	0	0	112	I324 G325 F331 S332 I387	I324-G328 PolarHBondContact O-N 2.89Å; G325-G328 PolarHBondContact O-N 3Å; G328-F331 PolarHBondContact O-N 2.89Å; G328-S332 WeakPolarHBondContact O-CB 3.47Å; G328-S332 PolarHBondContact O-N 3.07Å; G328-I387 WeakPolarHBondContact O-CD1 3.41Å
329	L	84.1	Confident	84.7	Confident	11 Å²	11	60.4 Å²	60.4	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-48.5	176.6	173.5	138.1	0	0	0	112.6	G325 F326 L327 F331 S333 L354 V358 L361	G325-L329 WeakPolarHBondContact O-CB 3.16Å; G325-L329 PolarHBondContact O-N 3.21Å; F326-L329 PolarHBondContact O-N 3.15Å; L327-L329 VanDerWaalsContact C-N 3.34Å; L327-L329 PolarHBondContact O-N 3.5Å; L329-F331 VanDerWaalsContact C-N 3.32Å; L329-F331 PolarHBondContact O-N 3.24Å; L329-S333 VanDerWaalsContact O-CB 3.26Å; L329-S333 WeakPolarHBondContact O-CB 2.85Å; L329-S333 PolarHBondContact O-N 2.86Å; L329-S333 PolarHBondContact O-OG 3.01Å; L329-L354 HydrophobicContact CD2-CD1 3.52Å; L329-L354 HydrophobicContact CG-CD1 4.47Å; L329-V358 HydrophobicContact CD1-CB 4.31Å; L329-V358 HydrophobicContact CD1-CG2 3.69Å; L329-L361 HydrophobicContact CB-CD2 4.2Å; L329-L361 HydrophobicContact CD1-CB 3.97Å; L329-L361 HydrophobicContact CD1-CD2 3.36Å; L329-L361 HydrophobicContact CD1-CG 4.27Å; L329-L361 HydrophobicContact CG-CD2 4.4Å
330	L	89.5	Confident	84.9	Confident	56 Å²	56	53.6 Å²	53.6	29%	0.293	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-42.7	179.5	-72.8	178.5	0	0	0	111.7	F326 L327 F334 Y350 L354	F326-L330 HydrophobicContact CD1-CD1 3.97Å; F326-L330 HydrophobicContact CE1-CD1 3.5Å; F326-L330 VanDerWaalsContact CE1-CD1 3.5Å; F326-L330 HydrophobicContact CE1-CG 4.24Å; F326-L330 HydrophobicContact CZ-CD1 3.84Å; F326-L330 HydrophobicContact CZ-CD2 4.35Å; F326-L330 HydrophobicContact CZ-CG 4.23Å; F326-L330 WeakPolarHBondContact O-CG 3.32Å; F326-L330 PolarHBondContact O-N 3.49Å; L327-L330 PolarHBondContact O-N 3.31Å; L330-F334 WeakPolarHBondContact O-CB 3.36Å; L330-F334 PolarHBondContact O-N 3.23Å; L330-F334 VanDerWaalsContact O-N 3.07Å; L330-Y350 WeakPolarHBondContact CD2-OH 3.31Å; L330-Y350 PolarHBondContact O-OH 3.12Å; L330-L354 HydrophobicContact CD2-CD1 4.15Å
331	F	85.5	Confident	85.3	Confident	138 Å²	138	56.2 Å²	56.2	61%	0.605	28%	0.277	S	S	*	.	H	α-helix	trans	-68	-47.5	-179.3	-173.2	-107.9	0	0	0	112.3	L327 G328 L329 F334 L335	L327-F331 WeakPolarHBondContact O-CB 3.3Å; L327-F331 PolarHBondContact O-N 2.85Å; G328-F331 PolarHBondContact O-N 2.89Å; L329-F331 VanDerWaalsContact C-N 3.32Å; L329-F331 PolarHBondContact O-N 3.24Å; F331-F334 PolarHBondContact O-N 3.36Å; F331-L335 HydrophobicContact CD1-CD1 3.99Å; F331-L335 HydrophobicContact CD1-CG 4.49Å; F331-L335 HydrophobicContact CE1-CD1 3.52Å; F331-L335 HydrophobicContact CE1-CG 4.22Å; F331-L335 HydrophobicContact CZ-CD1 3.95Å; F331-L335 HydrophobicContact CZ-CD2 4.42Å; F331-L335 HydrophobicContact CZ-CG 4.31Å; F331-L335 WeakPolarHBondContact O-CG 3.4Å; F331-L335 PolarHBondContact O-N 2.99Å
332	S	82.8	Confident	85.8	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-61.7	-46.4	176.4	171	0	0	0	0	112.5	G328 F334 L335 I336 W356 S383 I387	G328-S332 WeakPolarHBondContact O-CB 3.47Å; G328-S332 PolarHBondContact O-N 3.07Å; S332-F334 PolarHBondContact O-N 2.89Å; S332-L335 PolarHBondContact O-N 3.26Å; S332-I336 PolarHBondContact O-N 2.86Å; S332-W356 WeakPolarHBondContact OG-CZ3 3.4Å; S332-S383 VanDerWaalsContact OG-CB 3.25Å; S332-S383 WeakPolarHBondContact OG-CB 3.41Å; S332-S383 PolarHBondContact OG-OG 2.89Å; S332-I387 VanDerWaalsContact CB-CD1 3.41Å
333	S	88	Confident	85.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.9	-36.4	177.2	-53.5	0	0	0	0	111.2	L329 F337 A353	L329-S333 VanDerWaalsContact O-CB 3.26Å; L329-S333 WeakPolarHBondContact O-CB 2.85Å; L329-S333 PolarHBondContact O-N 2.86Å; L329-S333 PolarHBondContact O-OG 3.01Å; S333-F337 VanDerWaalsContact O-CB 3.26Å; S333-F337 WeakPolarHBondContact O-CB 3.4Å; S333-F337 PolarHBondContact O-N 3.25Å; S333-A353 VanDerWaalsContact O-CB 3.29Å; S333-A353 WeakPolarHBondContact O-CB 3.35Å
334	F	90.2	Very high	86	Confident	96 Å²	96	60.2 Å²	60.2	42%	0.421	29%	0.29	S	S	.	.	H	α-helix	trans	-70.6	-43.6	176.3	-174.9	-109.3	0	0	0	112.7	L330 F331 S332 F337 L338 Y350	L330-F334 WeakPolarHBondContact O-CB 3.36Å; L330-F334 PolarHBondContact O-N 3.23Å; L330-F334 VanDerWaalsContact O-N 3.07Å; F331-F334 PolarHBondContact O-N 3.36Å; S332-F334 PolarHBondContact O-N 2.89Å; F334-F337 PolarHBondContact O-N 3.01Å; F334-L338 HydrophobicContact CD1-CD1 4.05Å; F334-L338 HydrophobicContact CD1-CG 4.44Å; F334-L338 HydrophobicContact CE1-CD1 3.52Å; F334-L338 HydrophobicContact CE1-CG 4.09Å; F334-L338 HydrophobicContact CE2-CD2 4.37Å; F334-L338 HydrophobicContact CE2-CG 4.39Å; F334-L338 HydrophobicContact CZ-CD1 3.85Å; F334-L338 HydrophobicContact CZ-CD2 4.09Å; F334-L338 HydrophobicContact CZ-CG 4.06Å; F334-L338 WeakPolarHBondContact O-CG 3.07Å; F334-L338 PolarHBondContact O-N 3.48Å; F334-Y350 HydrophobicContact CB-CE2 3.94Å; F334-Y350 HydrophobicContact CD2-CD2 4.36Å; F334-Y350 HydrophobicContact CD2-CE2 4.19Å
335	L	88.1	Confident	86.5	Confident	49 Å²	49	66.2 Å²	66.2	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-44.5	176.2	-69.7	-178.6	0	0	0	112.1	F331 S332 L338 V339 I379	F331-L335 HydrophobicContact CD1-CD1 3.99Å; F331-L335 HydrophobicContact CD1-CG 4.49Å; F331-L335 HydrophobicContact CE1-CD1 3.52Å; F331-L335 HydrophobicContact CE1-CG 4.22Å; F331-L335 HydrophobicContact CZ-CD1 3.95Å; F331-L335 HydrophobicContact CZ-CD2 4.42Å; F331-L335 HydrophobicContact CZ-CG 4.31Å; F331-L335 WeakPolarHBondContact O-CG 3.4Å; F331-L335 PolarHBondContact O-N 2.99Å; S332-L335 PolarHBondContact O-N 3.26Å; L335-L338 PolarHBondContact O-N 2.78Å; L335-V339 WeakPolarHBondContact O-CG2 3.42Å; L335-V339 PolarHBondContact O-N 2.85Å; L335-I379 HydrophobicContact CB-CD1 4.4Å; L335-I379 HydrophobicContact CB-CG2 3.79Å; L335-I379 HydrophobicContact CD1-CG2 4.21Å
336	I	89.9	Confident	87	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66	-40	176.4	-71.5	-55.3	0	0	0	111.6	S332 L338 V339 E340 I347 W356 G376 I379 A380	S332-I336 PolarHBondContact O-N 2.86Å; I336-L338 PolarHBondContact O-N 2.98Å; I336-V339 PolarHBondContact O-N 3.48Å; I336-E340 HydrophobicContact CG2-CB 4.49Å; I336-E340 HydrophobicContact CG2-CG 4.01Å; I336-E340 VanDerWaalsContact O-CB 3.32Å; I336-E340 WeakPolarHBondContact O-CB 3.1Å; I336-E340 PolarHBondContact O-N 3.17Å; I336-I347 HydrophobicContact CG2-CD1 4.01Å; I336-W356 HydrophobicContact CB-CE3 4.06Å; I336-W356 HydrophobicContact CB-CZ3 3.91Å; I336-W356 HydrophobicContact CD1-CH2 4.47Å; I336-W356 HydrophobicContact CG1-CE3 4.02Å; I336-W356 HydrophobicContact CG1-CH2 3.65Å; I336-W356 HydrophobicContact CG1-CZ2 4.4Å; I336-W356 HydrophobicContact CG1-CZ3 3.42Å; I336-W356 VanDerWaalsContact CG1-CZ3 3.42Å; I336-W356 HydrophobicContact CG2-CD2 4.29Å; I336-W356 HydrophobicContact CG2-CE3 3.89Å; I336-W356 HydrophobicContact CG2-CZ3 4.2Å; I336-G376 VanDerWaalsContact CD1-O 3.27Å; I336-G376 WeakPolarHBondContact CD1-O 3.45Å; I336-I379 HydrophobicContact CD1-CB 3.96Å; I336-I379 HydrophobicContact CD1-CG2 3.62Å; I336-I379 HydrophobicContact CG1-CG2 4.11Å; I336-A380 HydrophobicContact CD1-CB 4.09Å
337	F	91.4	Very high	87.4	Confident	30 Å²	30	65.3 Å²	65.3	13%	0.132	31%	0.312	C	S	.	.	H	α-helix	trans	-57.1	-46.8	171.6	173.9	-114.9	0	0	0	112.4	S333 F334 V339 K341 T349 Y350 A353	S333-F337 VanDerWaalsContact O-CB 3.26Å; S333-F337 WeakPolarHBondContact O-CB 3.4Å; S333-F337 PolarHBondContact O-N 3.25Å; F334-F337 PolarHBondContact O-N 3.01Å; F337-V339 VanDerWaalsContact C-N 3.26Å; F337-V339 PolarHBondContact O-N 2.78Å; F337-K341 HydrophobicContact CD2-CB 4.36Å; F337-K341 HydrophobicContact CE1-CD 4.37Å; F337-K341 HydrophobicContact CE2-CB 4.26Å; F337-K341 HydrophobicContact CE2-CD 3.76Å; F337-K341 HydrophobicContact CE2-CG 4.16Å; F337-K341 HydrophobicContact CZ-CD 3.68Å; F337-K341 WeakPolarHBondContact O-CB 3.48Å; F337-K341 PolarHBondContact O-N 2.75Å; F337-T349 VanDerWaalsContact CD2-C 3.47Å; F337-Y350 HydrophobicContact CB-CD2 4.18Å; F337-Y350 HydrophobicContact CD1-CD2 4.29Å; F337-Y350 VanDerWaalsContact CE2-N 3.34Å; F337-Y350 HydrophobicContact CG-CD2 4.27Å; F337-A353 HydrophobicContact CB-CB 3.65Å
338	L	90.9	Very high	87.6	Confident	102 Å²	102	70.1 Å²	70.1	53%	0.534	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-34.1	-178.8	-74.2	-177.7	0	0	0	113.2	F334 L335 I336	F334-L338 HydrophobicContact CD1-CD1 4.05Å; F334-L338 HydrophobicContact CD1-CG 4.44Å; F334-L338 HydrophobicContact CE1-CD1 3.52Å; F334-L338 HydrophobicContact CE1-CG 4.09Å; F334-L338 HydrophobicContact CE2-CD2 4.37Å; F334-L338 HydrophobicContact CE2-CG 4.39Å; F334-L338 HydrophobicContact CZ-CD1 3.85Å; F334-L338 HydrophobicContact CZ-CD2 4.09Å; F334-L338 HydrophobicContact CZ-CG 4.06Å; F334-L338 WeakPolarHBondContact O-CG 3.07Å; F334-L338 PolarHBondContact O-N 3.48Å; L335-L338 PolarHBondContact O-N 2.78Å; I336-L338 PolarHBondContact O-N 2.98Å
339	V	90.6	Very high	88.2	Confident	32 Å²	32	71.4 Å²	71.4	19%	0.194	33%	0.327	C	S	.	.	H	α-helix	trans	-87.8	-48.1	-175.6	174.4	0	0	0	0	111.8	L335 I336 F337 S373 L375 I379	L335-V339 WeakPolarHBondContact O-CG2 3.42Å; L335-V339 PolarHBondContact O-N 2.85Å; I336-V339 PolarHBondContact O-N 3.48Å; F337-V339 VanDerWaalsContact C-N 3.26Å; F337-V339 PolarHBondContact O-N 2.78Å; V339-S373 VanDerWaalsContact CG1-OG 3.3Å; V339-S373 WeakPolarHBondContact CG1-OG 3.45Å; V339-L375 HydrophobicContact CB-CD2 4.27Å; V339-L375 HydrophobicContact CG1-CB 4.39Å; V339-L375 HydrophobicContact CG1-CD2 3.75Å; V339-L375 HydrophobicContact CG2-CD2 3.47Å; V339-L375 VanDerWaalsContact CG2-CD2 3.47Å; V339-I379 HydrophobicContact CG2-CD1 3.97Å
340	E	90	Very high	88.7	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-82.4	-19.6	-171.5	-66.9	-72.7	138.5	0	0	113.6	I336 K342 E343 N344 I347 P371 Q372 S373	I336-E340 HydrophobicContact CG2-CB 4.49Å; I336-E340 HydrophobicContact CG2-CG 4.01Å; I336-E340 VanDerWaalsContact O-CB 3.32Å; I336-E340 WeakPolarHBondContact O-CB 3.1Å; I336-E340 PolarHBondContact O-N 3.17Å; E340-K342 PolarHBondContact O-N 3.44Å; E340-E343 PolarHBondContact O-N 3.5Å; E340-N344 HydrophobicContact CB-CB 4.1Å; E340-N344 WeakPolarHBondContact O-CB 3.09Å; E340-N344 PolarHBondContact O-N 3.03Å; E340-N344 WeakPolarHBondContact OE2-CB 3.17Å; E340-N344 PolarHBondContact OE2-ND2 2.87Å; E340-I347 HydrophobicContact CB-CB 3.99Å; E340-I347 HydrophobicContact CB-CD1 3.98Å; E340-I347 HydrophobicContact CB-CG1 4.48Å; E340-I347 HydrophobicContact CB-CG2 4.15Å; E340-I347 HydrophobicContact CG-CD1 4.1Å; E340-P371 VanDerWaalsContact CD-CA 3.4Å; E340-P371 HydrophobicContact CG-CB 3.99Å; E340-P371 WeakPolarHBondContact OE1-CB 3.18Å; E340-P371 VanDerWaalsContact OE2-CA 3.28Å; E340-P371 WeakPolarHBondContact OE2-CA 3.3Å; E340-Q372 VanDerWaalsContact CD-N 3.34Å; E340-Q372 PolarHBondContact OE1-N 2.91Å; E340-Q372 PolarHBondContact OE2-N 3.03Å; E340-S373 VanDerWaalsContact OE1-CB 3.24Å; E340-S373 WeakPolarHBondContact OE1-CB 3.26Å; E340-S373 PolarHBondContact OE1-N 3Å; E340-S373 PolarHBondContact OE1-OG 2.84Å
341	K	88.9	Confident	88.9	Confident	117 Å²	117	75 Å²	75	51%	0.509	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-26.9	-175.5	175.1	-177.8	-172.1	-175.1	0	115.5	F337 I347	F337-K341 HydrophobicContact CD2-CB 4.36Å; F337-K341 HydrophobicContact CE1-CD 4.37Å; F337-K341 HydrophobicContact CE2-CB 4.26Å; F337-K341 HydrophobicContact CE2-CD 3.76Å; F337-K341 HydrophobicContact CE2-CG 4.16Å; F337-K341 HydrophobicContact CZ-CD 3.68Å; F337-K341 WeakPolarHBondContact O-CB 3.48Å; F337-K341 PolarHBondContact O-N 2.75Å; K341-I347 WeakPolarHBondContact CA-O 2.97Å
342	K	86.3	Confident	89.3	Confident	207 Å²	207	71 Å²	71	90%	0.9	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-27.2	179	-68.6	-175.8	179.1	-179.8	0	114	E340	E340-K342 PolarHBondContact O-N 3.44Å
343	E	83.5	Confident	89.7	Confident	126 Å²	126	70.9 Å²	70.9	59%	0.589	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-19.3	-171.7	-66.6	-172.8	-149.3	0	0	112.9	E340 S373	E340-E343 PolarHBondContact O-N 3.5Å; E343-S373 WeakPolarHBondContact OE2-CA 3.39Å; E343-S373 WeakPolarHBondContact OE2-CB 3.02Å
344	N	84.8	Confident	89.8	Confident	4 Å²	4	73.4 Å²	73.4	2%	0.021	35%	0.348	C	S	.	.			trans	-133.2	107.8	-167.4	-171	-5.1	0	0	0	111.5	E340 K346 I347 V370 Q372	E340-N344 HydrophobicContact CB-CB 4.1Å; E340-N344 WeakPolarHBondContact O-CB 3.09Å; E340-N344 PolarHBondContact O-N 3.03Å; E340-N344 WeakPolarHBondContact OE2-CB 3.17Å; E340-N344 PolarHBondContact OE2-ND2 2.87Å; N344-K346 PolarHBondContact O-N 2.95Å; N344-K346 WeakPolarHBondContact OD1-CB 3.28Å; N344-K346 PolarHBondContact OD1-N 3.08Å; N344-I347 PolarHBondContact O-N 2.94Å; N344-V370 PolarHBondContact ND2-O 2.98Å; N344-Q372 HydrophobicContact CB-CG 4.49Å; N344-Q372 PolarHBondContact OD1-NE2 3.42Å
345	E	88.7	Confident	89.9	Confident	192 Å²	192	74.6 Å²	74.6	90%	0.897	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.6	-179.4	-59	-173.1	153.2	0	0	113.3
346	K	88.5	Confident	89.9	Confident	106 Å²	106	72.9 Å²	72.9	46%	0.461	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-14	179.6	-55.7	-171.4	173.5	-175.7	0	114.5	N344 D368	N344-K346 PolarHBondContact O-N 2.95Å; N344-K346 WeakPolarHBondContact OD1-CB 3.28Å; N344-K346 PolarHBondContact OD1-N 3.08Å; K346-D368 WeakPolarHBondContact CD-O 3.13Å; K346-D368 WeakPolarHBondContact CE-O 3.35Å; K346-D368 PolarHBondContact NZ-O 3.06Å
347	I	89.7	Confident	89.6	Confident	0 Å²	0	73 Å²	73	0%	0	34%	0.342	C	S	.	.			trans	-124.8	60.2	-176.6	-50.7	-177.1	0	0	0	109.2	I336 E340 K341 N344 A353	I336-I347 HydrophobicContact CG2-CD1 4.01Å; E340-I347 HydrophobicContact CB-CB 3.99Å; E340-I347 HydrophobicContact CB-CD1 3.98Å; E340-I347 HydrophobicContact CB-CG1 4.48Å; E340-I347 HydrophobicContact CB-CG2 4.15Å; E340-I347 HydrophobicContact CG-CD1 4.1Å; K341-I347 WeakPolarHBondContact CA-O 2.97Å; N344-I347 PolarHBondContact O-N 2.94Å; I347-A353 HydrophobicContact CG2-CB 3.66Å
348	R	88.1	Confident	89.3	Confident	180 Å²	180	74.2 Å²	74.2	68%	0.679	35%	0.351	S	S	*	.			trans	-86.9	-28.8	-173.9	-164.2	178.1	67	110.9	2.1	113.2	D352	R348-D352 PolarHBondContact N-OD2 2.89Å
349	T	93	Very high	88.9	Confident	50 Å²	50	70 Å²	70	31%	0.307	33%	0.329	S	S	.	.	S	Bend	trans	-118.2	160.9	-179.3	76.3	0	0	0	0	111.5	F337 A351 D352 A353	F337-T349 VanDerWaalsContact CD2-C 3.47Å; T349-A351 PolarHBondContact O-N 2.63Å; T349-A351 PolarHBondContact OG1-N 3.22Å; T349-D352 WeakPolarHBondContact CA-OD2 3.45Å; T349-D352 WeakPolarHBondContact CB-OD2 3.39Å; T349-D352 PolarHBondContact N-OD2 3.14Å; T349-D352 PolarHBondContact O-N 2.87Å; T349-D352 PolarHBondContact OG1-N 3.29Å; T349-D352 PolarHBondContact OG1-OD1 2.83Å; T349-D352 PolarHBondContact OG1-OD2 3.4Å; T349-A353 PolarHBondContact O-N 3.24Å
350	Y	93.7	Very high	88.3	Confident	78 Å²	78	69.7 Å²	69.7	31%	0.306	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-28.5	173	179.9	-106.3	0	0	0	111.9	L330 F334 F337 A353 L354	L330-Y350 WeakPolarHBondContact CD2-OH 3.31Å; L330-Y350 PolarHBondContact O-OH 3.12Å; F334-Y350 HydrophobicContact CB-CE2 3.94Å; F334-Y350 HydrophobicContact CD2-CD2 4.36Å; F334-Y350 HydrophobicContact CD2-CE2 4.19Å; F337-Y350 HydrophobicContact CB-CD2 4.18Å; F337-Y350 HydrophobicContact CD1-CD2 4.29Å; F337-Y350 VanDerWaalsContact CE2-N 3.34Å; F337-Y350 HydrophobicContact CG-CD2 4.27Å; Y350-A353 PolarHBondContact O-N 2.89Å; Y350-L354 HydrophobicContact CE1-CD1 4.4Å; Y350-L354 HydrophobicContact CE1-CD2 4.42Å; Y350-L354 VanDerWaalsContact O-CB 3.24Å; Y350-L354 WeakPolarHBondContact O-CB 3.21Å; Y350-L354 PolarHBondContact O-N 2.85Å
351	A	95	Very high	87.6	Confident	64 Å²	64	71.2 Å²	71.2	53%	0.529	34%	0.335	S	S	.	.	H	α-helix	trans	-66.2	-37.1	176.1	0	0	0	0	0	112.2	T349 L354 W355	T349-A351 PolarHBondContact O-N 2.63Å; T349-A351 PolarHBondContact OG1-N 3.22Å; A351-L354 PolarHBondContact O-N 3.44Å; A351-W355 WeakPolarHBondContact O-CB 3.37Å; A351-W355 PolarHBondContact O-N 3.1Å
352	D	93.4	Very high	86.9	Confident	56 Å²	56	69 Å²	69	30%	0.299	33%	0.334	S	S	.	.	H	α-helix	trans	-67.7	-41.2	177	-47.6	-42.4	0	0	0	111	R348 T349 W355 W356	R348-D352 PolarHBondContact N-OD2 2.89Å; T349-D352 WeakPolarHBondContact CA-OD2 3.45Å; T349-D352 WeakPolarHBondContact CB-OD2 3.39Å; T349-D352 PolarHBondContact N-OD2 3.14Å; T349-D352 PolarHBondContact O-N 2.87Å; T349-D352 PolarHBondContact OG1-N 3.29Å; T349-D352 PolarHBondContact OG1-OD1 2.83Å; T349-D352 PolarHBondContact OG1-OD2 3.4Å; D352-W355 PolarHBondContact O-N 3.44Å; D352-W356 PolarHBondContact O-N 3.48Å
353	A	90.7	Very high	86.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-68.4	-34.7	174.5	0	0	0	0	0	112.4	S333 F337 I347 T349 Y350 G357	S333-A353 VanDerWaalsContact O-CB 3.29Å; S333-A353 WeakPolarHBondContact O-CB 3.35Å; F337-A353 HydrophobicContact CB-CB 3.65Å; I347-A353 HydrophobicContact CG2-CB 3.66Å; T349-A353 PolarHBondContact O-N 3.24Å; Y350-A353 PolarHBondContact O-N 2.89Å; A353-G357 PolarHBondContact O-N 2.87Å
354	L	90.9	Very high	86	Confident	53 Å²	53	57.8 Å²	57.8	28%	0.277	29%	0.291	S	S	.	.	H	α-helix	trans	-69.4	-38.9	174.4	-169.6	71.7	0	0	0	111.5	L329 L330 Y350 A351 G357 V358	L329-L354 HydrophobicContact CD2-CD1 3.52Å; L329-L354 HydrophobicContact CG-CD1 4.47Å; L330-L354 HydrophobicContact CD2-CD1 4.15Å; Y350-L354 HydrophobicContact CE1-CD1 4.4Å; Y350-L354 HydrophobicContact CE1-CD2 4.42Å; Y350-L354 VanDerWaalsContact O-CB 3.24Å; Y350-L354 WeakPolarHBondContact O-CB 3.21Å; Y350-L354 PolarHBondContact O-N 2.85Å; A351-L354 PolarHBondContact O-N 3.44Å; L354-G357 CarbonylContact O-C 3.58Å; L354-G357 PolarHBondContact O-N 3.42Å; L354-V358 WeakPolarHBondContact O-CG2 3.47Å; L354-V358 PolarHBondContact O-N 2.9Å
355	W	91.8	Very high	85.8	Confident	120 Å²	120	60.2 Å²	60.2	46%	0.455	32%	0.317	S	S	.	.	H	α-helix	trans	-59.8	-51	171.7	171.4	-107	0	0	0	111	A351 D352 G357 V358 I359 Y366 D368	A351-W355 WeakPolarHBondContact O-CB 3.37Å; A351-W355 PolarHBondContact O-N 3.1Å; D352-W355 PolarHBondContact O-N 3.44Å; W355-G357 VanDerWaalsContact C-N 3.27Å; W355-G357 PolarHBondContact O-N 2.96Å; W355-V358 PolarHBondContact O-N 2.9Å; W355-I359 HydrophobicContact CD2-CG1 3.97Å; W355-I359 HydrophobicContact CE3-CG1 4.29Å; W355-I359 HydrophobicContact CH2-CD1 3.8Å; W355-I359 HydrophobicContact CH2-CG1 4.16Å; W355-I359 HydrophobicContact CZ2-CD1 3.87Å; W355-I359 HydrophobicContact CZ2-CG1 3.81Å; W355-I359 HydrophobicContact CZ3-CD1 4.13Å; W355-I359 HydrophobicContact CZ3-CG1 4.37Å; W355-I359 WeakPolarHBondContact O-CG1 3.44Å; W355-I359 PolarHBondContact O-N 3.37Å; W355-Y366 HydrophobicContact CH2-CE2 4.48Å; W355-Y366 HydrophobicContact CZ2-CD2 4.25Å; W355-Y366 HydrophobicContact CZ2-CE2 4.23Å; W355-D368 PolarHBondContact NE1-OD2 2.72Å
356	W	88.8	Confident	85.5	Confident	14 Å²	14	58.6 Å²	58.6	5%	0.053	30%	0.304	C	S	.	.	H	α-helix	trans	-53.7	-45.5	171.6	169.4	78.3	0	0	0	111.6	S332 I336 D352 V358 I359 T360 S369 A380	S332-W356 WeakPolarHBondContact OG-CZ3 3.4Å; I336-W356 HydrophobicContact CB-CE3 4.06Å; I336-W356 HydrophobicContact CB-CZ3 3.91Å; I336-W356 HydrophobicContact CD1-CH2 4.47Å; I336-W356 HydrophobicContact CG1-CE3 4.02Å; I336-W356 HydrophobicContact CG1-CH2 3.65Å; I336-W356 HydrophobicContact CG1-CZ2 4.4Å; I336-W356 HydrophobicContact CG1-CZ3 3.42Å; I336-W356 VanDerWaalsContact CG1-CZ3 3.42Å; I336-W356 HydrophobicContact CG2-CD2 4.29Å; I336-W356 HydrophobicContact CG2-CE3 3.89Å; I336-W356 HydrophobicContact CG2-CZ3 4.2Å; D352-W356 PolarHBondContact O-N 3.48Å; W356-V358 PolarHBondContact O-N 2.89Å; W356-I359 PolarHBondContact O-N 3.09Å; W356-T360 HydrophobicContact CH2-CG2 4.44Å; W356-T360 HydrophobicContact CZ2-CG2 4.04Å; W356-T360 PolarHBondContact NE1-OG1 3.33Å; W356-T360 WeakPolarHBondContact O-CB 3.28Å; W356-T360 PolarHBondContact O-N 3.03Å; W356-T360 PolarHBondContact O-OG1 2.89Å; W356-S369 VanDerWaalsContact CD1-O 3.23Å; W356-A380 HydrophobicContact CH2-CB 3.95Å; W356-A380 HydrophobicContact CZ2-CB 3.62Å
357	G	83.6	Confident	85.4	Confident	3 Å²	3	55.8 Å²	55.8	3%	0.031	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-40	178.9	0	0	0	0	0	113.5	A353 L354 W355 L361	A353-G357 PolarHBondContact O-N 2.87Å; L354-G357 CarbonylContact O-C 3.58Å; L354-G357 PolarHBondContact O-N 3.42Å; W355-G357 VanDerWaalsContact C-N 3.27Å; W355-G357 PolarHBondContact O-N 2.96Å; G357-L361 WeakPolarHBondContact O-CB 3.33Å; G357-L361 PolarHBondContact O-N 3.18Å
358	V	84	Confident	85.3	Confident	55 Å²	55	58.9 Å²	58.9	33%	0.333	32%	0.321	S	S	.	.	H	α-helix	trans	-67.2	-49.9	174.7	171.4	0	0	0	0	111	L329 L354 W355 W356 T360 L361 C362	L329-V358 HydrophobicContact CD1-CB 4.31Å; L329-V358 HydrophobicContact CD1-CG2 3.69Å; L354-V358 WeakPolarHBondContact O-CG2 3.47Å; L354-V358 PolarHBondContact O-N 2.9Å; W355-V358 PolarHBondContact O-N 2.9Å; W356-V358 PolarHBondContact O-N 2.89Å; V358-T360 PolarHBondContact O-N 2.92Å; V358-L361 PolarHBondContact O-N 3.43Å; V358-C362 WeakPolarHBondContact O-CB 3.43Å; V358-C362 PolarHBondContact O-N 3.3Å; V358-C362 PolarHBondContact O-SG 3.25Å
359	I	83	Confident	85.2	Confident	13 Å²	13	51 Å²	51	7%	0.067	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-32.2	-179.4	-67.1	-53.4	0	0	0	111.7	W355 W356 T363 V364 G365 Y366	W355-I359 HydrophobicContact CD2-CG1 3.97Å; W355-I359 HydrophobicContact CE3-CG1 4.29Å; W355-I359 HydrophobicContact CH2-CD1 3.8Å; W355-I359 HydrophobicContact CH2-CG1 4.16Å; W355-I359 HydrophobicContact CZ2-CD1 3.87Å; W355-I359 HydrophobicContact CZ2-CG1 3.81Å; W355-I359 HydrophobicContact CZ3-CD1 4.13Å; W355-I359 HydrophobicContact CZ3-CG1 4.37Å; W355-I359 WeakPolarHBondContact O-CG1 3.44Å; W355-I359 PolarHBondContact O-N 3.37Å; W356-I359 PolarHBondContact O-N 3.09Å; I359-T363 PolarHBondContact O-N 3.24Å; I359-V364 HydrophobicContact CG2-CB 4.24Å; I359-V364 PolarHBondContact O-N 3.46Å; I359-G365 PolarHBondContact O-N 2.78Å; I359-Y366 HydrophobicContact CD1-CD2 3.77Å; I359-Y366 HydrophobicContact CD1-CE2 3.56Å; I359-Y366 HydrophobicContact CG1-CD2 4.07Å; I359-Y366 HydrophobicContact CG1-CE2 4.35Å; I359-Y366 HydrophobicContact CG2-CD2 3.9Å; I359-Y366 HydrophobicContact CG2-CG 4.4Å
360	T	78.5	Confident	84.9	Confident	26 Å²	26	51.9 Å²	51.9	16%	0.16	30%	0.299	C	S	.	.	H	α-helix	trans	-76.7	-47	174.8	-57.6	0	0	0	0	112.2	W356 V358 C362 T363 C384	W356-T360 HydrophobicContact CH2-CG2 4.44Å; W356-T360 HydrophobicContact CZ2-CG2 4.04Å; W356-T360 PolarHBondContact NE1-OG1 3.33Å; W356-T360 WeakPolarHBondContact O-CB 3.28Å; W356-T360 PolarHBondContact O-N 3.03Å; W356-T360 PolarHBondContact O-OG1 2.89Å; V358-T360 PolarHBondContact O-N 2.92Å; T360-C362 VanDerWaalsContact C-N 3.33Å; T360-C362 PolarHBondContact O-N 2.92Å; T360-T363 WeakPolarHBondContact O-CA 3.37Å; T360-T363 PolarHBondContact O-N 3.26Å; T360-C384 WeakPolarHBondContact CG2-SG 3.3Å
361	L	74.7	Confident	84.6	Confident	32 Å²	32	48.9 Å²	48.9	17%	0.168	29%	0.289	C	S	.	.	H	α-helix	trans	-56.3	-46.6	173.6	164.9	69	0	0	0	111.3	L329 G357 V358 T363 I387 Y391 A392	L329-L361 HydrophobicContact CB-CD2 4.2Å; L329-L361 HydrophobicContact CD1-CB 3.97Å; L329-L361 HydrophobicContact CD1-CD2 3.36Å; L329-L361 HydrophobicContact CD1-CG 4.27Å; L329-L361 HydrophobicContact CG-CD2 4.4Å; G357-L361 WeakPolarHBondContact O-CB 3.33Å; G357-L361 PolarHBondContact O-N 3.18Å; V358-L361 PolarHBondContact O-N 3.43Å; L361-T363 PolarHBondContact O-N 3.3Å; L361-I387 HydrophobicContact CB-CG2 4.23Å; L361-I387 HydrophobicContact CD1-CG2 3.26Å; L361-I387 HydrophobicContact CG-CG2 4.31Å; L361-Y391 HydrophobicContact CD1-CD2 4.23Å; L361-Y391 HydrophobicContact CD1-CG 3.92Å; L361-A392 WeakPolarHBondContact O-CB 3.28Å
362	C	74.8	Confident	84.3	Confident	70 Å²	70	50.6 Å²	50.6	47%	0.473	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	1.5	178.6	-66	0	0	0	0	112.7	V358 T360 V364	V358-C362 WeakPolarHBondContact O-CB 3.43Å; V358-C362 PolarHBondContact O-N 3.3Å; V358-C362 PolarHBondContact O-SG 3.25Å; T360-C362 VanDerWaalsContact C-N 3.33Å; T360-C362 PolarHBondContact O-N 2.92Å; C362-V364 HydrophobicContact CB-CG2 3.96Å; C362-V364 PolarHBondContact O-N 2.65Å; C362-V364 VanDerWaalsContact O-N 3.09Å
363	T	74.2	Confident	84	Confident	33 Å²	33	48.2 Å²	48.2	20%	0.202	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	26.4	178.4	55.2	0	0	0	0	114.6	I359 T360 L361 I388 A392 L393	I359-T363 PolarHBondContact O-N 3.24Å; T360-T363 WeakPolarHBondContact O-CA 3.37Å; T360-T363 PolarHBondContact O-N 3.26Å; L361-T363 PolarHBondContact O-N 3.3Å; T363-I388 HydrophobicContact CG2-CD1 3.96Å; T363-I388 HydrophobicContact CG2-CG1 4Å; T363-A392 HydrophobicContact CG2-CB 3.74Å; T363-A392 WeakPolarHBondContact CG2-O 3.34Å; T363-L393 HydrophobicContact CG2-CB 4.27Å; T363-L393 HydrophobicContact CG2-CG 4.5Å; T363-L393 WeakPolarHBondContact OG1-CD1 3.48Å; T363-L393 VanDerWaalsContact OG1-CG 3.28Å; T363-L393 WeakPolarHBondContact OG1-CG 3.42Å
364	V	77.1	Confident	83.8	Confident	65 Å²	65	51 Å²	51	39%	0.394	30%	0.302	S	S	.	.			trans	-77.4	-41.5	178.5	177.9	0	0	0	0	110.2	I359 C362 Y366	I359-V364 HydrophobicContact CG2-CB 4.24Å; I359-V364 PolarHBondContact O-N 3.46Å; C362-V364 HydrophobicContact CB-CG2 3.96Å; C362-V364 PolarHBondContact O-N 2.65Å; C362-V364 VanDerWaalsContact O-N 3.09Å; V364-Y366 HydrophobicContact CG1-CD1 3.92Å; V364-Y366 HydrophobicContact CG1-CD2 4.09Å; V364-Y366 HydrophobicContact CG1-CE1 3.53Å; V364-Y366 HydrophobicContact CG1-CE2 3.73Å; V364-Y366 HydrophobicContact CG1-CG 4.17Å; V364-Y366 VanDerWaalsContact CG1-CZ 3.43Å; V364-Y366 PolarHBondContact O-N 2.73Å
365	G	78.8	Confident	83.5	Confident	55 Å²	55	53.1 Å²	53.1	57%	0.567	31%	0.313	S	S	*	.			trans	59.4	46.6	166.3	0	0	0	0	0	115.9	I359 G367	I359-G365 PolarHBondContact O-N 2.78Å; G365-G367 PolarHBondContact O-N 3.34Å
366	Y	83.4	Confident	83.2	Confident	158 Å²	158	47.4 Å²	47.4	62%	0.62	29%	0.292	S	S	*	.			trans	-56.1	-24.2	-178.4	-68.1	-53.5	0	0	0	115.2	W355 I359 V364 D368	W355-Y366 HydrophobicContact CH2-CE2 4.48Å; W355-Y366 HydrophobicContact CZ2-CD2 4.25Å; W355-Y366 HydrophobicContact CZ2-CE2 4.23Å; I359-Y366 HydrophobicContact CD1-CD2 3.77Å; I359-Y366 HydrophobicContact CD1-CE2 3.56Å; I359-Y366 HydrophobicContact CG1-CD2 4.07Å; I359-Y366 HydrophobicContact CG1-CE2 4.35Å; I359-Y366 HydrophobicContact CG2-CD2 3.9Å; I359-Y366 HydrophobicContact CG2-CG 4.4Å; V364-Y366 HydrophobicContact CG1-CD1 3.92Å; V364-Y366 HydrophobicContact CG1-CD2 4.09Å; V364-Y366 HydrophobicContact CG1-CE1 3.53Å; V364-Y366 HydrophobicContact CG1-CE2 3.73Å; V364-Y366 HydrophobicContact CG1-CG 4.17Å; V364-Y366 VanDerWaalsContact CG1-CZ 3.43Å; V364-Y366 PolarHBondContact O-N 2.73Å; Y366-D368 PolarHBondContact O-N 2.94Å
367	G	85.5	Confident	83.1	Confident	46 Å²	46	52.6 Å²	52.6	47%	0.474	31%	0.314	S	S	.	.			trans	74.1	7	-178.6	0	0	0	0	0	114.4	G365	G365-G367 PolarHBondContact O-N 3.34Å
368	D	88.9	Confident	83	Confident	65 Å²	65	56.5 Å²	56.5	35%	0.348	34%	0.338	S	S	.	.	S	Bend	trans	-61.6	-50.6	175.8	59.7	-29.3	0	0	0	111.4	K346 W355 Y366	K346-D368 WeakPolarHBondContact CD-O 3.13Å; K346-D368 WeakPolarHBondContact CE-O 3.35Å; K346-D368 PolarHBondContact NZ-O 3.06Å; W355-D368 PolarHBondContact NE1-OD2 2.72Å; Y366-D368 PolarHBondContact O-N 2.94Å
369	S	84.7	Confident	83	Confident	16 Å²	16	55.6 Å²	55.6	11%	0.112	33%	0.331	C	S	.	.	S	Bend	trans	-117.5	127.8	171.1	-73.2	0	0	0	0	110	W356	W356-S369 VanDerWaalsContact CD1-O 3.23Å
370	V	88	Confident	82.9	Confident	68 Å²	68	55.4 Å²	55.4	41%	0.412	33%	0.331	S	S	.	.			trans	-139.2	145.2	177.4	-66.3	0	0	0	0	109.5	N344 Q372	N344-V370 PolarHBondContact ND2-O 2.98Å; V370-Q372 PolarHBondContact O-N 2.94Å
371	P	87.7	Confident	82.8	Confident	14 Å²	14	55.7 Å²	55.7	9%	0.091	34%	0.34	C	S	.	.			trans	-66.1	131.4	175.5	28.8	-35.8	0	0	0	110.3	E340 K377 A380	E340-P371 VanDerWaalsContact CD-CA 3.4Å; E340-P371 HydrophobicContact CG-CB 3.99Å; E340-P371 WeakPolarHBondContact OE1-CB 3.18Å; E340-P371 VanDerWaalsContact OE2-CA 3.28Å; E340-P371 WeakPolarHBondContact OE2-CA 3.3Å; P371-K377 HydrophobicContact CG-CG 4.3Å; P371-K377 WeakPolarHBondContact O-CE 3.45Å; P371-K377 WeakPolarHBondContact O-CG 3.32Å; P371-A380 HydrophobicContact CG-CB 3.68Å
372	Q	87	Confident	82.8	Confident	101 Å²	101	58.2 Å²	58.2	47%	0.472	36%	0.359	S	S	.	.			trans	-97.8	-35.6	-178.4	-62.8	-169	35.7	0	0	111.8	E340 N344 V370 K377	E340-Q372 VanDerWaalsContact CD-N 3.34Å; E340-Q372 PolarHBondContact OE1-N 2.91Å; E340-Q372 PolarHBondContact OE2-N 3.03Å; N344-Q372 HydrophobicContact CB-CG 4.49Å; N344-Q372 PolarHBondContact OD1-NE2 3.42Å; V370-Q372 PolarHBondContact O-N 2.94Å; Q372-K377 VanDerWaalsContact O-CE 3.27Å; Q372-K377 WeakPolarHBondContact O-CE 3.35Å; Q372-K377 PolarHBondContact O-NZ 3.06Å
373	S	88.6	Confident	82.7	Confident	5 Å²	5	55.4 Å²	55.4	4%	0.035	34%	0.34	C	S	.	.	S	Bend	trans	-65.2	149.8	-177.9	73.7	0	0	0	0	111.3	V339 E340 E343 L375 G376 K377	V339-S373 VanDerWaalsContact CG1-OG 3.3Å; V339-S373 WeakPolarHBondContact CG1-OG 3.45Å; E340-S373 VanDerWaalsContact OE1-CB 3.24Å; E340-S373 WeakPolarHBondContact OE1-CB 3.26Å; E340-S373 PolarHBondContact OE1-N 3Å; E340-S373 PolarHBondContact OE1-OG 2.84Å; E343-S373 WeakPolarHBondContact OE2-CA 3.39Å; E343-S373 WeakPolarHBondContact OE2-CB 3.02Å; S373-L375 PolarHBondContact O-N 3.38Å; S373-G376 PolarHBondContact O-N 3.23Å; S373-G376 VanDerWaalsContact OG-CA 3.25Å; S373-G376 WeakPolarHBondContact OG-CA 3.12Å; S373-G376 PolarHBondContact OG-N 3.42Å; S373-K377 WeakPolarHBondContact O-CB 3.42Å; S373-K377 WeakPolarHBondContact O-CG 3.44Å; S373-K377 PolarHBondContact O-N 2.75Å
374	G	85.4	Confident	82.5	Confident	58 Å²	58	54.6 Å²	54.6	60%	0.598	34%	0.335	S	S	*	.	H	α-helix	trans	-60.1	-36.4	176.4	0	0	0	0	0	112.3	T378	G374-T378 PolarHBondContact O-N 3.14Å; G374-T378 PolarHBondContact O-OG1 3.49Å
375	L	84.9	Confident	81.9	Confident	99 Å²	99	54.7 Å²	54.7	52%	0.518	33%	0.333	S	S	.	.	H	α-helix	trans	-79.4	-34.6	-179.5	-168	149	0	0	0	112.4	V339 S373 T378 I379	V339-L375 HydrophobicContact CB-CD2 4.27Å; V339-L375 HydrophobicContact CG1-CB 4.39Å; V339-L375 HydrophobicContact CG1-CD2 3.75Å; V339-L375 HydrophobicContact CG2-CD2 3.47Å; V339-L375 VanDerWaalsContact CG2-CD2 3.47Å; S373-L375 PolarHBondContact O-N 3.38Å; L375-T378 WeakPolarHBondContact CA-OG1 3.37Å; L375-T378 PolarHBondContact O-N 3.17Å; L375-T378 PolarHBondContact O-OG1 3.03Å; L375-I379 HydrophobicContact CD2-CD1 3.54Å; L375-I379 HydrophobicContact CD2-CG1 4.15Å; L375-I379 WeakPolarHBondContact O-CB 3.22Å; L375-I379 WeakPolarHBondContact O-CG1 3.37Å; L375-I379 PolarHBondContact O-N 3.06Å
376	G	85.5	Confident	81.3	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-36	172.1	0	0	0	0	0	111.7	I336 S373 A380	I336-G376 VanDerWaalsContact CD1-O 3.27Å; I336-G376 WeakPolarHBondContact CD1-O 3.45Å; S373-G376 PolarHBondContact O-N 3.23Å; S373-G376 VanDerWaalsContact OG-CA 3.25Å; S373-G376 WeakPolarHBondContact OG-CA 3.12Å; S373-G376 PolarHBondContact OG-N 3.42Å; G376-A380 WeakPolarHBondContact O-CB 3.26Å; G376-A380 PolarHBondContact O-N 3.16Å
377	K	86.6	Confident	80.3	Confident	122 Å²	122	48.2 Å²	48.2	53%	0.53	31%	0.305	S	S	.	.	H	α-helix	trans	-64.9	-40.8	171.5	-75.1	165	176.9	155.3	0	112.5	P371 Q372 S373 G381	P371-K377 HydrophobicContact CG-CG 4.3Å; P371-K377 WeakPolarHBondContact O-CE 3.45Å; P371-K377 WeakPolarHBondContact O-CG 3.32Å; Q372-K377 VanDerWaalsContact O-CE 3.27Å; Q372-K377 WeakPolarHBondContact O-CE 3.35Å; Q372-K377 PolarHBondContact O-NZ 3.06Å; S373-K377 WeakPolarHBondContact O-CB 3.42Å; S373-K377 WeakPolarHBondContact O-CG 3.44Å; S373-K377 PolarHBondContact O-N 2.75Å; K377-G381 PolarHBondContact O-N 3.35Å
378	T	82.6	Confident	79.1	Confident	86 Å²	86	46.4 Å²	46.4	53%	0.528	28%	0.284	S	S	.	.	H	α-helix	trans	-71.8	-41.8	175.7	55.7	0	0	0	0	112.2	G374 L375 G381 C382	G374-T378 PolarHBondContact O-N 3.14Å; G374-T378 PolarHBondContact O-OG1 3.49Å; L375-T378 WeakPolarHBondContact CA-OG1 3.37Å; L375-T378 PolarHBondContact O-N 3.17Å; L375-T378 PolarHBondContact O-OG1 3.03Å; T378-G381 PolarHBondContact O-N 2.97Å; T378-C382 WeakPolarHBondContact O-CB 3.4Å; T378-C382 PolarHBondContact O-N 3.27Å; T378-C382 PolarHBondContact O-SG 2.91Å; T378-C382 VanDerWaalsContact O-SG 3.32Å
379	I	83	Confident	77.6	Confident	35 Å²	35	44.6 Å²	44.6	18%	0.179	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-45	173	-72.7	-177.4	0	0	0	110.7	L335 I336 V339 L375 G381 C382 S383	L335-I379 HydrophobicContact CB-CD1 4.4Å; L335-I379 HydrophobicContact CB-CG2 3.79Å; L335-I379 HydrophobicContact CD1-CG2 4.21Å; I336-I379 HydrophobicContact CD1-CB 3.96Å; I336-I379 HydrophobicContact CD1-CG2 3.62Å; I336-I379 HydrophobicContact CG1-CG2 4.11Å; V339-I379 HydrophobicContact CG2-CD1 3.97Å; L375-I379 HydrophobicContact CD2-CD1 3.54Å; L375-I379 HydrophobicContact CD2-CG1 4.15Å; L375-I379 WeakPolarHBondContact O-CB 3.22Å; L375-I379 WeakPolarHBondContact O-CG1 3.37Å; L375-I379 PolarHBondContact O-N 3.06Å; I379-G381 PolarHBondContact O-N 3.41Å; I379-C382 PolarHBondContact O-N 3.2Å; I379-S383 VanDerWaalsContact O-CB 3.26Å; I379-S383 WeakPolarHBondContact O-CB 3.32Å; I379-S383 PolarHBondContact O-N 3.35Å; I379-S383 PolarHBondContact O-OG 3.43Å
380	A	81.7	Confident	76.4	Confident	9 Å²	9	48.2 Å²	48.2	7%	0.074	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-44.4	176.2	0	0	0	0	0	111.1	I336 W356 P371 G376 S383 C384	I336-A380 HydrophobicContact CD1-CB 4.09Å; W356-A380 HydrophobicContact CH2-CB 3.95Å; W356-A380 HydrophobicContact CZ2-CB 3.62Å; P371-A380 HydrophobicContact CG-CB 3.68Å; G376-A380 WeakPolarHBondContact O-CB 3.26Å; G376-A380 PolarHBondContact O-N 3.16Å; A380-S383 PolarHBondContact O-N 3.22Å; A380-S383 PolarHBondContact O-OG 2.83Å; A380-C384 WeakPolarHBondContact O-CA 3.49Å; A380-C384 WeakPolarHBondContact O-CB 3.27Å; A380-C384 PolarHBondContact O-N 3.39Å; A380-C384 PolarHBondContact O-SG 3.09Å
381	G	76.5	Confident	74.9	Confident	33 Å²	33	47.2 Å²	47.2	34%	0.34	28%	0.28	S	S	.	.	H	α-helix	trans	-58.7	-49.2	173.9	0	0	0	0	0	112.7	K377 T378 I379 C384 L385	K377-G381 PolarHBondContact O-N 3.35Å; T378-G381 PolarHBondContact O-N 2.97Å; I379-G381 PolarHBondContact O-N 3.41Å; G381-C384 WeakPolarHBondContact O-CB 3.3Å; G381-L385 WeakPolarHBondContact O-CB 3.32Å; G381-L385 VanDerWaalsContact O-CG 3.29Å; G381-L385 WeakPolarHBondContact O-CG 3.44Å; G381-L385 PolarHBondContact O-N 3.32Å
382	C	74	Confident	73.3	Confident	84 Å²	84	47.2 Å²	47.2	57%	0.568	28%	0.281	S	S	*	.	H	α-helix	trans	-66.7	-40.7	179	-70.6	0	0	0	0	112.9	T378 I379 L385 A386	T378-C382 WeakPolarHBondContact O-CB 3.4Å; T378-C382 PolarHBondContact O-N 3.27Å; T378-C382 PolarHBondContact O-SG 2.91Å; T378-C382 VanDerWaalsContact O-SG 3.32Å; I379-C382 PolarHBondContact O-N 3.2Å; C382-L385 PolarHBondContact O-N 3Å; C382-A386 WeakPolarHBondContact O-CB 3.38Å; C382-A386 PolarHBondContact O-N 3.09Å
383	S	73.5	Confident	71.8	Confident	12 Å²	12	45.4 Å²	45.4	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-76.3	-33.5	178.6	69.9	0	0	0	0	112	S332 I379 A380 A386 I387	S332-S383 VanDerWaalsContact OG-CB 3.25Å; S332-S383 WeakPolarHBondContact OG-CB 3.41Å; S332-S383 PolarHBondContact OG-OG 2.89Å; I379-S383 VanDerWaalsContact O-CB 3.26Å; I379-S383 WeakPolarHBondContact O-CB 3.32Å; I379-S383 PolarHBondContact O-N 3.35Å; I379-S383 PolarHBondContact O-OG 3.43Å; A380-S383 PolarHBondContact O-N 3.22Å; A380-S383 PolarHBondContact O-OG 2.83Å; S383-A386 PolarHBondContact O-N 2.84Å; S383-I387 WeakPolarHBondContact O-CB 3.38Å; S383-I387 WeakPolarHBondContact O-CD1 3.42Å; S383-I387 WeakPolarHBondContact O-CG1 3.14Å; S383-I387 PolarHBondContact O-N 3.49Å
384	C	69.1	Low	70.1	Confident	15 Å²	15	46.6 Å²	46.6	10%	0.101	28%	0.282	C	S	.	.	H	α-helix	trans	-53.4	-60	163.4	-78.3	0	0	0	0	108.2	T360 A380 G381 A386 I387 I388 L398	T360-C384 WeakPolarHBondContact CG2-SG 3.3Å; A380-C384 WeakPolarHBondContact O-CA 3.49Å; A380-C384 WeakPolarHBondContact O-CB 3.27Å; A380-C384 PolarHBondContact O-N 3.39Å; A380-C384 PolarHBondContact O-SG 3.09Å; G381-C384 WeakPolarHBondContact O-CB 3.3Å; C384-A386 VanDerWaalsContact C-N 3.3Å; C384-A386 PolarHBondContact O-N 3.34Å; C384-I387 PolarHBondContact O-N 3Å; C384-I387 VanDerWaalsContact O-N 3.14Å; C384-I388 HydrophobicContact CB-CD1 3.98Å; C384-I388 WeakPolarHBondContact O-CA 3.27Å; C384-I388 WeakPolarHBondContact O-CB 3.13Å; C384-I388 PolarHBondContact O-N 3.09Å; C384-L398 HydrophobicContact CB-CD1 4.2Å; C384-L398 HydrophobicContact CB-CD2 3.94Å
385	L	65	Low	68.5	Low	67 Å²	67	44 Å²	44	35%	0.351	25%	0.254	S	S	.	.	H	α-helix	trans	-54.7	-42.7	179.7	-71.8	170.3	0	0	0	112.8	G381 C382 S389 L398 C420	G381-L385 WeakPolarHBondContact O-CB 3.32Å; G381-L385 VanDerWaalsContact O-CG 3.29Å; G381-L385 WeakPolarHBondContact O-CG 3.44Å; G381-L385 PolarHBondContact O-N 3.32Å; C382-L385 PolarHBondContact O-N 3Å; L385-S389 WeakPolarHBondContact O-CB 3.38Å; L385-S389 PolarHBondContact O-N 3.44Å; L385-S389 PolarHBondContact O-OG 2.85Å; L385-L398 HydrophobicContact CD2-CD1 4.26Å; L385-C420 HydrophobicContact CD2-CB 4.3Å
386	A	64.8	Low	66.9	Low	61 Å²	61	42.9 Å²	42.9	50%	0.504	25%	0.248	S	C	.	.	H	α-helix	trans	-70	-34.6	179.2	0	0	0	0	0	114	C382 S383 C384 F390	C382-A386 WeakPolarHBondContact O-CB 3.38Å; C382-A386 PolarHBondContact O-N 3.09Å; S383-A386 PolarHBondContact O-N 2.84Å; C384-A386 VanDerWaalsContact C-N 3.3Å; C384-A386 PolarHBondContact O-N 3.34Å; A386-F390 VanDerWaalsContact O-CD2 3.32Å; A386-F390 WeakPolarHBondContact O-CD2 3.38Å
387	I	63.9	Low	65.3	Low	16 Å²	16	44.8 Å²	44.8	8%	0.082	26%	0.26	C	S	.	.	H	α-helix	trans	-87.6	-46.6	-178	-68.1	169.2	0	0	0	110.9	G328 S332 L361 S383 C384 S389 F390 Y391	G328-I387 WeakPolarHBondContact O-CD1 3.41Å; S332-I387 VanDerWaalsContact CB-CD1 3.41Å; L361-I387 HydrophobicContact CB-CG2 4.23Å; L361-I387 HydrophobicContact CD1-CG2 3.26Å; L361-I387 HydrophobicContact CG-CG2 4.31Å; S383-I387 WeakPolarHBondContact O-CB 3.38Å; S383-I387 WeakPolarHBondContact O-CD1 3.42Å; S383-I387 WeakPolarHBondContact O-CG1 3.14Å; S383-I387 PolarHBondContact O-N 3.49Å; C384-I387 PolarHBondContact O-N 3Å; C384-I387 VanDerWaalsContact O-N 3.14Å; I387-S389 VanDerWaalsContact C-N 3.3Å; I387-S389 PolarHBondContact O-N 2.91Å; I387-F390 CarbonylContact O-C 3.49Å; I387-F390 PolarHBondContact O-N 2.84Å; I387-Y391 HydrophobicContact CG2-CD2 4.35Å; I387-Y391 VanDerWaalsContact O-CD2 3.31Å; I387-Y391 WeakPolarHBondContact O-CD2 3.49Å; I387-Y391 PolarHBondContact O-N 3.36Å
388	I	58.8	Low	63.6	Low	8 Å²	8	42.1 Å²	42.1	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-66.8	-31.9	178.1	-73.2	161.4	0	0	0	110.7	T363 C384 F390 Y391 A392 L398	T363-I388 HydrophobicContact CG2-CD1 3.96Å; T363-I388 HydrophobicContact CG2-CG1 4Å; C384-I388 HydrophobicContact CB-CD1 3.98Å; C384-I388 WeakPolarHBondContact O-CA 3.27Å; C384-I388 WeakPolarHBondContact O-CB 3.13Å; C384-I388 PolarHBondContact O-N 3.09Å; I388-F390 PolarHBondContact O-N 3.44Å; I388-F390 VanDerWaalsContact O-N 3.08Å; I388-Y391 PolarHBondContact O-N 3.44Å; I388-A392 VanDerWaalsContact CG2-O 3.26Å; I388-A392 WeakPolarHBondContact CG2-O 3.05Å; I388-L398 HydrophobicContact CB-CD1 4.18Å; I388-L398 HydrophobicContact CD1-CD1 3.75Å; I388-L398 HydrophobicContact CD1-CD2 4.3Å; I388-L398 HydrophobicContact CD1-CG 4.08Å; I388-L398 HydrophobicContact CG2-CD1 3.84Å
389	S	58.3	Low	62.3	Low	28 Å²	28	39.2 Å²	39.2	20%	0.196	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-5.8	168.4	-63.1	0	0	0	0	114.3	L385 I387 F427	L385-S389 WeakPolarHBondContact O-CB 3.38Å; L385-S389 PolarHBondContact O-N 3.44Å; L385-S389 PolarHBondContact O-OG 2.85Å; I387-S389 VanDerWaalsContact C-N 3.3Å; I387-S389 PolarHBondContact O-N 2.91Å; S389-F427 WeakPolarHBondContact O-CB 3.43Å; S389-F427 WeakPolarHBondContact O-CD2 3.37Å; S389-F427 WeakPolarHBondContact O-CG 3.43Å
390	F	58.5	Low	60.9	Low	92 Å²	92	39.7 Å²	39.7	40%	0.404	24%	0.238	S	C	.	.	H	α-helix	trans	-121.3	-19.2	173.2	-78.2	-104.1	0	0	0	114.2	I324 A386 I387 I388	I324-F390 HydrophobicContact CG2-CD1 4.04Å; I324-F390 HydrophobicContact CG2-CE1 4.24Å; A386-F390 VanDerWaalsContact O-CD2 3.32Å; A386-F390 WeakPolarHBondContact O-CD2 3.38Å; I387-F390 CarbonylContact O-C 3.49Å; I387-F390 PolarHBondContact O-N 2.84Å; I388-F390 PolarHBondContact O-N 3.44Å; I388-F390 VanDerWaalsContact O-N 3.08Å
391	Y	57.2	Low	59.4	Low	47 Å²	47	43.2 Å²	43.2	18%	0.184	26%	0.259	C	S	.	.	H	α-helix	trans	-128.6	-33.5	-165.3	-69.2	-67	0	0	0	120.2	T321 I324 G325 L361 I387 I388	T321-Y391 WeakPolarHBondContact O-CE1 3.29Å; T321-Y391 PolarHBondContact O-OH 2.9Å; I324-Y391 WeakPolarHBondContact CB-OH 3.33Å; I324-Y391 HydrophobicContact CG2-CE2 4.25Å; I324-Y391 WeakPolarHBondContact CG2-OH 3.39Å; G325-Y391 VanDerWaalsContact CA-CD2 3.41Å; G325-Y391 PolarHBondContact N-OH 3.46Å; G325-Y391 VanDerWaalsContact N-OH 3.13Å; L361-Y391 HydrophobicContact CD1-CD2 4.23Å; L361-Y391 HydrophobicContact CD1-CG 3.92Å; I387-Y391 HydrophobicContact CG2-CD2 4.35Å; I387-Y391 VanDerWaalsContact O-CD2 3.31Å; I387-Y391 WeakPolarHBondContact O-CD2 3.49Å; I387-Y391 PolarHBondContact O-N 3.36Å; I388-Y391 PolarHBondContact O-N 3.44Å
392	A	55.3	Low	58.2	Low	13 Å²	13	43.8 Å²	43.8	11%	0.107	27%	0.265	C	S	.	.	S	Bend	trans	-158.5	126	-166.7	0	0	0	0	0	116	L361 T363 I388	L361-A392 WeakPolarHBondContact O-CB 3.28Å; T363-A392 HydrophobicContact CG2-CB 3.74Å; T363-A392 WeakPolarHBondContact CG2-O 3.34Å; I388-A392 VanDerWaalsContact CG2-O 3.26Å; I388-A392 WeakPolarHBondContact CG2-O 3.05Å
393	L	54.1	Low	57	Low	63 Å²	63	47.9 Å²	47.9	33%	0.33	27%	0.27	S	S	.	.	S	Bend	trans	60.5	151.7	171	-64.1	-169.1	0	0	0	117.5	T363 T397 F428	T363-L393 HydrophobicContact CG2-CB 4.27Å; T363-L393 HydrophobicContact CG2-CG 4.5Å; T363-L393 WeakPolarHBondContact OG1-CD1 3.48Å; T363-L393 VanDerWaalsContact OG1-CG 3.28Å; T363-L393 WeakPolarHBondContact OG1-CG 3.42Å; L393-T397 HydrophobicContact CD1-CG2 4.25Å; L393-F428 HydrophobicContact CD2-CE2 4.01Å; L393-F428 HydrophobicContact CD2-CZ 3.92Å
394	P	53.7	Low	56	Low	31 Å²	31	49.9 Å²	49.9	20%	0.201	29%	0.293	C	S	.	.			trans	-63.5	143.9	173.6	26.8	-35.5	0	0	0	110.5	I396 T397	P394-I396 HydrophobicContact CB-CB 4.1Å; P394-I396 HydrophobicContact CB-CD1 3.81Å; P394-I396 HydrophobicContact CB-CG1 3.95Å; P394-I396 HydrophobicContact CG-CB 4.11Å; P394-I396 HydrophobicContact CG-CD1 3.98Å; P394-I396 HydrophobicContact CG-CG1 4.32Å; P394-I396 PolarHBondContact O-N 3.17Å; P394-T397 PolarHBondContact O-N 3.46Å; P394-T397 PolarHBondContact O-OG1 2.98Å
395	P	51.1	Low	55.3	Low	3 Å²	3	56.4 Å²	56.4	2%	0.019	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-1	174.1	-29.7	39.8	0	0	0	115	T397 L398 C399 C420	P395-T397 PolarHBondContact O-N 3.38Å; P395-L398 PolarHBondContact O-N 3.04Å; P395-C399 VanDerWaalsContact O-CB 3.22Å; P395-C399 WeakPolarHBondContact O-CB 3.4Å; P395-C399 PolarHBondContact O-N 3Å; P395-C399 PolarHBondContact O-SG 3.19Å; P395-C420 HydrophobicContact CB-CB 4.29Å; P395-C420 WeakPolarHBondContact CG-O 3.47Å
396	I	52.5	Low	54.9	Low	76 Å²	76	57.1 Å²	57.1	39%	0.39	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-36.6	160.6	-64.3	171.2	0	0	0	111.5	P394 T400 V401 G402	P394-I396 HydrophobicContact CB-CB 4.1Å; P394-I396 HydrophobicContact CB-CD1 3.81Å; P394-I396 HydrophobicContact CB-CG1 3.95Å; P394-I396 HydrophobicContact CG-CB 4.11Å; P394-I396 HydrophobicContact CG-CD1 3.98Å; P394-I396 HydrophobicContact CG-CG1 4.32Å; P394-I396 PolarHBondContact O-N 3.17Å; I396-T400 PolarHBondContact O-N 3.37Å; I396-V401 HydrophobicContact CG2-CB 4.1Å; I396-V401 HydrophobicContact CG2-CG1 4.35Å; I396-V401 PolarHBondContact O-N 3.1Å; I396-G402 PolarHBondContact O-N 2.83Å
397	T	52.2	Low	54.7	Low	39 Å²	39	58.2 Å²	58.2	24%	0.239	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-46.9	174	48.9	0	0	0	0	112.8	L393 P394 P395 C399 T400	L393-T397 HydrophobicContact CD1-CG2 4.25Å; P394-T397 PolarHBondContact O-N 3.46Å; P394-T397 PolarHBondContact O-OG1 2.98Å; P395-T397 PolarHBondContact O-N 3.38Å; T397-C399 PolarHBondContact O-N 2.91Å; T397-T400 WeakPolarHBondContact O-CA 3.45Å; T397-T400 PolarHBondContact O-N 3.09Å; T397-T400 VanDerWaalsContact O-N 3.08Å
398	L	50.5	Low	54.8	Low	67 Å²	67	59.1 Å²	59.1	35%	0.351	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-34.6	178	-86.6	173.6	0	0	0	113.9	C384 L385 I388 P395 T400	C384-L398 HydrophobicContact CB-CD1 4.2Å; C384-L398 HydrophobicContact CB-CD2 3.94Å; L385-L398 HydrophobicContact CD2-CD1 4.26Å; I388-L398 HydrophobicContact CB-CD1 4.18Å; I388-L398 HydrophobicContact CD1-CD1 3.75Å; I388-L398 HydrophobicContact CD1-CD2 4.3Å; I388-L398 HydrophobicContact CD1-CG 4.08Å; I388-L398 HydrophobicContact CG2-CD1 3.84Å; P395-L398 PolarHBondContact O-N 3.04Å; L398-T400 PolarHBondContact O-N 2.98Å
399	C	53.9	Low	55.5	Low	24 Å²	24	67.9 Å²	67.9	16%	0.162	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	11	175.8	-56.4	0	0	0	0	112.1	P395 T397 V401 A417	P395-C399 VanDerWaalsContact O-CB 3.22Å; P395-C399 WeakPolarHBondContact O-CB 3.4Å; P395-C399 PolarHBondContact O-N 3Å; P395-C399 PolarHBondContact O-SG 3.19Å; T397-C399 PolarHBondContact O-N 2.91Å; C399-V401 HydrophobicContact CB-CG2 4.07Å; C399-V401 WeakPolarHBondContact O-CG2 3.49Å; C399-V401 PolarHBondContact O-N 3.23Å; C399-A417 HydrophobicContact CB-CB 4.04Å
400	T	53.8	Low	56.7	Low	45 Å²	45	70.8 Å²	70.8	28%	0.276	40%	0.396	S	S	.	.	S	Bend	trans	57	2.2	177.8	54.2	0	0	0	0	116.8	I396 T397 L398 G402 Y403 G404 T406	I396-T400 PolarHBondContact O-N 3.37Å; T397-T400 WeakPolarHBondContact O-CA 3.45Å; T397-T400 PolarHBondContact O-N 3.09Å; T397-T400 VanDerWaalsContact O-N 3.08Å; L398-T400 PolarHBondContact O-N 2.98Å; T400-G402 PolarHBondContact O-N 3.46Å; T400-Y403 PolarHBondContact O-N 3.26Å; T400-G404 PolarHBondContact O-N 3.04Å; T400-T406 CarbonylContact C-O 3.29Å; T400-T406 VanDerWaalsContact C-O 3.29Å; T400-T406 WeakPolarHBondContact CB-O 3.27Å; T400-T406 WeakPolarHBondContact CB-OG1 3.34Å; T400-T406 WeakPolarHBondContact CG2-OG1 3.44Å; T400-T406 WeakPolarHBondContact OG1-CB 3.32Å; T400-T406 PolarHBondContact OG1-O 3.01Å; T400-T406 PolarHBondContact OG1-OG1 3.5Å
401	V	50.3	Low	57.7	Low	83 Å²	83	75.2 Å²	75.2	50%	0.503	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.2	173.7	-173.9	0	0	0	0	112.4	I396 C399	I396-V401 HydrophobicContact CG2-CB 4.1Å; I396-V401 HydrophobicContact CG2-CG1 4.35Å; I396-V401 PolarHBondContact O-N 3.1Å; C399-V401 HydrophobicContact CB-CG2 4.07Å; C399-V401 WeakPolarHBondContact O-CG2 3.49Å; C399-V401 PolarHBondContact O-N 3.23Å
402	G	51.4	Low	58.3	Low	46 Å²	46	77.1 Å²	77.1	47%	0.474	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-16.9	-178.5	0	0	0	0	0	115.8	I396 T400	I396-G402 PolarHBondContact O-N 2.83Å; T400-G402 PolarHBondContact O-N 3.46Å
403	Y	48.4	Very low	58.9	Low	169 Å²	169	77.4 Å²	77.4	66%	0.663	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-5.8	178.3	-76.4	-77.7	0	0	0	113.1	T400 D405	T400-Y403 PolarHBondContact O-N 3.26Å; Y403-D405 PolarHBondContact O-N 2.7Å
404	G	53.5	Low	59.7	Low	55 Å²	55	80.5 Å²	80.5	57%	0.567	44%	0.436	S	S	*	.	S	Bend	trans	76.3	-32.1	175	0	0	0	0	0	115.7	T400 T406	T400-G404 PolarHBondContact O-N 3.04Å; G404-T406 PolarHBondContact O-N 3.35Å
405	D	54.8	Low	60.7	Low	152 Å²	152	82.4 Å²	82.4	81%	0.813	44%	0.444	S	S	*	.	S	Bend	trans	-75.4	-18.9	-168.4	-63.8	-30.2	0	0	0	115.2	Y403	Y403-D405 PolarHBondContact O-N 2.7Å
406	T	54.9	Low	61.3	Low	81 Å²	81	87.4 Å²	87.4	50%	0.497	47%	0.469	S	S	.	.			trans	-140.1	139.5	178.1	26.6	0	0	0	0	110.8	T400 G404	T400-T406 CarbonylContact C-O 3.29Å; T400-T406 VanDerWaalsContact C-O 3.29Å; T400-T406 WeakPolarHBondContact CB-O 3.27Å; T400-T406 WeakPolarHBondContact CB-OG1 3.34Å; T400-T406 WeakPolarHBondContact CG2-OG1 3.44Å; T400-T406 WeakPolarHBondContact OG1-CB 3.32Å; T400-T406 PolarHBondContact OG1-O 3.01Å; T400-T406 PolarHBondContact OG1-OG1 3.5Å; G404-T406 PolarHBondContact O-N 3.35Å
407	V	61.5	Low	61.6	Low	84 Å²	84	84.5 Å²	84.5	51%	0.509	46%	0.457	S	S	.	.			trans	-144.9	150.2	178.8	-70.4	0	0	0	0	110.5	K409	V407-K409 PolarHBondContact O-N 3.22Å
408	P	66.6	Low	62.2	Low	36 Å²	36	85.1 Å²	85.1	23%	0.234	47%	0.466	C	S	.	.			trans	-63.8	106.2	177.4	24.4	-33.3	0	0	0	111.2	K414 A417	P408-K414 HydrophobicContact CB-CG 4.26Å; P408-K414 HydrophobicContact CG-CG 4.14Å; P408-K414 WeakPolarHBondContact O-CE 3.15Å; P408-K414 WeakPolarHBondContact O-CG 3.35Å; P408-A417 HydrophobicContact CG-CB 4.06Å
409	K	72.3	Confident	62.9	Low	191 Å²	191	89 Å²	89	83%	0.83	48%	0.48	S	S	*	.			trans	-73.7	-33.1	178.8	-64.6	-173.6	179.3	-179.5	0	112.5	V407	V407-K409 PolarHBondContact O-N 3.22Å
410	T	85	Confident	63.2	Low	90 Å²	90	89.1 Å²	89.1	55%	0.552	48%	0.481	S	S	*	.	S	Bend	trans	-81.2	147.7	-178.3	62.1	0	0	0	0	112.2	M412 G413 K414	T410-M412 VanDerWaalsContact C-N 3.34Å; T410-M412 PolarHBondContact O-N 2.7Å; T410-G413 PolarHBondContact O-N 3.06Å; T410-G413 PolarHBondContact OG1-N 3.02Å; T410-G413 VanDerWaalsContact OG1-N 3.12Å; T410-K414 WeakPolarHBondContact O-CG 3.49Å; T410-K414 PolarHBondContact O-N 3.03Å
411	W	78.7	Confident	63.3	Low	184 Å²	184	88.1 Å²	88.1	70%	0.697	48%	0.478	S	S	*	.	H	α-helix	trans	-62.1	-40.4	178	76.5	-77	0	0	0	112.3	K414 I415	W411-K414 PolarHBondContact O-N 3.36Å; W411-I415 HydrophobicContact CE3-CD1 3.7Å; W411-I415 HydrophobicContact CZ3-CD1 3.81Å; W411-I415 PolarHBondContact O-N 2.84Å; W411-I415 VanDerWaalsContact O-N 3.11Å
412	M	69.9	Low	63.9	Low	87 Å²	87	89.5 Å²	89.5	43%	0.429	48%	0.481	S	S	.	.	H	α-helix	trans	-59.4	-45	171.6	-63.9	-83.7	72.7	0	0	112.1	T410 K414 I415 I416	T410-M412 VanDerWaalsContact C-N 3.34Å; T410-M412 PolarHBondContact O-N 2.7Å; M412-K414 VanDerWaalsContact C-N 3.29Å; M412-K414 PolarHBondContact O-N 3.48Å; M412-I415 HydrophobicContact CE-CD1 3.91Å; M412-I415 PolarHBondContact O-N 2.99Å; M412-I416 WeakPolarHBondContact O-CG1 3.45Å; M412-I416 PolarHBondContact O-N 2.75Å
413	G	67.5	Low	64.1	Low	19 Å²	19	89.1 Å²	89.1	20%	0.196	47%	0.473	C	S	.	.	H	α-helix	trans	-61.6	-36.4	177.1	0	0	0	0	0	112.7	T410 A417	T410-G413 PolarHBondContact O-N 3.06Å; T410-G413 PolarHBondContact OG1-N 3.02Å; T410-G413 VanDerWaalsContact OG1-N 3.12Å; G413-A417 WeakPolarHBondContact O-CB 3.49Å; G413-A417 PolarHBondContact O-N 3.02Å
414	K	71.6	Confident	64.2	Low	128 Å²	128	81.1 Å²	81.1	56%	0.557	44%	0.442	S	S	*	.	H	α-helix	trans	-66.5	-41.6	175	-69.2	175	-178.5	-179.8	0	112.4	P408 T410 W411 M412 A417 A418	P408-K414 HydrophobicContact CB-CG 4.26Å; P408-K414 HydrophobicContact CG-CG 4.14Å; P408-K414 WeakPolarHBondContact O-CE 3.15Å; P408-K414 WeakPolarHBondContact O-CG 3.35Å; T410-K414 WeakPolarHBondContact O-CG 3.49Å; T410-K414 PolarHBondContact O-N 3.03Å; W411-K414 PolarHBondContact O-N 3.36Å; M412-K414 VanDerWaalsContact C-N 3.29Å; M412-K414 PolarHBondContact O-N 3.48Å; K414-A417 PolarHBondContact O-N 3.41Å; K414-A418 WeakPolarHBondContact O-CB 3.39Å; K414-A418 PolarHBondContact O-N 2.85Å
415	I	74.7	Confident	64.2	Low	71 Å²	71	83.2 Å²	83.2	36%	0.364	44%	0.44	S	S	.	.	H	α-helix	trans	-64.8	-47.9	176.9	-68.8	171	0	0	0	110.5	W411 M412 A417 A418 F419	W411-I415 HydrophobicContact CE3-CD1 3.7Å; W411-I415 HydrophobicContact CZ3-CD1 3.81Å; W411-I415 PolarHBondContact O-N 2.84Å; W411-I415 VanDerWaalsContact O-N 3.11Å; M412-I415 HydrophobicContact CE-CD1 3.91Å; M412-I415 PolarHBondContact O-N 2.99Å; I415-A417 PolarHBondContact O-N 3.39Å; I415-A418 PolarHBondContact O-N 2.64Å; I415-F419 HydrophobicContact CG2-CD2 3.82Å; I415-F419 HydrophobicContact CG2-CE2 3.94Å; I415-F419 WeakPolarHBondContact O-CD2 3.5Å; I415-F419 PolarHBondContact O-N 3.48Å
416	I	64	Low	64.2	Low	108 Å²	108	79.8 Å²	79.8	55%	0.554	43%	0.427	S	S	*	.	H	α-helix	trans	-60.4	-46.2	177.5	-65.5	164.9	0	0	0	110.2	M412 A418 F419 C420	M412-I416 WeakPolarHBondContact O-CG1 3.45Å; M412-I416 PolarHBondContact O-N 2.75Å; I416-A418 VanDerWaalsContact C-N 3.33Å; I416-A418 PolarHBondContact O-N 3.42Å; I416-F419 PolarHBondContact O-N 3.42Å; I416-C420 WeakPolarHBondContact O-CB 3.46Å; I416-C420 PolarHBondContact O-N 3.22Å; I416-C420 PolarHBondContact O-SG 2.86Å
417	A	59	Low	64.1	Low	15 Å²	15	80 Å²	80	12%	0.124	42%	0.422	C	S	.	.	H	α-helix	trans	-59.7	-39.6	176.2	0	0	0	0	0	112.9	C399 P408 G413 K414 I415 A421	C399-A417 HydrophobicContact CB-CB 4.04Å; P408-A417 HydrophobicContact CG-CB 4.06Å; G413-A417 WeakPolarHBondContact O-CB 3.49Å; G413-A417 PolarHBondContact O-N 3.02Å; K414-A417 PolarHBondContact O-N 3.41Å; I415-A417 PolarHBondContact O-N 3.39Å; A417-A421 WeakPolarHBondContact O-CB 3.26Å; A417-A421 PolarHBondContact O-N 3.09Å
418	A	64.4	Low	63.6	Low	52 Å²	52	79.9 Å²	79.9	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-67.1	-44.9	177.2	0	0	0	0	0	112.6	K414 I415 I416 A421 L422	K414-A418 WeakPolarHBondContact O-CB 3.39Å; K414-A418 PolarHBondContact O-N 2.85Å; I415-A418 PolarHBondContact O-N 2.64Å; I416-A418 VanDerWaalsContact C-N 3.33Å; I416-A418 PolarHBondContact O-N 3.42Å; A418-A421 PolarHBondContact O-N 2.71Å; A418-L422 WeakPolarHBondContact O-CG 3.37Å; A418-L422 PolarHBondContact O-N 2.81Å
419	F	65.5	Low	63.1	Low	149 Å²	149	80.8 Å²	80.8	65%	0.654	43%	0.425	S	S	*	.	H	α-helix	trans	-64.1	-44.3	175	-88.9	-75.2	0	0	0	112.1	I415 I416 L422 A423	I415-F419 HydrophobicContact CG2-CD2 3.82Å; I415-F419 HydrophobicContact CG2-CE2 3.94Å; I415-F419 WeakPolarHBondContact O-CD2 3.5Å; I415-F419 PolarHBondContact O-N 3.48Å; I416-F419 PolarHBondContact O-N 3.42Å; F419-L422 PolarHBondContact O-N 3.42Å; F419-A423 PolarHBondContact O-N 3.3Å
420	C	59.4	Low	62.8	Low	26 Å²	26	75.2 Å²	75.2	18%	0.176	40%	0.404	C	S	.	.	H	α-helix	trans	-57.8	-50.6	173.3	-69.8	0	0	0	0	110.4	L385 P395 I416 L422 A423 G424	L385-C420 HydrophobicContact CD2-CB 4.3Å; P395-C420 HydrophobicContact CB-CB 4.29Å; P395-C420 WeakPolarHBondContact CG-O 3.47Å; I416-C420 WeakPolarHBondContact O-CB 3.46Å; I416-C420 PolarHBondContact O-N 3.22Å; I416-C420 PolarHBondContact O-SG 2.86Å; C420-L422 PolarHBondContact O-N 2.88Å; C420-A423 PolarHBondContact O-N 3.2Å; C420-G424 PolarHBondContact O-N 3.4Å
421	A	56	Low	62.1	Low	25 Å²	25	72.4 Å²	72.4	21%	0.207	39%	0.387	C	S	.	.	H	α-helix	trans	-55.2	-46.7	178.8	0	0	0	0	0	112.9	A417 A418 G424 I425	A417-A421 WeakPolarHBondContact O-CB 3.26Å; A417-A421 PolarHBondContact O-N 3.09Å; A418-A421 PolarHBondContact O-N 2.71Å; A421-G424 PolarHBondContact O-N 3Å; A421-I425 WeakPolarHBondContact O-CB 3.08Å; A421-I425 WeakPolarHBondContact O-CD1 3.42Å; A421-I425 WeakPolarHBondContact O-CG1 3.46Å; A421-I425 PolarHBondContact O-N 3.43Å
422	L	63	Low	62	Low	112 Å²	112	66.8 Å²	66.8	59%	0.586	38%	0.38	S	S	*	.	H	α-helix	trans	-61.4	-43.3	176.8	-73.7	168.6	0	0	0	112.7	A418 F419 C420 S426	A418-L422 WeakPolarHBondContact O-CG 3.37Å; A418-L422 PolarHBondContact O-N 2.81Å; F419-L422 PolarHBondContact O-N 3.42Å; C420-L422 PolarHBondContact O-N 2.88Å; L422-S426 PolarHBondContact O-N 3.33Å; L422-S426 PolarHBondContact O-OG 3.04Å
423	A	54.8	Low	62.3	Low	37 Å²	37	64.1 Å²	64.1	31%	0.306	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-49.3	176.2	0	0	0	0	0	111.4	F419 C420 I425 S426 F427	F419-A423 PolarHBondContact O-N 3.3Å; C420-A423 PolarHBondContact O-N 3.2Å; A423-I425 PolarHBondContact O-N 3.34Å; A423-S426 WeakPolarHBondContact O-CB 3.34Å; A423-S426 PolarHBondContact O-N 2.98Å; A423-S426 VanDerWaalsContact O-N 3.08Å; A423-F427 VanDerWaalsContact O-CD2 3.26Å; A423-F427 WeakPolarHBondContact O-CD2 3.31Å; A423-F427 PolarHBondContact O-N 3.18Å
424	G	51.3	Low	63.1	Low	1 Å²	1	64.3 Å²	64.3	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-65.9	-35.3	-178.4	0	0	0	0	0	114	C420 A421 S426 F427 F428	C420-G424 PolarHBondContact O-N 3.4Å; A421-G424 PolarHBondContact O-N 3Å; G424-S426 VanDerWaalsContact C-N 3.25Å; G424-S426 PolarHBondContact O-N 3.45Å; G424-F427 PolarHBondContact O-N 3.27Å; G424-F428 WeakPolarHBondContact O-CB 3.5Å; G424-F428 PolarHBondContact O-N 3.13Å
425	I	52.5	Low	63.9	Low	99 Å²	99	60.3 Å²	60.3	51%	0.508	36%	0.356	S	S	.	.	H	α-helix	trans	-58.6	-40.4	171.3	-70.7	161.7	0	0	0	110.9	A421 A423	A421-I425 WeakPolarHBondContact O-CB 3.08Å; A421-I425 WeakPolarHBondContact O-CD1 3.42Å; A421-I425 WeakPolarHBondContact O-CG1 3.46Å; A421-I425 PolarHBondContact O-N 3.43Å; A423-I425 PolarHBondContact O-N 3.34Å
426	S	55.2	Low	64.5	Low	80 Å²	80	58.8 Å²	58.8	56%	0.559	36%	0.357	S	S	*	.	H	α-helix	trans	-68.7	-36.3	-175	-56.7	0	0	0	0	113.1	L422 A423 G424	L422-S426 PolarHBondContact O-N 3.33Å; L422-S426 PolarHBondContact O-OG 3.04Å; A423-S426 WeakPolarHBondContact O-CB 3.34Å; A423-S426 PolarHBondContact O-N 2.98Å; A423-S426 VanDerWaalsContact O-N 3.08Å; G424-S426 VanDerWaalsContact C-N 3.25Å; G424-S426 PolarHBondContact O-N 3.45Å
427	F	54.1	Low	65.7	Low	85 Å²	85	56.2 Å²	56.2	37%	0.373	35%	0.349	S	S	.	.	H	α-helix	trans	-97.5	-28.9	-177.5	-66.2	-72.4	0	0	0	114.3	S389 A423 G424 A429 L430	S389-F427 WeakPolarHBondContact O-CB 3.43Å; S389-F427 WeakPolarHBondContact O-CD2 3.37Å; S389-F427 WeakPolarHBondContact O-CG 3.43Å; A423-F427 VanDerWaalsContact O-CD2 3.26Å; A423-F427 WeakPolarHBondContact O-CD2 3.31Å; A423-F427 PolarHBondContact O-N 3.18Å; G424-F427 PolarHBondContact O-N 3.27Å; F427-A429 PolarHBondContact O-N 3.33Å; F427-A429 VanDerWaalsContact O-N 3.15Å; F427-L430 HydrophobicContact CD1-CD1 3.88Å; F427-L430 WeakPolarHBondContact O-CB 3.38Å; F427-L430 WeakPolarHBondContact O-CG 3.37Å; F427-L430 PolarHBondContact O-N 3.28Å
428	F	49.4	Very low	67.1	Low	82 Å²	82	55.7 Å²	55.7	36%	0.36	35%	0.345	S	S	.	.	H	α-helix	trans	-58.2	-29	175.8	176.1	-119	0	0	0	112.6	L393 G424 L430	L393-F428 HydrophobicContact CD2-CE2 4.01Å; L393-F428 HydrophobicContact CD2-CZ 3.92Å; G424-F428 WeakPolarHBondContact O-CB 3.5Å; G424-F428 PolarHBondContact O-N 3.13Å; F428-L430 PolarHBondContact O-N 2.91Å
429	A	57.2	Low	68.3	Low	55 Å²	55	56.3 Å²	56.3	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-69.4	-6	174.7	0	0	0	0	0	114.4	F427 G433	F427-A429 PolarHBondContact O-N 3.33Å; F427-A429 VanDerWaalsContact O-N 3.15Å; A429-G433 WeakPolarHBondContact O-CA 3.47Å; A429-G433 PolarHBondContact O-N 3.4Å
430	L	65.1	Low	69.4	Low	75 Å²	75	52 Å²	52	39%	0.393	33%	0.33	S	S	.	.	H	α-helix	trans	-71.7	-75.8	-173.7	-67.1	179.9	0	0	0	113.2	F427 F428 A432 G433 I434	F427-L430 HydrophobicContact CD1-CD1 3.88Å; F427-L430 WeakPolarHBondContact O-CB 3.38Å; F427-L430 WeakPolarHBondContact O-CG 3.37Å; F427-L430 PolarHBondContact O-N 3.28Å; F428-L430 PolarHBondContact O-N 2.91Å; L430-A432 VanDerWaalsContact C-N 3.35Å; L430-A432 PolarHBondContact O-N 3.07Å; L430-G433 PolarHBondContact O-N 3.36Å; L430-I434 HydrophobicContact CB-CD1 4.37Å; L430-I434 WeakPolarHBondContact O-CB 3.42Å; L430-I434 VanDerWaalsContact O-CD1 3.28Å; L430-I434 WeakPolarHBondContact O-CD1 3.29Å; L430-I434 WeakPolarHBondContact O-CG1 3.33Å; L430-I434 PolarHBondContact O-N 3.45Å
431	P	70.8	Confident	70.6	Confident	31 Å²	31	54.8 Å²	54.8	20%	0.201	34%	0.343	C	S	.	.	H	α-helix	trans	-59.6	-42.1	-176.5	-24.1	34.1	0	0	0	113.9	T321 L435	T321-P431 HydrophobicContact CG2-CG 4.25Å; P431-L435 WeakPolarHBondContact O-CG 3.39Å; P431-L435 PolarHBondContact O-N 3.49Å; P431-L435 VanDerWaalsContact O-N 3.13Å
432	A	75.8	Confident	71.8	Confident	66 Å²	66	55.9 Å²	55.9	55%	0.545	34%	0.343	S	S	.	.	H	α-helix	trans	-70.6	-39	-180	0	0	0	0	0	112.7	L430 G436	L430-A432 VanDerWaalsContact C-N 3.35Å; L430-A432 PolarHBondContact O-N 3.07Å; A432-G436 PolarHBondContact O-N 2.78Å
433	G	77.8	Confident	72.8	Confident	31 Å²	31	54.3 Å²	54.3	32%	0.32	34%	0.338	S	S	.	.	H	α-helix	trans	-82.4	-24.6	177.8	0	0	0	0	0	113.8	A429 L430 S437	A429-G433 WeakPolarHBondContact O-CA 3.47Å; A429-G433 PolarHBondContact O-N 3.4Å; L430-G433 PolarHBondContact O-N 3.36Å; G433-S437 WeakPolarHBondContact O-CA 3.48Å; G433-S437 WeakPolarHBondContact O-CB 3.38Å; G433-S437 PolarHBondContact O-N 3.13Å; G433-S437 PolarHBondContact O-OG 3.43Å
434	I	84.6	Confident	74	Confident	23 Å²	23	56.7 Å²	56.7	12%	0.118	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-53	165.6	-74.9	160.3	0	0	0	108.8	H314 E317 L430 S437 G438	H314-I434 HydrophobicContact CB-CG2 3.54Å; E317-I434 HydrophobicContact CB-CD1 3.81Å; E317-I434 HydrophobicContact CB-CG2 4.45Å; E317-I434 WeakPolarHBondContact OE2-CG2 3.47Å; L430-I434 HydrophobicContact CB-CD1 4.37Å; L430-I434 WeakPolarHBondContact O-CB 3.42Å; L430-I434 VanDerWaalsContact O-CD1 3.28Å; L430-I434 WeakPolarHBondContact O-CD1 3.29Å; L430-I434 WeakPolarHBondContact O-CG1 3.33Å; L430-I434 PolarHBondContact O-N 3.45Å; I434-S437 PolarHBondContact O-OG 3.1Å; I434-G438 PolarHBondContact O-N 3.05Å
435	L	87.4	Confident	75	Confident	44 Å²	44	62.2 Å²	62.2	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-64.4	-44.2	176.9	-67.8	176.3	0	0	0	111.6	V310 V311 P431 G438 F439	V310-L435 HydrophobicContact CG1-CD2 4.06Å; V311-L435 HydrophobicContact CG2-CD2 4Å; P431-L435 WeakPolarHBondContact O-CG 3.39Å; P431-L435 PolarHBondContact O-N 3.49Å; P431-L435 VanDerWaalsContact O-N 3.13Å; L435-G438 PolarHBondContact O-N 3.36Å; L435-F439 WeakPolarHBondContact O-CD2 3.39Å; L435-F439 PolarHBondContact O-N 3.1Å
436	G	88	Confident	75.9	Confident	38 Å²	38	62.2 Å²	62.2	39%	0.392	37%	0.366	S	S	.	.	H	α-helix	trans	-61.8	-46.2	178.8	0	0	0	0	0	113.5	A432 F439 A440	A432-G436 PolarHBondContact O-N 2.78Å; G436-F439 PolarHBondContact O-N 3.26Å; G436-A440 WeakPolarHBondContact O-CB 3.38Å; G436-A440 PolarHBondContact O-N 2.71Å
437	S	87.4	Confident	76.6	Confident	55 Å²	55	64.5 Å²	64.5	39%	0.385	37%	0.368	S	S	.	.	H	α-helix	trans	-68.5	-38.3	174.8	65	0	0	0	0	111.7	G433 I434 F439 A440 L441	G433-S437 WeakPolarHBondContact O-CA 3.48Å; G433-S437 WeakPolarHBondContact O-CB 3.38Å; G433-S437 PolarHBondContact O-N 3.13Å; G433-S437 PolarHBondContact O-OG 3.43Å; I434-S437 PolarHBondContact O-OG 3.1Å; S437-F439 PolarHBondContact O-N 2.83Å; S437-A440 PolarHBondContact O-N 3.32Å; S437-L441 VanDerWaalsContact O-CB 3.3Å; S437-L441 WeakPolarHBondContact O-CB 3.34Å; S437-L441 VanDerWaalsContact O-CG 3.27Å; S437-L441 WeakPolarHBondContact O-CG 3.49Å; S437-L441 PolarHBondContact O-N 2.92Å
438	G	89	Confident	77.1	Confident	4 Å²	4	68 Å²	68	4%	0.041	38%	0.379	C	S	.	.	H	α-helix	trans	-59	-44.1	172.1	0	0	0	0	0	112.8	H314 I434 L435 K442	H314-G438 WeakPolarHBondContact NE2-CA 3.49Å; I434-G438 PolarHBondContact O-N 3.05Å; L435-G438 PolarHBondContact O-N 3.36Å; G438-K442 WeakPolarHBondContact O-CB 3.38Å; G438-K442 PolarHBondContact O-N 3.01Å
439	F	90.3	Very high	77.7	Confident	64 Å²	64	68.2 Å²	68.2	28%	0.281	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-45.7	171.4	-78.3	-64.8	0	0	0	112.1	L306 L307 V310 L435 G436 S437 K442 V443	L306-F439 HydrophobicContact CD2-CD1 4.12Å; L306-F439 HydrophobicContact CD2-CE1 3.89Å; L306-F439 HydrophobicContact CG-CD1 4.31Å; L306-F439 HydrophobicContact CG-CE1 3.93Å; L307-F439 HydrophobicContact CB-CZ 4.4Å; L307-F439 HydrophobicContact CD1-CE2 4.31Å; L307-F439 HydrophobicContact CD1-CZ 3.81Å; V310-F439 HydrophobicContact CB-CE1 4.37Å; V310-F439 HydrophobicContact CB-CZ 4.45Å; V310-F439 HydrophobicContact CG1-CD2 4.45Å; V310-F439 HydrophobicContact CG1-CE2 4.46Å; V310-F439 HydrophobicContact CG2-CD1 3.81Å; V310-F439 HydrophobicContact CG2-CE1 3.87Å; V310-F439 HydrophobicContact CG2-CG 4.31Å; V310-F439 HydrophobicContact CG2-CZ 4.43Å; L435-F439 WeakPolarHBondContact O-CD2 3.39Å; L435-F439 PolarHBondContact O-N 3.1Å; G436-F439 PolarHBondContact O-N 3.26Å; S437-F439 PolarHBondContact O-N 2.83Å; F439-K442 PolarHBondContact O-N 3Å; F439-V443 WeakPolarHBondContact O-CG2 3.42Å; F439-V443 PolarHBondContact O-N 3.03Å
440	A	88	Confident	77.4	Confident	60 Å²	60	73.7 Å²	73.7	50%	0.496	39%	0.394	S	S	.	.	H	α-helix	trans	-61.5	-46.2	179.8	0	0	0	0	0	112.1	G436 S437 K442 V443 Q444	G436-A440 WeakPolarHBondContact O-CB 3.38Å; G436-A440 PolarHBondContact O-N 2.71Å; S437-A440 PolarHBondContact O-N 3.32Å; A440-K442 PolarHBondContact O-N 3.35Å; A440-V443 PolarHBondContact O-N 3.08Å; A440-Q444 WeakPolarHBondContact O-CB 3.39Å; A440-Q444 PolarHBondContact O-N 3.26Å
441	L	85	Confident	77.1	Confident	83 Å²	83	74.2 Å²	74.2	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-60.6	-42.8	174.3	-73.9	170.3	0	0	0	111.3	S437 Q444 Q445	S437-L441 VanDerWaalsContact O-CB 3.3Å; S437-L441 WeakPolarHBondContact O-CB 3.34Å; S437-L441 VanDerWaalsContact O-CG 3.27Å; S437-L441 WeakPolarHBondContact O-CG 3.49Å; S437-L441 PolarHBondContact O-N 2.92Å; L441-Q444 PolarHBondContact O-N 2.93Å; L441-Q445 WeakPolarHBondContact O-CB 3.38Å; L441-Q445 VanDerWaalsContact O-CG 3.26Å; L441-Q445 WeakPolarHBondContact O-CG 3.38Å; L441-Q445 PolarHBondContact O-N 3.26Å
442	K	81.9	Confident	76.6	Confident	49 Å²	49	77.1 Å²	77.1	21%	0.213	41%	0.408	C	S	.	.	H	α-helix	trans	-66.7	-38.6	178.5	-168.8	168.3	-177.4	177	0	112.7	L306 S309 V310 G438 F439 A440 H446	L306-K442 HydrophobicContact CD1-CD 3.92Å; L306-K442 PolarHBondContact O-NZ 2.95Å; L306-K442 VanDerWaalsContact O-NZ 3.07Å; S309-K442 PolarHBondContact OG-NZ 3.02Å; V310-K442 HydrophobicContact CG2-CD 3.6Å; G438-K442 WeakPolarHBondContact O-CB 3.38Å; G438-K442 PolarHBondContact O-N 3.01Å; F439-K442 PolarHBondContact O-N 3Å; A440-K442 PolarHBondContact O-N 3.35Å; K442-H446 WeakPolarHBondContact O-CB 3.28Å; K442-H446 PolarHBondContact O-N 3.21Å
443	V	82.3	Confident	76	Confident	79 Å²	79	80.2 Å²	80.2	48%	0.479	41%	0.414	S	S	.	.	H	α-helix	trans	-65.4	-42.9	171.4	171.5	0	0	0	0	110.8	F439 A440 H446 Q447	F439-V443 WeakPolarHBondContact O-CG2 3.42Å; F439-V443 PolarHBondContact O-N 3.03Å; A440-V443 PolarHBondContact O-N 3.08Å; V443-H446 PolarHBondContact O-N 3.31Å; V443-Q447 WeakPolarHBondContact O-CG 3.39Å; V443-Q447 PolarHBondContact O-N 3.22Å
444	Q	80.1	Confident	75.6	Confident	86 Å²	86	83.1 Å²	83.1	40%	0.402	42%	0.415	S	S	.	.	H	α-helix	trans	-64.3	-41.2	176.9	-163.2	-170.2	26.6	0	0	111.8	A440 L441 Q447 R448	A440-Q444 WeakPolarHBondContact O-CB 3.39Å; A440-Q444 PolarHBondContact O-N 3.26Å; L441-Q444 PolarHBondContact O-N 2.93Å; Q444-Q447 PolarHBondContact O-N 3.28Å; Q444-R448 VanDerWaalsContact NE2-NH2 3.15Å; Q444-R448 WeakPolarHBondContact O-CG 3.44Å; Q444-R448 PolarHBondContact O-N 2.79Å
445	Q	73.1	Confident	75.4	Confident	118 Å²	118	84 Å²	84	55%	0.551	42%	0.417	S	S	*	.	H	α-helix	trans	-59.7	-44.8	172.1	-76	173.2	1.3	0	0	111	L441 Q447 R448 Q449	L441-Q445 WeakPolarHBondContact O-CB 3.38Å; L441-Q445 VanDerWaalsContact O-CG 3.26Å; L441-Q445 WeakPolarHBondContact O-CG 3.38Å; L441-Q445 PolarHBondContact O-N 3.26Å; Q445-Q447 PolarHBondContact O-N 2.91Å; Q445-R448 WeakPolarHBondContact O-CB 3.09Å; Q445-R448 PolarHBondContact O-N 2.83Å; Q445-R448 VanDerWaalsContact O-N 3.14Å; Q445-Q449 WeakPolarHBondContact O-CG 3.36Å; Q445-Q449 PolarHBondContact O-N 3.07Å; Q445-Q449 VanDerWaalsContact O-N 3.16Å
446	H	71.2	Confident	75.3	Confident	98 Å²	98	90.8 Å²	90.8	45%	0.454	44%	0.439	S	S	.	.	H	α-helix	trans	-63.9	-39.5	176.5	-168.9	66.8	0	0	0	112.3	K442 V443 R448 Q449	K442-H446 WeakPolarHBondContact O-CB 3.28Å; K442-H446 PolarHBondContact O-N 3.21Å; V443-H446 PolarHBondContact O-N 3.31Å; H446-R448 VanDerWaalsContact C-N 3.3Å; H446-R448 PolarHBondContact O-N 2.98Å; H446-Q449 PolarHBondContact ND1-OE1 3.2Å; H446-Q449 WeakPolarHBondContact O-CB 3.49Å; H446-Q449 PolarHBondContact O-N 3.5Å
447	Q	70.6	Confident	75.2	Confident	128 Å²	128	93.8 Å²	93.8	60%	0.598	45%	0.45	S	S	*	.	H	α-helix	trans	-62.5	-34.6	172.3	-71.8	-179	-4.1	0	0	112.8	V443 Q444 Q445 Q449 K450	V443-Q447 WeakPolarHBondContact O-CG 3.39Å; V443-Q447 PolarHBondContact O-N 3.22Å; Q444-Q447 PolarHBondContact O-N 3.28Å; Q445-Q447 PolarHBondContact O-N 2.91Å; Q447-Q449 VanDerWaalsContact C-N 3.26Å; Q447-Q449 PolarHBondContact O-N 2.72Å; Q447-K450 WeakPolarHBondContact O-CG 3.41Å
448	R	64.6	Low	75.3	Confident	160 Å²	160	92.4 Å²	92.4	60%	0.604	44%	0.44	S	S	*	.	H	α-helix	trans	-69.3	-18	172.3	-67.1	175	-168.4	-167.1	7.5	112.8	Q444 Q445 H446 K450 H451	Q444-R448 VanDerWaalsContact NE2-NH2 3.15Å; Q444-R448 WeakPolarHBondContact O-CG 3.44Å; Q444-R448 PolarHBondContact O-N 2.79Å; Q445-R448 WeakPolarHBondContact O-CB 3.09Å; Q445-R448 PolarHBondContact O-N 2.83Å; Q445-R448 VanDerWaalsContact O-N 3.14Å; H446-R448 VanDerWaalsContact C-N 3.3Å; H446-R448 PolarHBondContact O-N 2.98Å; R448-K450 PolarHBondContact O-N 3.32Å; R448-H451 PolarHBondContact O-CD2 3.47Å
449	Q	61.2	Low	75.3	Confident	86 Å²	86	93.5 Å²	93.5	40%	0.402	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-72.9	8.9	178.5	-70.2	179.1	-10.4	0	0	115.3	Q445 H446 Q447 H451 L452	Q445-Q449 WeakPolarHBondContact O-CG 3.36Å; Q445-Q449 PolarHBondContact O-N 3.07Å; Q445-Q449 VanDerWaalsContact O-N 3.16Å; H446-Q449 PolarHBondContact ND1-OE1 3.2Å; H446-Q449 WeakPolarHBondContact O-CB 3.49Å; H446-Q449 PolarHBondContact O-N 3.5Å; Q447-Q449 VanDerWaalsContact C-N 3.26Å; Q447-Q449 PolarHBondContact O-N 2.72Å; Q449-H451 PolarHBondContact O-N 2.8Å; Q449-L452 PolarHBondContact O-N 3.35Å
450	K	51.4	Low	75.4	Confident	170 Å²	170	92.5 Å²	92.5	74%	0.739	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-53.6	-10.5	170.4	-74.9	179.2	178.9	-177.6	0	114.4	Q447 R448 L452	Q447-K450 WeakPolarHBondContact O-CG 3.41Å; R448-K450 PolarHBondContact O-N 3.32Å; K450-L452 PolarHBondContact O-N 3.14Å
451	H	58.1	Low	75.6	Confident	86 Å²	86	92.5 Å²	92.5	40%	0.398	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-65.5	14.2	169.8	-57.1	-65.5	0	0	0	116.7	R448 Q449 I453 R454 R455 Y695	R448-H451 PolarHBondContact O-CD2 3.47Å; Q449-H451 PolarHBondContact O-N 2.8Å; H451-I453 PolarHBondContact O-N 3.17Å; H451-R454 HydrophobicContact CB-CB 4.41Å; H451-R454 WeakPolarHBondContact O-CB 3.29Å; H451-R454 PolarHBondContact O-N 2.86Å; H451-R455 PolarHBondContact O-N 2.7Å; H451-Y695 HydrophobicContact CB-CE2 4.33Å; H451-Y695 AromaticContact CD2-CD2 3.54Å; H451-Y695 AromaticContact CD2-CE2 3.8Å; H451-Y695 AromaticContact CE1-CD2 3.65Å; H451-Y695 AromaticContact CE1-CE2 3.44Å; H451-Y695 VanDerWaalsContact CE1-CE2 3.44Å; H451-Y695 WeakPolarHBondContact CE1-CE2 3.18Å; H451-Y695 AromaticContact CG-CD2 3.85Å; H451-Y695 AromaticContact CG-CE2 3.61Å; H451-Y695 AromaticContact ND1-CD2 3.92Å; H451-Y695 AromaticContact ND1-CE2 3.38Å; H451-Y695 WeakPolarHBondContact ND1-CE2 2.98Å; H451-Y695 AromaticContact NE2-CD2 3.42Å; H451-Y695 WeakPolarHBondContact NE2-CD2 3.42Å; H451-Y695 AromaticContact NE2-CE2 3.71Å
452	L	60.6	Low	76	Confident	92 Å²	92	89.4 Å²	89.4	48%	0.482	43%	0.43	S	S	.	.	H	α-helix	trans	-50.6	-29.5	171.2	-71.4	177	0	0	0	113.1	Q449 K450 R455 R456	Q449-L452 PolarHBondContact O-N 3.35Å; K450-L452 PolarHBondContact O-N 3.14Å; L452-R455 PolarHBondContact O-N 3.13Å; L452-R456 PolarHBondContact O-N 3.25Å
453	I	64.1	Low	76.4	Confident	130 Å²	130	90.9 Å²	90.9	67%	0.667	44%	0.439	S	S	*	.	H	α-helix	trans	-63.5	-39.4	174	-59.1	176.2	0	0	0	111.7	H451 R455 R456	H451-I453 PolarHBondContact O-N 3.17Å; I453-R455 VanDerWaalsContact C-N 3.32Å; I453-R455 PolarHBondContact O-N 3.08Å; I453-R456 PolarHBondContact O-N 3.34Å
454	R	69.3	Low	76.8	Confident	93 Å²	93	91.4 Å²	91.4	35%	0.351	44%	0.436	S	S	.	.	H	α-helix	trans	-64	-36.2	177.3	-165.5	-172.9	-169.8	-167.5	3.1	111.4	H451 R456 P458 Y695 D699	H451-R454 HydrophobicContact CB-CB 4.41Å; H451-R454 WeakPolarHBondContact O-CB 3.29Å; H451-R454 PolarHBondContact O-N 2.86Å; R454-R456 VanDerWaalsContact C-N 3.34Å; R454-R456 PolarHBondContact O-N 3.43Å; R454-P458 WeakPolarHBondContact O-CD 3.33Å; R454-Y695 WeakPolarHBondContact CD-OH 3.45Å; R454-Y695 PolarHBondContact NE-OH 3.32Å; R454-Y695 VanDerWaalsContact NH1-CE1 3.3Å; R454-Y695 VanDerWaalsContact NH1-CE2 3.27Å; R454-D699 IonicContact CZ-OD2 3.24Å; R454-D699 VanDerWaalsContact CZ-OD2 3.26Å; R454-D699 IonicContact NH1-OD2 2.89Å; R454-D699 PolarHBondContact NH1-OD2 2.51Å; R454-D699 IonicContact NH2-OD2 3.84Å; R454-D699 PolarHBondContact NH2-OD2 3.17Å
455	R	80.3	Confident	77.3	Confident	42 Å²	42	88 Å²	88	16%	0.158	42%	0.422	C	S	.	.	H	α-helix	trans	-69.2	-26	-179.4	-70.6	177.1	177.6	176.7	-1.5	113.9	H451 L452 I453 V457 A459 A691 L692	H451-R455 PolarHBondContact O-N 2.7Å; L452-R455 PolarHBondContact O-N 3.13Å; I453-R455 VanDerWaalsContact C-N 3.32Å; I453-R455 PolarHBondContact O-N 3.08Å; R455-V457 PolarHBondContact O-N 3.31Å; R455-A459 VanDerWaalsContact O-CB 3.3Å; R455-A459 WeakPolarHBondContact O-CB 3.39Å; R455-A459 PolarHBondContact O-N 3.5Å; R455-A691 HydrophobicContact CG-CB 4.48Å; R455-A691 WeakPolarHBondContact CG-O 3.5Å; R455-A691 PolarHBondContact NE-O 3.45Å; R455-A691 VanDerWaalsContact NE-O 3.1Å; R455-L692 PolarHBondContact NH2-O 2.96Å
456	R	83.9	Confident	78.1	Confident	185 Å²	185	85.6 Å²	85.6	70%	0.698	41%	0.412	S	S	*	.	H	α-helix	trans	-61.2	-44.1	-174.6	-169.9	-176	-66.6	-179.1	-0.6	113.1	L452 I453 R454 A460	L452-R456 PolarHBondContact O-N 3.25Å; I453-R456 PolarHBondContact O-N 3.34Å; R454-R456 VanDerWaalsContact C-N 3.34Å; R454-R456 PolarHBondContact O-N 3.43Å; R456-A460 PolarHBondContact O-N 3.1Å; R456-A460 VanDerWaalsContact O-N 3.14Å
457	V	87.1	Confident	79	Confident	101 Å²	101	87.4 Å²	87.4	61%	0.612	42%	0.415	S	S	*	.	H	α-helix	trans	-72.9	-50	-175.9	-179.1	0	0	0	0	112	R455 A459 A460 T461	R455-V457 PolarHBondContact O-N 3.31Å; V457-A459 VanDerWaalsContact C-N 3.29Å; V457-A459 PolarHBondContact O-N 2.92Å; V457-A460 PolarHBondContact O-N 3.35Å; V457-T461 PolarHBondContact O-N 3.03Å; V457-T461 PolarHBondContact O-OG1 3.06Å; V457-T461 VanDerWaalsContact O-OG1 3.13Å
458	P	88.7	Confident	79.8	Confident	27 Å²	27	86.2 Å²	86.2	18%	0.175	41%	0.405	C	S	.	.	H	α-helix	trans	-58.4	-37.5	174.8	-25.8	36.5	0	0	0	113.5	R454 T461 L462 F688 A691	R454-P458 WeakPolarHBondContact O-CD 3.33Å; P458-T461 PolarHBondContact O-N 3.13Å; P458-L462 WeakPolarHBondContact O-CB 3.38Å; P458-L462 PolarHBondContact O-N 2.82Å; P458-F688 HydrophobicContact CB-CB 4.3Å; P458-F688 HydrophobicContact CB-CD2 4.3Å; P458-A691 HydrophobicContact CB-CB 4.26Å; P458-A691 HydrophobicContact CG-CB 3.95Å
459	A	90.2	Very high	80.8	Confident	26 Å²	26	80.1 Å²	80.1	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-61.7	-47.1	174.6	0	0	0	0	0	112.1	R455 V457 L462 I463 F688	R455-A459 VanDerWaalsContact O-CB 3.3Å; R455-A459 WeakPolarHBondContact O-CB 3.39Å; R455-A459 PolarHBondContact O-N 3.5Å; V457-A459 VanDerWaalsContact C-N 3.29Å; V457-A459 PolarHBondContact O-N 2.92Å; A459-L462 PolarHBondContact O-N 3.45Å; A459-I463 WeakPolarHBondContact O-CG1 3.38Å; A459-I463 PolarHBondContact O-N 2.96Å; A459-I463 VanDerWaalsContact O-N 3.08Å; A459-F688 HydrophobicContact CB-CD2 3.98Å; A459-F688 HydrophobicContact CB-CE2 3.69Å
460	A	92	Very high	82	Confident	43 Å²	43	80.6 Å²	80.6	36%	0.355	39%	0.385	S	S	.	.	H	α-helix	trans	-61.6	-44.5	176.6	0	0	0	0	0	111.7	R456 V457 L462 I463 Q464	R456-A460 PolarHBondContact O-N 3.1Å; R456-A460 VanDerWaalsContact O-N 3.14Å; V457-A460 PolarHBondContact O-N 3.35Å; A460-L462 PolarHBondContact O-N 2.82Å; A460-I463 PolarHBondContact O-N 2.85Å; A460-Q464 WeakPolarHBondContact O-CG 3.3Å; A460-Q464 PolarHBondContact O-N 2.87Å
461	T	91.9	Very high	83.6	Confident	60 Å²	60	72.7 Å²	72.7	37%	0.368	35%	0.352	S	S	.	.	H	α-helix	trans	-61.2	-43	176.5	-57	0	0	0	0	111.8	V457 P458 Q464 C465 A684	V457-T461 PolarHBondContact O-N 3.03Å; V457-T461 PolarHBondContact O-OG1 3.06Å; V457-T461 VanDerWaalsContact O-OG1 3.13Å; P458-T461 PolarHBondContact O-N 3.13Å; T461-Q464 PolarHBondContact O-N 3.2Å; T461-C465 WeakPolarHBondContact O-CB 3.46Å; T461-C465 PolarHBondContact O-N 2.83Å; T461-C465 PolarHBondContact O-SG 3.25Å; T461-C465 VanDerWaalsContact O-SG 3.39Å; T461-A684 HydrophobicContact CG2-CB 4.1Å
462	L	92.5	Very high	84.7	Confident	19 Å²	19	68.7 Å²	68.7	10%	0.099	33%	0.334	C	S	.	.	H	α-helix	trans	-59.4	-47.9	176.3	176.3	59	0	0	0	112	P458 A459 A460 Q464 C465 L466 F681 A684 R685 F688	P458-L462 WeakPolarHBondContact O-CB 3.38Å; P458-L462 PolarHBondContact O-N 2.82Å; A459-L462 PolarHBondContact O-N 3.45Å; A460-L462 PolarHBondContact O-N 2.82Å; L462-Q464 PolarHBondContact O-N 2.84Å; L462-C465 PolarHBondContact O-N 3.35Å; L462-L466 WeakPolarHBondContact O-CB 3.37Å; L462-L466 PolarHBondContact O-N 3.32Å; L462-F681 HydrophobicContact CD1-CD2 4.01Å; L462-F681 HydrophobicContact CD1-CE2 3.76Å; L462-A684 HydrophobicContact CB-CB 4.49Å; L462-A684 HydrophobicContact CD1-CB 4.42Å; L462-R685 HydrophobicContact CD1-CB 3.96Å; L462-R685 HydrophobicContact CD1-CG 4.48Å; L462-F688 HydrophobicContact CB-CB 4.44Å; L462-F688 HydrophobicContact CD2-CB 3.93Å; L462-F688 HydrophobicContact CD2-CD1 3.48Å; L462-F688 VanDerWaalsContact CD2-CD1 3.48Å; L462-F688 HydrophobicContact CD2-CE1 4.19Å; L462-F688 HydrophobicContact CD2-CG 3.79Å
463	I	92	Very high	85.7	Confident	79 Å²	79	67.2 Å²	67.2	41%	0.405	33%	0.327	S	S	.	.	H	α-helix	trans	-60.9	-45.7	177.7	-65.9	165.8	0	0	0	110.6	L89 A459 A460 L466 W467	L89-I463 HydrophobicContact CD2-CD1 4.09Å; A459-I463 WeakPolarHBondContact O-CG1 3.38Å; A459-I463 PolarHBondContact O-N 2.96Å; A459-I463 VanDerWaalsContact O-N 3.08Å; A460-I463 PolarHBondContact O-N 2.85Å; I463-L466 PolarHBondContact O-N 3.25Å; I463-W467 WeakPolarHBondContact O-CB 3.33Å; I463-W467 PolarHBondContact O-N 2.98Å
464	Q	90.1	Very high	86.2	Confident	91 Å²	91	65.5 Å²	65.5	43%	0.425	32%	0.324	S	S	.	.	H	α-helix	trans	-64.1	-42.3	178.2	-70.4	-178.9	23.4	0	0	112.6	A460 T461 L462 W467 R468	A460-Q464 WeakPolarHBondContact O-CG 3.3Å; A460-Q464 PolarHBondContact O-N 2.87Å; T461-Q464 PolarHBondContact O-N 3.2Å; L462-Q464 PolarHBondContact O-N 2.84Å; Q464-W467 PolarHBondContact O-N 3.46Å; Q464-R468 WeakPolarHBondContact O-CB 3.24Å; Q464-R468 VanDerWaalsContact O-CG 3.25Å; Q464-R468 WeakPolarHBondContact O-CG 3.41Å; Q464-R468 PolarHBondContact O-N 2.89Å
465	C	90	Very high	86.4	Confident	15 Å²	15	68 Å²	68	10%	0.101	34%	0.339	C	S	.	.	H	α-helix	trans	-66.1	-42.8	177.1	-75.2	0	0	0	0	111.6	T461 L462 W467 R468 C469 F681 A684	T461-C465 WeakPolarHBondContact O-CB 3.46Å; T461-C465 PolarHBondContact O-N 2.83Å; T461-C465 PolarHBondContact O-SG 3.25Å; T461-C465 VanDerWaalsContact O-SG 3.39Å; L462-C465 PolarHBondContact O-N 3.35Å; C465-W467 PolarHBondContact O-N 3.29Å; C465-R468 PolarHBondContact O-N 3.36Å; C465-C469 WeakPolarHBondContact O-CB 3.37Å; C465-C469 PolarHBondContact O-N 3.48Å; C465-C469 PolarHBondContact O-SG 2.97Å; C465-C469 VanDerWaalsContact O-SG 3.33Å; C465-F681 HydrophobicContact CB-CB 4.24Å; C465-A684 HydrophobicContact CB-CB 4.1Å
466	L	90.3	Very high	86	Confident	66 Å²	66	67.6 Å²	67.6	35%	0.346	34%	0.343	S	S	.	.	H	α-helix	trans	-58.9	-46.5	174.6	178.6	60.9	0	0	0	111.3	L462 I463 C469 Y470 F681	L462-L466 WeakPolarHBondContact O-CB 3.37Å; L462-L466 PolarHBondContact O-N 3.32Å; I463-L466 PolarHBondContact O-N 3.25Å; L466-C469 WeakPolarHBondContact O-CB 3.37Å; L466-C469 PolarHBondContact O-N 3.49Å; L466-Y470 PolarHBondContact O-N 3.33Å; L466-F681 HydrophobicContact CB-CD2 4.06Å; L466-F681 HydrophobicContact CB-CE2 4.01Å; L466-F681 HydrophobicContact CD1-CD2 4.3Å; L466-F681 HydrophobicContact CD1-CE2 3.79Å; L466-F681 HydrophobicContact CD1-CZ 4.29Å; L466-F681 HydrophobicContact CG-CE2 4.4Å
467	W	89.6	Confident	84.9	Confident	136 Å²	136	63.8 Å²	63.8	52%	0.515	34%	0.344	S	S	.	.	H	α-helix	trans	-64.2	-42.9	176.1	-174.7	84.6	0	0	0	112.3	I463 Q464 C465 C469 Y470 A471	I463-W467 WeakPolarHBondContact O-CB 3.33Å; I463-W467 PolarHBondContact O-N 2.98Å; Q464-W467 PolarHBondContact O-N 3.46Å; C465-W467 PolarHBondContact O-N 3.29Å; W467-C469 VanDerWaalsContact C-N 3.3Å; W467-C469 PolarHBondContact O-N 2.91Å; W467-Y470 PolarHBondContact O-N 3.36Å; W467-A471 HydrophobicContact CD2-CB 4.47Å; W467-A471 HydrophobicContact CE3-CB 4.47Å; W467-A471 HydrophobicContact CH2-CB 4.32Å; W467-A471 HydrophobicContact CZ2-CB 4.31Å; W467-A471 HydrophobicContact CZ3-CB 4.4Å; W467-A471 VanDerWaalsContact O-CB 3.28Å; W467-A471 WeakPolarHBondContact O-CB 3.3Å; W467-A471 PolarHBondContact O-N 2.95Å
468	R	87.4	Confident	84	Confident	104 Å²	104	60.5 Å²	60.5	39%	0.392	33%	0.326	S	S	.	.	H	α-helix	trans	-64.2	-31.6	176.5	-75.8	174.2	179.6	124.6	3.6	112.9	Q464 C465 A472 R677	Q464-R468 WeakPolarHBondContact O-CB 3.24Å; Q464-R468 VanDerWaalsContact O-CG 3.25Å; Q464-R468 WeakPolarHBondContact O-CG 3.41Å; Q464-R468 PolarHBondContact O-N 2.89Å; C465-R468 PolarHBondContact O-N 3.36Å; R468-A472 WeakPolarHBondContact O-CB 3.02Å; R468-R677 WeakPolarHBondContact O-CD 3.23Å; R468-R677 PolarHBondContact O-NH1 3.03Å
469	C	86.7	Confident	83.1	Confident	32 Å²	32	64.6 Å²	64.6	22%	0.216	35%	0.35	C	S	.	.	H	α-helix	trans	-68.4	-50.8	170.8	-75.3	0	0	0	0	111.5	C465 L466 W467 A471 A472 R677 F681	C465-C469 WeakPolarHBondContact O-CB 3.37Å; C465-C469 PolarHBondContact O-N 3.48Å; C465-C469 PolarHBondContact O-SG 2.97Å; C465-C469 VanDerWaalsContact O-SG 3.33Å; L466-C469 WeakPolarHBondContact O-CB 3.37Å; L466-C469 PolarHBondContact O-N 3.49Å; W467-C469 VanDerWaalsContact C-N 3.3Å; W467-C469 PolarHBondContact O-N 2.91Å; C469-A471 PolarHBondContact O-N 3.1Å; C469-A472 PolarHBondContact O-N 3.39Å; C469-A472 VanDerWaalsContact O-N 3.13Å; C469-R677 PolarHBondContact SG-O 3.22Å; C469-F681 VanDerWaalsContact SG-CB 3.59Å
470	Y	86.2	Confident	82.3	Confident	95 Å²	95	66.7 Å²	66.7	37%	0.373	37%	0.368	S	S	.	.	H	α-helix	trans	-60.2	-43.5	179.2	178.6	-102.4	0	0	0	112.3	L143 L466 W467 A472 D473	L143-Y470 HydrophobicContact CD1-CE1 4.45Å; L143-Y470 HydrophobicContact CD2-CE1 3.79Å; L143-Y470 HydrophobicContact CG-CE1 3.85Å; L466-Y470 PolarHBondContact O-N 3.33Å; W467-Y470 PolarHBondContact O-N 3.36Å; Y470-A472 PolarHBondContact O-N 2.85Å; Y470-A472 VanDerWaalsContact O-N 3.14Å; Y470-D473 VanDerWaalsContact O-CB 3.29Å; Y470-D473 WeakPolarHBondContact O-CB 3.24Å; Y470-D473 PolarHBondContact O-N 3.42Å
471	A	84.1	Confident	81.6	Confident	4 Å²	4	64.9 Å²	64.9	3%	0.033	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-4.9	178.5	0	0	0	0	0	114.3	W467 C469 S476 T481	W467-A471 HydrophobicContact CD2-CB 4.47Å; W467-A471 HydrophobicContact CE3-CB 4.47Å; W467-A471 HydrophobicContact CH2-CB 4.32Å; W467-A471 HydrophobicContact CZ2-CB 4.31Å; W467-A471 HydrophobicContact CZ3-CB 4.4Å; W467-A471 VanDerWaalsContact O-CB 3.28Å; W467-A471 WeakPolarHBondContact O-CB 3.3Å; W467-A471 PolarHBondContact O-N 2.95Å; C469-A471 PolarHBondContact O-N 3.1Å; A471-S476 PolarHBondContact O-OG 3.25Å; A471-T481 HydrophobicContact CB-CG2 4.45Å; A471-T481 WeakPolarHBondContact O-CB 3.23Å; A471-T481 WeakPolarHBondContact O-CG2 3.35Å; A471-T481 PolarHBondContact O-OG1 3.19Å
472	A	82.7	Confident	81	Confident	3 Å²	3	63.8 Å²	63.8	3%	0.025	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	7	175.3	0	0	0	0	0	113.3	R468 C469 Y470 T481 W482 R674	R468-A472 WeakPolarHBondContact O-CB 3.02Å; C469-A472 PolarHBondContact O-N 3.39Å; C469-A472 VanDerWaalsContact O-N 3.13Å; Y470-A472 PolarHBondContact O-N 2.85Å; Y470-A472 VanDerWaalsContact O-N 3.14Å; A472-T481 HydrophobicContact CB-CG2 4.01Å; A472-W482 HydrophobicContact CB-CH2 4.33Å; A472-W482 HydrophobicContact CB-CZ2 4.45Å; A472-R674 HydrophobicContact CB-CG 4.26Å; A472-R674 WeakPolarHBondContact O-CD 3.34Å; A472-R674 VanDerWaalsContact O-CG 3.32Å; A472-R674 WeakPolarHBondContact O-CG 3.45Å
473	D	81.2	Confident	80.2	Confident	61 Å²	61	69.7 Å²	69.7	33%	0.326	37%	0.366	S	S	.	.	S	Bend	trans	-55.6	137.4	168.2	-172.2	-46.6	0	0	0	109.8	Y470 H475 S476	Y470-D473 VanDerWaalsContact O-CB 3.29Å; Y470-D473 WeakPolarHBondContact O-CB 3.24Å; Y470-D473 PolarHBondContact O-N 3.42Å; D473-H475 PolarHBondContact O-N 2.95Å; D473-H475 WeakPolarHBondContact OD1-CB 3.37Å; D473-H475 IonicContact OD1-CD2 2.74Å; D473-H475 PolarHBondContact OD1-CD2 2.88Å; D473-H475 VanDerWaalsContact OD1-CD2 3.28Å; D473-H475 IonicContact OD1-CG 3.22Å; D473-H475 PolarHBondContact OD1-N 3.22Å; D473-S476 WeakPolarHBondContact O-CB 3.37Å; D473-S476 PolarHBondContact O-N 3.2Å
474	P	74.2	Confident	79.4	Confident	93 Å²	93	71.8 Å²	71.8	60%	0.604	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-25.9	174	-30	37.4	0	0	0	115.3
475	H	74.4	Confident	78.6	Confident	145 Å²	145	71 Å²	71	67%	0.671	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.1	176.4	-56.8	-64	0	0	0	113.8	D473	D473-H475 PolarHBondContact O-N 2.95Å; D473-H475 WeakPolarHBondContact OD1-CB 3.37Å; D473-H475 IonicContact OD1-CD2 2.74Å; D473-H475 PolarHBondContact OD1-CD2 2.88Å; D473-H475 VanDerWaalsContact OD1-CD2 3.28Å; D473-H475 IonicContact OD1-CG 3.22Å; D473-H475 PolarHBondContact OD1-N 3.22Å
476	S	70.6	Confident	77.7	Confident	34 Å²	34	72.7 Å²	72.7	24%	0.238	38%	0.38	C	S	.	.			trans	-88.8	118.5	-179.5	-167.6	0	0	0	0	112.2	A471 D473 S478	A471-S476 PolarHBondContact O-OG 3.25Å; D473-S476 WeakPolarHBondContact O-CB 3.37Å; D473-S476 PolarHBondContact O-N 3.2Å; S476-S478 PolarHBondContact O-N 3.39Å
477	S	61.4	Low	76.2	Confident	105 Å²	105	78.5 Å²	78.5	73%	0.734	40%	0.398	S	S	*	.			trans	-80.8	11	179.7	57.4	0	0	0	0	115	V479	S477-V479 PolarHBondContact O-N 2.88Å
478	S	67.9	Low	74.6	Confident	33 Å²	33	76.6 Å²	76.6	23%	0.231	40%	0.402	C	S	.	.			trans	-74.1	97.9	-173.7	171.7	0	0	0	0	112.5	S476 A480 T481	S476-S478 PolarHBondContact O-N 3.39Å; S478-A480 VanDerWaalsContact C-N 3.26Å; S478-A480 PolarHBondContact O-N 3.06Å; S478-T481 WeakPolarHBondContact CB-OG1 3.38Å; S478-T481 WeakPolarHBondContact O-CB 3.32Å; S478-T481 PolarHBondContact O-N 2.66Å; S478-T481 VanDerWaalsContact O-N 3.17Å; S478-T481 PolarHBondContact O-OG1 3.32Å; S478-T481 PolarHBondContact OG-N 3.28Å; S478-T481 PolarHBondContact OG-OG1 3.43Å
479	V	69.4	Low	72.7	Confident	112 Å²	112	77.1 Å²	77.1	68%	0.679	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-35.3	174.8	-177.1	0	0	0	0	111.9	S477 T481 W482 K483	S477-V479 PolarHBondContact O-N 2.88Å; V479-T481 PolarHBondContact O-N 2.92Å; V479-W482 PolarHBondContact O-N 2.84Å; V479-K483 PolarHBondContact O-N 3.22Å
480	A	74.3	Confident	70.8	Confident	71 Å²	71	87.1 Å²	87.1	59%	0.587	45%	0.445	S	S	*	.	H	α-helix	trans	-59.8	-27.5	177.5	0	0	0	0	0	113.2	S478 W482	S478-A480 VanDerWaalsContact C-N 3.26Å; S478-A480 PolarHBondContact O-N 3.06Å; A480-W482 PolarHBondContact O-N 3.36Å
481	T	77.1	Confident	68.4	Low	4 Å²	4	90.4 Å²	90.4	3%	0.025	46%	0.461	C	S	.	.	H	α-helix	trans	-56.9	-38	173.9	-60.6	0	0	0	0	112	A471 A472 S478 V479 R677	A471-T481 HydrophobicContact CB-CG2 4.45Å; A471-T481 WeakPolarHBondContact O-CB 3.23Å; A471-T481 WeakPolarHBondContact O-CG2 3.35Å; A471-T481 PolarHBondContact O-OG1 3.19Å; A472-T481 HydrophobicContact CB-CG2 4.01Å; S478-T481 WeakPolarHBondContact CB-OG1 3.38Å; S478-T481 WeakPolarHBondContact O-CB 3.32Å; S478-T481 PolarHBondContact O-N 2.66Å; S478-T481 VanDerWaalsContact O-N 3.17Å; S478-T481 PolarHBondContact O-OG1 3.32Å; S478-T481 PolarHBondContact OG-N 3.28Å; S478-T481 PolarHBondContact OG-OG1 3.43Å; V479-T481 PolarHBondContact O-N 2.92Å; T481-R677 PolarHBondContact O-NH2 3.02Å
482	W	79	Confident	66.3	Low	37 Å²	37	96 Å²	96	14%	0.14	50%	0.497	C	S	.	.	H	α-helix	trans	-97.3	-28	-169.1	-55.8	105.7	0	0	0	112.8	A472 V479 A480 I484 H485 M486 L665 K670 V673	A472-W482 HydrophobicContact CB-CH2 4.33Å; A472-W482 HydrophobicContact CB-CZ2 4.45Å; V479-W482 PolarHBondContact O-N 2.84Å; A480-W482 PolarHBondContact O-N 3.36Å; W482-I484 PolarHBondContact O-N 3.37Å; W482-I484 VanDerWaalsContact O-N 3.07Å; W482-H485 PolarHBondContact O-N 3.2Å; W482-M486 HydrophobicContact CB-CE 4.17Å; W482-L665 HydrophobicContact CE3-CD2 4.32Å; W482-K670 HydrophobicContact CE3-CG 4.12Å; W482-K670 HydrophobicContact CH2-CB 3.91Å; W482-K670 HydrophobicContact CH2-CD 4.39Å; W482-K670 HydrophobicContact CH2-CG 4.07Å; W482-K670 HydrophobicContact CZ3-CB 3.87Å; W482-K670 HydrophobicContact CZ3-CD 4.44Å; W482-K670 HydrophobicContact CZ3-CG 3.77Å; W482-V673 HydrophobicContact CZ3-CB 4.21Å; W482-V673 HydrophobicContact CZ3-CG1 3.91Å
483	K	75.2	Confident	64.3	Low	144 Å²	144	102.4 Å²	102.4	63%	0.626	54%	0.536	S	S	*	.	H	α-helix	trans	-54.7	-29.1	-179.7	-169.4	172.2	-178.2	175.7	0	114.1	V479 H485 M486	V479-K483 PolarHBondContact O-N 3.22Å; K483-H485 PolarHBondContact O-N 3.06Å; K483-M486 PolarHBondContact O-N 3.32Å
484	I	74.6	Confident	62.1	Low	123 Å²	123	102.2 Å²	102.2	63%	0.631	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.3	176.4	-59.1	170.8	0	0	0	112.2	W482	W482-I484 PolarHBondContact O-N 3.37Å; W482-I484 VanDerWaalsContact O-N 3.07Å
485	H	74.5	Confident	60.1	Low	75 Å²	75	106.2 Å²	106.2	35%	0.347	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98	-1.8	-175.9	-60.7	-78.1	0	0	0	113.1	W482 K483 L665 R677	W482-H485 PolarHBondContact O-N 3.2Å; K483-H485 PolarHBondContact O-N 3.06Å; H485-L665 HydrophobicContact CB-CD1 4.38Å; H485-L665 HydrophobicContact CB-CD2 3.84Å; H485-R677 PolarHBondContact CD2-NH2 3.23Å; H485-R677 PolarHBondContact NE2-NH2 3.4Å
486	M	71	Confident	58.4	Low	50 Å²	50	105 Å²	105	25%	0.246	57%	0.567	C	S	.	*	P	Polyproline II helix	trans	-91.4	121.6	179.6	-65.9	167.8	172.9	0	0	110.2	W482 K483 M662 L665	W482-M486 HydrophobicContact CB-CE 4.17Å; K483-M486 PolarHBondContact O-N 3.32Å; M486-M662 HydrophobicContact CB-CE 3.48Å; M486-M662 VanDerWaalsContact CB-CE 3.48Å; M486-M662 HydrophobicContact CG-CE 4.25Å; M486-M662 HydrophobicContact SD-CE 3.86Å; M486-L665 HydrophobicContact CE-CD1 4.16Å; M486-L665 HydrophobicContact CG-CD1 3.54Å
487	R	58.8	Low	56.5	Low	188 Å²	188	110.7 Å²	110.7	71%	0.709	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-96.8	136.2	173.8	-66.9	-175	-179.8	-174.8	1.2	110.7
488	P	55.3	Low	55.1	Low	95 Å²	95	110.6 Å²	110.6	62%	0.617	59%	0.594	S	S	*	*	B	Isolated β-bridge	trans	-75.5	132.4	169.1	30.9	-32.5	0	0	0	110.4	V660	P488-V660 HydrophobicContact CB-CG1 4.07Å
489	I	48.5	Very low	53.4	Low	116 Å²	116	119.1 Å²	119.1	60%	0.595	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-96.1	124.6	172.2	-62.7	175	0	0	0	108.6
490	R	45.6	Very low	51.4	Low	242 Å²	242	118.7 Å²	118.7	91%	0.913	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-81.2	120.9	160.5	-68.7	-177.7	178.6	178.6	-1	107.4
491	K	37.6	Very low	49.3	Very low	163 Å²	163	123.1 Å²	123.1	71%	0.709	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-65.9	134	172.1	-66.8	-177.7	-179.9	178.2	0	108.9
492	P	39.7	Very low	47.2	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-65	138.3	164.8	28.9	-32.4	0	0	0	108.7	G494	P492-G494 PolarHBondContact O-N 2.94Å
493	V	40	Very low	44.7	Very low	138 Å²	138	135.3 Å²	135.3	84%	0.836	70%	0.702	S	S	*	*			trans	-71.5	114.5	172.1	178.5	0	0	0	0	107.2
494	G	35.5	Very low	42.5	Very low	57 Å²	57	138.8 Å²	138.8	59%	0.588	71%	0.711	S	S	*	*			trans	-70.6	133.1	-179.9	0	0	0	0	0	111.5	P492 T496	P492-G494 PolarHBondContact O-N 2.94Å; G494-T496 PolarHBondContact O-N 2.88Å
495	L	31.7	Very low	40.3	Very low	177 Å²	177	138 Å²	138	93%	0.927	72%	0.717	S	S	*	*			trans	-71.6	114.5	160.4	-79	83.7	0	0	0	107.8
496	T	38.3	Very low	38.1	Very low	120 Å²	120	138 Å²	138	74%	0.736	74%	0.736	S	S	*	*			trans	-128.7	112.8	167.4	54.9	0	0	0	0	109.5	G494	G494-T496 PolarHBondContact O-N 2.88Å
497	N	30.1	Very low	36	Very low	154 Å²	154	144.5 Å²	144.5	82%	0.824	76%	0.764	S	S	*	*			trans	60	126.1	154.6	-58	-3.2	0	0	0	119.5
498	S	32.1	Very low	34.6	Very low	102 Å²	102	138.8 Å²	138.8	71%	0.713	75%	0.753	S	S	*	*				135	111.7	120.9	-71.3	0	0	0	0	115.1
499	Y	32.1	Very low	33.4	Very low	212 Å²	212	143.8 Å²	143.8	83%	0.831	76%	0.759	S	S	*	*			trans	58.5	113.6	139.6	-71.1	-87.4	0	0	0	121.5
500	S	29.3	Very low	32.6	Very low	103 Å²	103	146.3 Å²	146.3	72%	0.72	77%	0.766	S	S	*	*				74.7	125.2	126.3	67.2	0	0	0	0	122.1
501	M	29.1	Very low	31.8	Very low	164 Å²	164	137.4 Å²	137.4	81%	0.808	75%	0.75	S	S	*	*			trans	82.8	113.2	140.4	-70.1	-60.7	-176.2	0	0	121.3
502	T	32.3	Very low	31.4	Very low	124 Å²	124	139.3 Å²	139.3	76%	0.761	75%	0.753	S	S	*	*			trans	72.7	115.4	138.4	49.5	0	0	0	0	120.8
503	E	28.2	Very low	31.1	Very low	173 Å²	173	141.8 Å²	141.8	81%	0.808	75%	0.751	S	S	*	*			trans	-25.8	152.8	138.3	-46.1	-176.6	144.9	0	0	113.6
504	R	28.2	Very low	30.6	Very low	217 Å²	217	139.2 Å²	139.2	82%	0.819	74%	0.739	S	S	*	*			cis	-164.5	156.5	42.1	-146.6	178.5	-162.2	-172.9	3	110.5
505	S	27.5	Very low	30.5	Very low	108 Å²	108	142.5 Å²	142.5	76%	0.755	75%	0.749	S	S	*	*			trans	15.3	121	152.9	59.4	0	0	0	0	119.7
506	G	28.6	Very low	30.5	Very low	74 Å²	74	141.3 Å²	141.3	76%	0.763	74%	0.742	S	S	*	*			trans	169.4	113	157.1	0	0	0	0	0	117.6
507	F	28.1	Very low	30.1	Very low	186 Å²	186	144.2 Å²	144.2	82%	0.816	75%	0.745	S	S	*	*			trans	59.8	92.3	139.1	-107.9	-104.9	0	0	0	120.6
508	S	29.2	Very low	30	Very low	69 Å²	69	148.1 Å²	148.1	48%	0.483	75%	0.748	S	S	.	*				73.8	153.4	117.6	83.4	0	0	0	0	120
509	R	29.6	Very low	29.9	Very low	199 Å²	199	153.5 Å²	153.5	75%	0.751	75%	0.752	S	S	*	*			trans	64.3	133.6	153.7	-68.1	176.5	-68.1	175	2.3	115.7
510	F	31	Very low	29.8	Very low	169 Å²	169	149.3 Å²	149.3	74%	0.741	75%	0.749	S	S	*	*			cis	-129.3	160.2	-7.2	-79.2	-95.6	0	0	0	106
511	G	30.2	Very low	29.8	Very low	56 Å²	56	151.8 Å²	151.8	58%	0.577	75%	0.749	S	S	*	*			cis	111.2	123.7	18.7	0	0	0	0	0	110.5
512	R	29.4	Very low	29.8	Very low	203 Å²	203	153.7 Å²	153.7	77%	0.766	75%	0.753	S	S	*	*			trans	70.5	158.2	169.5	-44.9	168.1	-170.3	172.6	2.6	113.2
513	F	32.4	Very low	29.8	Very low	172 Å²	172	154.7 Å²	154.7	75%	0.754	76%	0.759	S	S	*	*			cis	-126	133.2	10.6	-80.1	-107.6	0	0	0	108.5
514	S	30.5	Very low	29.8	Very low	84 Å²	84	152.5 Å²	152.5	59%	0.587	76%	0.758	S	S	*	*				46.8	132.4	76.5	74	0	0	0	0	113
515	T	33.8	Very low	29.8	Very low	127 Å²	127	146.3 Å²	146.3	78%	0.779	75%	0.748	S	S	*	*				-156.6	136.1	52.1	39.8	0	0	0	0	108.3
516	L	29.8	Very low	29.9	Very low	151 Å²	151	148.1 Å²	148.1	79%	0.791	75%	0.749	S	S	*	*			cis	71.1	120.9	46.4	-133.2	170.7	0	0	0	113.6
517	K	30	Very low	29.9	Very low	182 Å²	182	149.5 Å²	149.5	79%	0.791	74%	0.743	S	S	*	*			trans	94	107	149.3	-147.4	170	-174.2	174.8	0	118.5
518	R	29.4	Very low	30	Very low	235 Å²	235	147.5 Å²	147.5	89%	0.887	74%	0.741	S	S	*	*				-168.2	102.8	103.7	-96.4	169.8	-158.9	170.8	6.6	110.7
519	R	28.9	Very low	30	Very low	215 Å²	215	149.3 Å²	149.3	81%	0.811	75%	0.749	S	S	*	*			trans	-113	116.7	149.9	-170.3	173.8	-175.9	166	2	106.1	E521	R519-E521 IonicContact NE-OE2 2.68Å; R519-E521 IonicContact NH2-OE2 3.99Å
520	T	29.6	Very low	30	Very low	124 Å²	124	146.7 Å²	146.7	76%	0.761	75%	0.75	S	S	*	*			trans	-120.4	108.6	175.9	33.7	0	0	0	0	107.4
521	E	31	Very low	29.9	Very low	156 Å²	156	144 Å²	144	73%	0.729	75%	0.747	S	S	*	*			trans	-134.3	131.2	162.5	-104.1	156.1	175.7	0	0	107.1	R519	R519-E521 IonicContact NE-OE2 2.68Å; R519-E521 IonicContact NH2-OE2 3.99Å
522	K	28.4	Very low	30	Very low	204 Å²	204	148 Å²	148	89%	0.887	76%	0.755	S	S	*	*			trans	-94.6	131.1	-179	-61	168.8	176.3	177.8	0	107.4
523	T	31.1	Very low	30.2	Very low	144 Å²	144	146 Å²	146	88%	0.883	76%	0.759	S	S	*	*			trans	-136.8	130.8	149.1	-39.8	0	0	0	0	109
524	T	29.6	Very low	30	Very low	128 Å²	128	145.7 Å²	145.7	79%	0.785	76%	0.764	S	S	*	*			trans	-77.9	151.7	-172	-35	0	0	0	0	111.3
525	S	27.2	Very low	30	Very low	86 Å²	86	147.6 Å²	147.6	60%	0.601	77%	0.772	S	S	*	*			trans	-67.2	149.1	168.8	51.4	0	0	0	0	113.1
526	N	29.8	Very low	29.8	Very low	146 Å²	146	147.6 Å²	147.6	78%	0.781	77%	0.774	S	S	*	*				-161.4	108.1	127.6	-88.4	-13.8	0	0	0	105.7
527	T	28.5	Very low	29.5	Very low	103 Å²	103	146.1 Å²	146.1	63%	0.632	77%	0.772	S	S	*	*				49.8	95.6	74.2	67	0	0	0	0	114.1
528	N	29.6	Very low	29.4	Very low	145 Å²	145	143.2 Å²	143.2	78%	0.775	77%	0.769	S	S	*	*				159.1	137.9	123.7	-79.8	-5.3	0	0	0	107.3
529	T	29.6	Very low	29.1	Very low	106 Å²	106	136.9 Å²	136.9	65%	0.65	76%	0.761	S	S	*	*			cis	-179.3	153.1	-3.2	20.7	0	0	0	0	103.6
530	N	29.4	Very low	29	Very low	145 Å²	145	132.3 Å²	132.3	78%	0.775	76%	0.757	S	S	*	*			trans	70.7	121.1	149.5	-72.9	-2.2	0	0	0	121.2
531	V	30.7	Very low	28.9	Very low	113 Å²	113	133.4 Å²	133.4	69%	0.685	76%	0.758	S	S	*	*				94.5	98.9	128.6	174.9	0	0	0	0	117.6
532	N	30.9	Very low	28.5	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	76%	0.763	S	S	*	*			trans	87.2	145.7	141	-62.5	-1.4	0	0	0	121.3
533	N	32.9	Very low	28.7	Very low	161 Å²	161	132.2 Å²	132.2	86%	0.861	76%	0.758	S	S	*	*			trans	82.4	105.8	164.9	-59.5	-12.5	0	0	0	118
534	I	28.9	Very low	28.5	Very low	167 Å²	167	131.8 Å²	131.8	86%	0.856	75%	0.751	S	S	*	*			trans	-89.6	108.3	180	-61.7	161.4	0	0	0	109.4
535	V	30.5	Very low	28.5	Very low	124 Å²	124	133.6 Å²	133.6	75%	0.752	76%	0.755	S	S	*	*			trans	-160.5	120.5	138.9	177.1	0	0	0	0	107.5	T537	V535-T537 PolarHBondContact O-N 3.34Å
536	P	29	Very low	28.4	Very low	127 Å²	127	138.3 Å²	138.3	83%	0.825	77%	0.768	S	S	*	*			trans	-81.8	115.4	179.4	31.4	-32.4	0	0	0	112.4
537	T	23.6	Very low	28.2	Very low	120 Å²	120	137.7 Å²	137.7	74%	0.736	77%	0.769	S	S	*	*			trans	-122.5	172.2	159.2	-52.6	0	0	0	0	107.5	V535	V535-T537 PolarHBondContact O-N 3.34Å
538	V	27.7	Very low	28.1	Very low	120 Å²	120	138.6 Å²	138.6	73%	0.727	78%	0.777	S	S	*	*			trans	80.6	111.5	-176.8	-168.2	0	0	0	0	111.4
539	S	24.1	Very low	27.9	Very low	103 Å²	103	141.6 Å²	141.6	72%	0.72	78%	0.783	S	S	*	*				80.7	150.2	56.3	-57	0	0	0	0	114.6
540	T	26	Very low	27.8	Very low	119 Å²	119	142.2 Å²	142.2	73%	0.73	79%	0.792	S	S	*	*			trans	62.1	126.3	172.6	48.1	0	0	0	0	115.7
541	D	29	Very low	27.6	Very low	147 Å²	147	139.4 Å²	139.4	79%	0.786	79%	0.789	S	S	*	*				-164.4	166.9	57.1	-95.8	-45.3	0	0	0	114.9
542	Y	22.3	Very low	27.4	Very low	214 Å²	214	139.7 Å²	139.7	84%	0.839	79%	0.793	S	S	*	*			trans	-80.4	160.4	170.5	-71.3	-98.3	0	0	0	111.9
543	P	32.5	Very low	27.4	Very low	120 Å²	120	140.1 Å²	140.1	78%	0.779	80%	0.8	S	S	*	*				-145.7	161.5	107.8	36	-20.9	0	0	0	116.1
544	N	26.7	Very low	27.3	Very low	136 Å²	136	140.1 Å²	140.1	73%	0.727	79%	0.793	S	S	*	*			trans	-76.8	149.5	174.3	-58.1	-50	0	0	0	112.3
545	N	29.4	Very low	27.4	Very low	165 Å²	165	136.4 Å²	136.4	88%	0.882	78%	0.781	S	S	*	*				-174.5	145.2	118.6	-96	-22.6	0	0	0	112.3
546	E	25.7	Very low	27.9	Very low	185 Å²	185	136.1 Å²	136.1	86%	0.864	77%	0.772	S	S	*	*			trans	-95.6	149	-168.3	-56.8	-175.5	132	0	0	113.6
547	T	25.9	Very low	28.4	Very low	133 Å²	133	134.8 Å²	134.8	82%	0.816	76%	0.758	S	S	*	*			trans	-163.3	155.6	146	8.9	0	0	0	0	108.5	K549	T547-K549 PolarHBondContact O-N 3.45Å
548	P	25.3	Very low	29.4	Very low	123 Å²	123	133.9 Å²	133.9	80%	0.799	75%	0.748	S	S	*	*			trans	-80.4	124.9	-139.1	28.3	-36.6	0	0	0	114.9	S550	P548-S550 PolarHBondContact O-N 3.04Å
549	K	26.6	Very low	30.1	Very low	207 Å²	207	133.4 Å²	133.4	90%	0.9	74%	0.741	S	S	*	*			trans	-72	113.6	166.5	-71.9	-179.7	179.1	175.3	0	110.2	T547 A551	T547-K549 PolarHBondContact O-N 3.45Å; K549-A551 PolarHBondContact O-N 2.84Å; K549-A551 VanDerWaalsContact O-N 3.1Å
550	S	26	Very low	31.2	Very low	119 Å²	119	130.3 Å²	130.3	83%	0.832	72%	0.718	S	S	*	*			trans	-56.1	110.9	162.7	52	0	0	0	0	109.7	P548	P548-S550 PolarHBondContact O-N 3.04Å
551	A	25.5	Very low	32	Very low	87 Å²	87	128 Å²	128	72%	0.719	70%	0.7	S	S	*	*			trans	-66.4	138.6	179.4	0	0	0	0	0	110.9	K549	K549-A551 PolarHBondContact O-N 2.84Å; K549-A551 VanDerWaalsContact O-N 3.1Å
552	P	27.3	Very low	32.5	Very low	118 Å²	118	127.9 Å²	127.9	77%	0.766	69%	0.69	S	S	*	*			trans	-65.9	144.6	174.8	28.5	-34.2	0	0	0	110.4	K554	P552-K554 PolarHBondContact O-N 2.99Å; P552-K554 VanDerWaalsContact O-N 3.13Å
553	V	30.3	Very low	33.6	Very low	147 Å²	147	120.5 Å²	120.5	89%	0.891	67%	0.674	S	S	*	*			trans	-60.5	115.1	177.7	177.7	0	0	0	0	109.2
554	K	30.3	Very low	34.2	Very low	162 Å²	162	119.6 Å²	119.6	70%	0.704	66%	0.658	S	S	*	*			trans	-70.1	139.3	176.3	-68.3	-178	179.5	179.1	0	110.6	P552 E556	P552-K554 PolarHBondContact O-N 2.99Å; P552-K554 VanDerWaalsContact O-N 3.13Å; K554-E556 HydrophobicContact CB-CG 3.92Å; K554-E556 PolarHBondContact O-N 3.17Å
555	S	31	Very low	35	Very low	88 Å²	88	116.7 Å²	116.7	62%	0.615	64%	0.641	S	S	*	*			trans	-77.4	48.9	179.9	54.3	0	0	0	0	113.6	D557 L558	S555-D557 PolarHBondContact O-N 3.39Å; S555-L558 PolarHBondContact O-N 3.39Å
556	E	42.2	Very low	35.6	Very low	118 Å²	118	112.8 Å²	112.8	55%	0.551	62%	0.62	S	S	*	*	H	α-helix	trans	-67.1	-3.5	-176.1	-62.2	-177.9	171.9	0	0	114.3	K554 V560 R680	K554-E556 HydrophobicContact CB-CG 3.92Å; K554-E556 PolarHBondContact O-N 3.17Å; E556-V560 WeakPolarHBondContact O-CG2 3.4Å; E556-R680 PolarHBondContact O-NH2 3.38Å
557	D	39.5	Very low	36.4	Very low	99 Å²	99	107.8 Å²	107.8	53%	0.529	60%	0.6	S	S	.	*	H	α-helix	trans	-80.5	-23.9	177.4	-66.2	-35.5	0	0	0	113	S555 I561 R680	S555-D557 PolarHBondContact O-N 3.39Å; D557-I561 WeakPolarHBondContact O-CG1 3.5Å; D557-R680 IonicContact OD1-CZ 2.7Å; D557-R680 VanDerWaalsContact OD1-CZ 3.22Å; D557-R680 IonicContact OD1-NH1 3.98Å; D557-R680 PolarHBondContact OD1-NH1 3.18Å; D557-R680 IonicContact OD1-NH2 3.01Å; D557-R680 PolarHBondContact OD1-NH2 2.95Å
558	L	43.6	Very low	37.1	Very low	101 Å²	101	108.3 Å²	108.3	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-82.2	-43.3	178.9	-92.8	160	0	0	0	112.9	S555 V560 I561 Y562	S555-L558 PolarHBondContact O-N 3.39Å; L558-V560 PolarHBondContact O-N 3.15Å; L558-I561 PolarHBondContact O-N 3.41Å; L558-Y562 PolarHBondContact O-N 2.82Å
559	D	42.5	Very low	37.5	Very low	110 Å²	110	108.2 Å²	108.2	59%	0.588	59%	0.585	S	S	*	*	H	α-helix	trans	-61.5	-30.2	-179.1	-59.7	-19.7	0	0	0	112.4	A563	D559-A563 WeakPolarHBondContact O-CB 3.3Å; D559-A563 PolarHBondContact O-N 2.8Å
560	V	47.5	Very low	37.8	Very low	39 Å²	39	103.5 Å²	103.5	24%	0.236	57%	0.574	C	S	.	*	H	α-helix	trans	-73.9	-29	177.5	175.8	0	0	0	0	112.1	E556 L558 F564 R680	E556-V560 WeakPolarHBondContact O-CG2 3.4Å; L558-V560 PolarHBondContact O-N 3.15Å; V560-F564 PolarHBondContact O-N 3.04Å; V560-R680 HydrophobicContact CG1-CG 4.27Å
561	I	42.2	Very low	38	Very low	69 Å²	69	103.8 Å²	103.8	35%	0.354	57%	0.571	S	S	.	*	H	α-helix	trans	-78.5	-46.6	175.6	-65.8	171.5	0	0	0	109.2	D557 L558 A563 F564 I565	D557-I561 WeakPolarHBondContact O-CG1 3.5Å; L558-I561 PolarHBondContact O-N 3.41Å; I561-A563 VanDerWaalsContact C-N 3.34Å; I561-A563 PolarHBondContact O-N 2.96Å; I561-F564 PolarHBondContact O-N 3.48Å; I561-I565 HydrophobicContact CG2-CD1 3.65Å; I561-I565 HydrophobicContact CG2-CG1 4.37Å; I561-I565 WeakPolarHBondContact O-CG1 3.37Å; I561-I565 PolarHBondContact O-N 3.26Å
562	Y	39.7	Very low	38.1	Very low	146 Å²	146	106.3 Å²	106.3	57%	0.573	57%	0.572	S	S	*	*	H	α-helix	trans	-58.7	-41.8	173.9	-98.2	-77.3	0	0	0	113	L558 F564 I565 N566	L558-Y562 PolarHBondContact O-N 2.82Å; Y562-F564 PolarHBondContact O-N 3.28Å; Y562-I565 PolarHBondContact O-N 3.34Å; Y562-N566 VanDerWaalsContact O-CB 3.27Å; Y562-N566 WeakPolarHBondContact O-CB 3.01Å; Y562-N566 PolarHBondContact O-N 3.03Å; Y562-N566 PolarHBondContact O-OD1 3.5Å
563	A	45.5	Very low	38.1	Very low	59 Å²	59	105.9 Å²	105.9	49%	0.488	57%	0.572	S	S	.	*	H	α-helix	trans	-71.6	-6.6	176.1	0	0	0	0	0	114.5	D559 I561	D559-A563 WeakPolarHBondContact O-CB 3.3Å; D559-A563 PolarHBondContact O-N 2.8Å; I561-A563 VanDerWaalsContact C-N 3.34Å; I561-A563 PolarHBondContact O-N 2.96Å
564	F	45.5	Very low	38.1	Very low	101 Å²	101	108.1 Å²	108.1	44%	0.443	57%	0.573	S	S	.	*	H	α-helix	trans	-100.1	-37.3	172.6	-125.6	-91.5	0	0	0	111.7	V560 I561 Y562 M679 V683	V560-F564 PolarHBondContact O-N 3.04Å; I561-F564 PolarHBondContact O-N 3.48Å; Y562-F564 PolarHBondContact O-N 3.28Å; F564-M679 HydrophobicContact CB-CE 3.77Å; F564-M679 HydrophobicContact CD1-CE 3.59Å; F564-M679 HydrophobicContact CD2-CE 3.27Å; F564-M679 HydrophobicContact CD2-CG 4.13Å; F564-M679 HydrophobicContact CE1-CE 3.89Å; F564-M679 HydrophobicContact CE2-CE 3.6Å; F564-M679 HydrophobicContact CE2-CG 3.52Å; F564-M679 HydrophobicContact CE2-SD 4.41Å; F564-M679 HydrophobicContact CG-CE 3.24Å; F564-M679 HydrophobicContact CZ-CE 3.89Å; F564-M679 HydrophobicContact CZ-CG 3.8Å; F564-V683 HydrophobicContact CD2-CG2 4.29Å; F564-V683 HydrophobicContact CE2-CG2 3.8Å
565	I	43.3	Very low	38.1	Very low	75 Å²	75	107.7 Å²	107.7	39%	0.385	58%	0.578	S	S	.	*	H	α-helix	trans	-69.3	-45.9	175.9	-65.7	170.6	0	0	0	110.3	I561 Y562 D567 E568	I561-I565 HydrophobicContact CG2-CD1 3.65Å; I561-I565 HydrophobicContact CG2-CG1 4.37Å; I561-I565 WeakPolarHBondContact O-CG1 3.37Å; I561-I565 PolarHBondContact O-N 3.26Å; Y562-I565 PolarHBondContact O-N 3.34Å; I565-D567 PolarHBondContact O-N 2.88Å; I565-E568 PolarHBondContact O-N 3.47Å
566	N	41.3	Very low	38	Very low	83 Å²	83	111.1 Å²	111.1	44%	0.444	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.4	-8	-177	-63.9	5.7	0	0	0	114.3	Y562	Y562-N566 VanDerWaalsContact O-CB 3.27Å; Y562-N566 WeakPolarHBondContact O-CB 3.01Å; Y562-N566 PolarHBondContact O-N 3.03Å; Y562-N566 PolarHBondContact O-OD1 3.5Å
567	D	42.6	Very low	37.5	Very low	80 Å²	80	111.1 Å²	111.1	43%	0.428	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.2	-17.8	177.9	-125.8	15.8	0	0	0	111.1	I565 T570 R686	I565-D567 PolarHBondContact O-N 2.88Å; D567-T570 PolarHBondContact O-OG1 3.48Å; D567-R686 IonicContact OD1-NH2 2.73Å; D567-R686 IonicContact OD2-CZ 2.68Å; D567-R686 IonicContact OD2-NH1 2.59Å; D567-R686 PolarHBondContact OD2-NH1 3.29Å; D567-R686 IonicContact OD2-NH2 3.27Å
568	E	41.3	Very low	37.1	Very low	144 Å²	144	113.4 Å²	113.4	67%	0.673	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-25.1	176.3	-74.1	-175.1	142.4	0	0	113.4	I565 T570	I565-E568 PolarHBondContact O-N 3.47Å; E568-T570 VanDerWaalsContact C-N 3.31Å; E568-T570 PolarHBondContact O-N 2.96Å
569	D	34.4	Very low	36.5	Very low	121 Å²	121	114.8 Å²	114.8	65%	0.647	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-1.3	-178.5	-77.6	-34.7	0	0	0	114.5
570	T	33.2	Very low	36.1	Very low	108 Å²	108	113.3 Å²	113.3	66%	0.663	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	6.1	-176.4	5.2	0	0	0	0	115.7	D567 E568	D567-T570 PolarHBondContact O-OG1 3.48Å; E568-T570 VanDerWaalsContact C-N 3.31Å; E568-T570 PolarHBondContact O-N 2.96Å
571	T	29.1	Very low	35.4	Very low	125 Å²	125	120.4 Å²	120.4	77%	0.767	66%	0.664	S	S	*	*			trans	-108.9	71	170.1	52.4	0	0	0	0	111.3
572	N	28.2	Very low	35	Very low	140 Å²	140	122 Å²	122	75%	0.749	68%	0.678	S	S	*	*			trans	-140.5	103.6	172.5	-97.6	-40.6	0	0	0	111.1
573	S	27.6	Very low	34.8	Very low	108 Å²	108	119.8 Å²	119.8	76%	0.755	68%	0.682	S	S	*	*	S	Bend		158.3	82.6	112.1	-164.1	0	0	0	0	112.4
574	Q	28.7	Very low	34.6	Very low	194 Å²	194	123 Å²	123	91%	0.907	69%	0.687	S	S	*	*			trans	-158.8	121.5	138.8	-111.8	177.2	4.3	0	0	108.4
575	N	30.4	Very low	34.2	Very low	153 Å²	153	124 Å²	124	82%	0.818	70%	0.696	S	S	*	*			trans	-81.3	122.9	-164.5	-57.9	-52.8	0	0	0	112.9
576	I	30.3	Very low	34	Very low	160 Å²	160	125.2 Å²	125.2	82%	0.821	70%	0.704	S	S	*	*			trans	-148.4	127.6	137	-53.6	-175.1	0	0	0	107.5
577	P	32	Very low	34	Very low	118 Å²	118	126.7 Å²	126.7	77%	0.766	71%	0.708	S	S	*	*			trans	-89.7	124.4	177.9	33.1	-31	0	0	0	112.5
578	D	30.2	Very low	34.1	Very low	148 Å²	148	128.4 Å²	128.4	79%	0.791	71%	0.711	S	S	*	*			trans	-90	122.2	176.3	-119.8	-14.8	0	0	0	111.4	G580	D578-G580 PolarHBondContact O-N 3.43Å
579	P	31.7	Very low	34.3	Very low	130 Å²	130	126.2 Å²	126.2	84%	0.844	70%	0.703	S	S	*	*			trans	-90.8	101.1	-177.1	33.8	-31.7	0	0	0	111.8
580	G	34.1	Very low	34.9	Very low	78 Å²	78	124.8 Å²	124.8	80%	0.804	70%	0.699	S	S	*	*			trans	-172.6	5.9	179.4	0	0	0	0	0	120.2	D578	D578-G580 PolarHBondContact O-N 3.43Å
581	K	32.7	Very low	35.4	Very low	189 Å²	189	125.2 Å²	125.2	82%	0.822	69%	0.691	S	S	*	*			trans	-125.6	127.4	-175.8	-137.8	176.1	-174.2	-176.3	0	111.8
582	P	33	Very low	36.1	Very low	102 Å²	102	121.8 Å²	121.8	66%	0.662	68%	0.676	S	S	*	*			trans	-69.4	130.8	-177.6	26.7	-33.4	0	0	0	111	E584	P582-E584 PolarHBondContact O-N 2.98Å; P582-E584 VanDerWaalsContact O-N 3.07Å
583	P	35.9	Very low	36.7	Very low	99 Å²	99	117.7 Å²	117.7	64%	0.643	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	5.3	-168.9	30.5	-37	0	0	0	115.1	L585 E587	P583-L585 VanDerWaalsContact C-N 3.35Å; P583-L585 PolarHBondContact O-N 3.34Å; P583-E587 PolarHBondContact O-N 3.43Å
584	E	41	Very low	37.4	Very low	126 Å²	126	115.7 Å²	115.7	59%	0.589	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-16.5	-163.1	-145.5	-160.1	155	0	0	115	P582 K588	P582-E584 PolarHBondContact O-N 2.98Å; P582-E584 VanDerWaalsContact O-N 3.07Å; E584-K588 VanDerWaalsContact CD-NZ 3.33Å; E584-K588 VanDerWaalsContact O-CD 3.25Å; E584-K588 WeakPolarHBondContact O-CD 3.42Å; E584-K588 VanDerWaalsContact O-CG 3.29Å; E584-K588 WeakPolarHBondContact O-CG 3.26Å; E584-K588 WeakPolarHBondContact OE1-CE 3.31Å; E584-K588 IonicContact OE1-NZ 3.96Å; E584-K588 PolarHBondContact OE1-NZ 3.13Å
585	L	37.6	Very low	38.2	Very low	122 Å²	122	113 Å²	113	64%	0.639	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-40.6	179.3	-160.6	71	0	0	0	111.7	P583 K588 I589	P583-L585 VanDerWaalsContact C-N 3.35Å; P583-L585 PolarHBondContact O-N 3.34Å; L585-K588 PolarHBondContact O-N 3.33Å; L585-I589 HydrophobicContact CG-CD1 4.33Å; L585-I589 WeakPolarHBondContact O-CG1 3.38Å; L585-I589 PolarHBondContact O-N 2.92Å
586	D	37.8	Very low	39	Very low	102 Å²	102	110.4 Å²	110.4	55%	0.545	62%	0.617	S	S	.	*	H	α-helix	trans	-77	-39.6	-174.5	-55.3	-35	0	0	0	110.6	K588 I589 V590	D586-K588 VanDerWaalsContact C-N 3.28Å; D586-K588 PolarHBondContact O-N 3.21Å; D586-I589 PolarHBondContact O-N 3.45Å; D586-I589 VanDerWaalsContact O-N 3.17Å; D586-V590 WeakPolarHBondContact O-CG2 3.36Å; D586-V590 PolarHBondContact O-N 3.05Å
587	E	43.1	Very low	39.5	Very low	113 Å²	113	107.3 Å²	107.3	53%	0.528	60%	0.602	S	S	.	*	H	α-helix	trans	-59.5	-39.1	172.5	-159.8	-156.2	144	0	0	111.4	P583 I589 V590 K591	P583-E587 PolarHBondContact O-N 3.43Å; E587-I589 PolarHBondContact O-N 3.37Å; E587-V590 PolarHBondContact O-N 2.68Å; E587-K591 WeakPolarHBondContact O-CB 3.23Å; E587-K591 PolarHBondContact O-N 2.89Å; E587-K591 IonicContact OE1-NZ 3.2Å; E587-K591 PolarHBondContact OE1-NZ 2.78Å
588	K	44	Very low	39.8	Very low	117 Å²	117	105.1 Å²	105.1	51%	0.509	59%	0.587	S	S	.	*	H	α-helix	trans	-69.5	-32.3	178.5	-73.2	177.4	-170.4	166.8	0	113	E584 L585 D586 A592	E584-K588 VanDerWaalsContact CD-NZ 3.33Å; E584-K588 VanDerWaalsContact O-CD 3.25Å; E584-K588 WeakPolarHBondContact O-CD 3.42Å; E584-K588 VanDerWaalsContact O-CG 3.29Å; E584-K588 WeakPolarHBondContact O-CG 3.26Å; E584-K588 WeakPolarHBondContact OE1-CE 3.31Å; E584-K588 IonicContact OE1-NZ 3.96Å; E584-K588 PolarHBondContact OE1-NZ 3.13Å; L585-K588 PolarHBondContact O-N 3.33Å; D586-K588 VanDerWaalsContact C-N 3.28Å; D586-K588 PolarHBondContact O-N 3.21Å; K588-A592 VanDerWaalsContact O-CB 3.25Å; K588-A592 WeakPolarHBondContact O-CB 3.48Å; K588-A592 PolarHBondContact O-N 3.33Å
589	I	45.4	Very low	40.2	Very low	98 Å²	98	103.4 Å²	103.4	50%	0.503	58%	0.577	S	S	.	*	H	α-helix	trans	-73.7	-43.5	176.5	-69.2	167.2	0	0	0	110.2	L585 D586 E587 A592 S593	L585-I589 HydrophobicContact CG-CD1 4.33Å; L585-I589 WeakPolarHBondContact O-CG1 3.38Å; L585-I589 PolarHBondContact O-N 2.92Å; D586-I589 PolarHBondContact O-N 3.45Å; D586-I589 VanDerWaalsContact O-N 3.17Å; E587-I589 PolarHBondContact O-N 3.37Å; I589-A592 PolarHBondContact O-N 2.99Å; I589-S593 PolarHBondContact O-N 3.07Å
590	V	46.5	Very low	40.2	Very low	91 Å²	91	102.6 Å²	102.6	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-63.8	-41.7	175.1	173.5	0	0	0	0	111.7	D586 E587 S593 S594	D586-V590 WeakPolarHBondContact O-CG2 3.36Å; D586-V590 PolarHBondContact O-N 3.05Å; E587-V590 PolarHBondContact O-N 2.68Å; V590-S593 PolarHBondContact O-N 3.19Å; V590-S593 PolarHBondContact O-OG 3.49Å; V590-S594 PolarHBondContact O-N 2.99Å; V590-S594 PolarHBondContact O-OG 3.49Å
591	K	45	Very low	40.4	Very low	117 Å²	117	103.6 Å²	103.6	51%	0.509	56%	0.556	S	S	.	*	H	α-helix	trans	-69.8	-32.5	178	-154.1	171.8	-144.2	151.8	0	112.4	E587 S594 E595	E587-K591 WeakPolarHBondContact O-CB 3.23Å; E587-K591 PolarHBondContact O-N 2.89Å; E587-K591 IonicContact OE1-NZ 3.2Å; E587-K591 PolarHBondContact OE1-NZ 2.78Å; K591-S594 PolarHBondContact O-OG 3.42Å; K591-S594 VanDerWaalsContact O-OG 3.13Å; K591-E595 PolarHBondContact O-N 3.24Å
592	A	44	Very low	40.3	Very low	53 Å²	53	103.7 Å²	103.7	44%	0.438	56%	0.556	S	S	.	*	H	α-helix	trans	-72.1	-31.4	171.4	0	0	0	0	0	113	K588 I589 L596	K588-A592 VanDerWaalsContact O-CB 3.25Å; K588-A592 WeakPolarHBondContact O-CB 3.48Å; K588-A592 PolarHBondContact O-N 3.33Å; I589-A592 PolarHBondContact O-N 2.99Å; A592-L596 WeakPolarHBondContact O-CD1 3.25Å; A592-L596 WeakPolarHBondContact O-CG 3.35Å; A592-L596 PolarHBondContact O-N 3.4Å
593	S	39.8	Very low	40.1	Very low	53 Å²	53	103.4 Å²	103.4	37%	0.371	55%	0.552	S	S	.	*	H	α-helix	trans	-74	-38.8	177	77.3	0	0	0	0	111.9	I589 V590 L596 L597	I589-S593 PolarHBondContact O-N 3.07Å; V590-S593 PolarHBondContact O-N 3.19Å; V590-S593 PolarHBondContact O-OG 3.49Å; S593-L596 PolarHBondContact O-N 3.21Å; S593-L597 PolarHBondContact O-N 2.95Å
594	S	42.6	Very low	39.7	Very low	66 Å²	66	109.4 Å²	109.4	46%	0.462	56%	0.562	S	S	.	*	H	α-helix	trans	-69.1	-29.7	177.6	65.3	0	0	0	0	113.7	V590 K591 P598	V590-S594 PolarHBondContact O-N 2.99Å; V590-S594 PolarHBondContact O-OG 3.49Å; K591-S594 PolarHBondContact O-OG 3.42Å; K591-S594 VanDerWaalsContact O-OG 3.13Å; S594-P598 WeakPolarHBondContact O-CD 3.29Å
595	E	45.9	Very low	39.1	Very low	138 Å²	138	109.2 Å²	109.2	65%	0.645	57%	0.57	S	S	*	*	H	α-helix	trans	-79	-27.7	172.3	-74.1	-163.5	-172.6	0	0	114.1	K591 I599	K591-E595 PolarHBondContact O-N 3.24Å; E595-I599 WeakPolarHBondContact O-CD1 3.36Å; E595-I599 WeakPolarHBondContact O-CG1 3.35Å
596	L	45.7	Very low	38.5	Very low	99 Å²	99	109.1 Å²	109.1	52%	0.518	58%	0.576	S	S	.	*	H	α-helix	trans	-79.6	-29.1	179.1	-75.6	171	0	0	0	113.5	A592 S593 I599 L600	A592-L596 WeakPolarHBondContact O-CD1 3.25Å; A592-L596 WeakPolarHBondContact O-CG 3.35Å; A592-L596 PolarHBondContact O-N 3.4Å; S593-L596 PolarHBondContact O-N 3.21Å; L596-I599 PolarHBondContact O-N 3.18Å; L596-L600 HydrophobicContact CB-CD1 4.48Å; L596-L600 WeakPolarHBondContact O-CB 3.49Å; L596-L600 WeakPolarHBondContact O-CG 3.16Å; L596-L600 PolarHBondContact O-N 3.43Å
597	L	42.2	Very low	38	Very low	95 Å²	95	110.8 Å²	110.8	50%	0.497	59%	0.585	S	S	.	*	H	α-helix	trans	-60.3	-45.5	-179.7	-86.7	162.1	0	0	0	114.2	S593 I599 T601	S593-L597 PolarHBondContact O-N 2.95Å; L597-I599 PolarHBondContact O-N 2.88Å; L597-T601 WeakPolarHBondContact O-CG2 3.48Å; L597-T601 PolarHBondContact O-N 2.9Å; L597-T601 VanDerWaalsContact O-N 3.15Å; L597-T601 PolarHBondContact O-OG1 3.42Å
598	P	37.2	Very low	37.2	Very low	72 Å²	72	112.1 Å²	112.1	47%	0.468	60%	0.596	S	S	.	*	H	α-helix	trans	-65.4	-34.6	174.6	-23.1	33.8	0	0	0	113.6	S594 T601 K602	S594-P598 WeakPolarHBondContact O-CD 3.29Å; P598-T601 WeakPolarHBondContact CA-OG1 3.34Å; P598-T601 PolarHBondContact O-OG1 2.83Å; P598-K602 PolarHBondContact O-N 3.31Å; P598-K602 VanDerWaalsContact O-N 3.16Å
599	I	38.4	Very low	36.5	Very low	111 Å²	111	115.4 Å²	115.4	57%	0.569	61%	0.605	S	S	*	*	H	α-helix	trans	-72.3	-39.5	-178.1	-61.6	174.3	0	0	0	110.3	E595 L596 L597	E595-I599 WeakPolarHBondContact O-CD1 3.36Å; E595-I599 WeakPolarHBondContact O-CG1 3.35Å; L596-I599 PolarHBondContact O-N 3.18Å; L597-I599 PolarHBondContact O-N 2.88Å
600	L	33	Very low	35.7	Very low	114 Å²	114	119.3 Å²	119.3	60%	0.597	62%	0.621	S	S	*	*	H	α-helix	trans	-75.1	-26.5	177.6	-72.9	164.9	0	0	0	113.4	L596	L596-L600 HydrophobicContact CB-CD1 4.48Å; L596-L600 WeakPolarHBondContact O-CB 3.49Å; L596-L600 WeakPolarHBondContact O-CG 3.16Å; L596-L600 PolarHBondContact O-N 3.43Å
601	T	36.6	Very low	34.6	Very low	99 Å²	99	121.5 Å²	121.5	61%	0.607	64%	0.639	S	S	*	*	H	α-helix	trans	-83.8	-26.2	178	46.4	0	0	0	0	114.1	L597 P598 V603	L597-T601 WeakPolarHBondContact O-CG2 3.48Å; L597-T601 PolarHBondContact O-N 2.9Å; L597-T601 VanDerWaalsContact O-N 3.15Å; L597-T601 PolarHBondContact O-OG1 3.42Å; P598-T601 WeakPolarHBondContact CA-OG1 3.34Å; P598-T601 PolarHBondContact O-OG1 2.83Å; T601-V603 PolarHBondContact O-N 3.3Å
602	K	32	Very low	33.8	Very low	190 Å²	190	119.7 Å²	119.7	83%	0.826	65%	0.646	S	S	*	*	S	Bend	trans	-71.4	-9.9	174.4	-104.9	174.1	176.6	172.3	0	114.9	P598 R604	P598-K602 PolarHBondContact O-N 3.31Å; P598-K602 VanDerWaalsContact O-N 3.16Å; K602-R604 PolarHBondContact O-N 2.93Å
603	V	29.4	Very low	33.1	Very low	96 Å²	96	123 Å²	123	58%	0.582	66%	0.661	S	S	*	*			trans	-91.4	44.7	178.2	-167.7	0	0	0	0	111.2	T601	T601-V603 PolarHBondContact O-N 3.3Å
604	R	26.4	Very low	32.4	Very low	225 Å²	225	127.4 Å²	127.4	85%	0.849	68%	0.681	S	S	*	*			trans	-110.1	110.5	173.6	-159.9	173.2	-154	139.4	7.5	109.6	K602	K602-R604 PolarHBondContact O-N 2.93Å
605	T	28.7	Very low	31.8	Very low	122 Å²	122	129.5 Å²	129.5	75%	0.748	70%	0.695	S	S	*	*			trans	-59.6	128.7	176.2	45.5	0	0	0	0	111.2	N607	T605-N607 PolarHBondContact O-N 3.46Å
606	P	24.6	Very low	30.8	Very low	120 Å²	120	130.7 Å²	130.7	78%	0.779	71%	0.705	S	S	*	*			trans	-77.8	111.7	162.2	31.5	-28.7	0	0	0	108
607	N	26.7	Very low	30.1	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	72%	0.721	S	S	*	*			trans	-159.2	154.1	164.4	-108.1	4.6	0	0	0	110	T605	T605-N607 PolarHBondContact O-N 3.46Å
608	D	27.9	Very low	29.2	Very low	140 Å²	140	132.9 Å²	132.9	75%	0.749	73%	0.732	S	S	*	*			trans	63.9	72.8	164.8	-49.1	-32.1	0	0	0	116.7
609	R	27.9	Very low	28.9	Very low	186 Å²	186	134.8 Å²	134.8	70%	0.702	75%	0.747	S	S	*	*			trans	-104	101.6	149.9	-135.7	175.3	-174.7	157.1	-7.7	108.5
610	Q	30	Very low	28.3	Very low	181 Å²	181	138.1 Å²	138.1	85%	0.846	76%	0.76	S	S	*	*			trans	-64.3	136.2	-179.4	-74.3	152.5	-54.8	0	0	111.4
611	C	23.1	Very low	28.2	Very low	137 Å²	137	137.3 Å²	137.3	93%	0.926	76%	0.764	S	S	*	*			trans	-68.3	137.4	157.8	-73.5	0	0	0	0	109.3
612	A	28.7	Very low	27.8	Very low	79 Å²	79	139.7 Å²	139.7	65%	0.653	77%	0.768	S	S	*	*			trans	-137.9	142.9	166.9	0	0	0	0	0	107.7
613	T	27.4	Very low	27.8	Very low	123 Å²	123	138.2 Å²	138.2	76%	0.755	76%	0.764	S	S	*	*			trans	61.7	129.4	163.5	53.7	0	0	0	0	116
614	D	25.2	Very low	27.8	Very low	145 Å²	145	139.7 Å²	139.7	78%	0.775	77%	0.767	S	S	*	*			cis	-159.9	-176.3	18.2	-97.6	-31.3	0	0	0	113
615	S	30.6	Very low	28	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	76%	0.761	S	S	*	*			trans	85.9	96.3	155.1	72.3	0	0	0	0	121.6
616	L	26	Very low	28.1	Very low	162 Å²	162	135.3 Å²	135.3	85%	0.848	76%	0.762	S	S	*	*				63.9	106.7	110.1	-156.1	79.9	0	0	0	119.3
617	S	29.2	Very low	28.4	Very low	124 Å²	124	135 Å²	135	87%	0.867	76%	0.763	S	S	*	*			trans	-166.5	148.8	131.3	22.5	0	0	0	0	112.5
618	T	24.5	Very low	28.6	Very low	117 Å²	117	138.5 Å²	138.5	72%	0.718	77%	0.772	S	S	*	*			trans	-102.1	147.3	-163.6	-50.1	0	0	0	0	112.8
619	S	30.4	Very low	28.8	Very low	111 Å²	111	137.6 Å²	137.6	78%	0.776	78%	0.776	S	S	*	*			trans	151.7	113.9	143.7	47.4	0	0	0	0	108.9
620	Q	26.9	Very low	28.9	Very low	182 Å²	182	132 Å²	132	85%	0.85	78%	0.776	S	S	*	*				77.5	146.6	57.9	-79.6	-161.6	-12.3	0	0	115.6
621	S	30.5	Very low	29.1	Very low	97 Å²	97	129.9 Å²	129.9	68%	0.678	77%	0.771	S	S	*	*			trans	78.4	133.4	171.1	-149.9	0	0	0	0	116.6
622	E	27.5	Very low	29.5	Very low	149 Å²	149	131.3 Å²	131.3	70%	0.696	76%	0.764	S	S	*	*			cis	-174.1	-172.8	-30.9	-113	157.6	137	0	0	108.9
623	H	32.5	Very low	29.4	Very low	158 Å²	158	132.4 Å²	132.4	73%	0.731	77%	0.766	S	S	*	*			trans	77.9	147	160.7	-63.8	-83.4	0	0	0	119.7
624	I	28.2	Very low	29.5	Very low	128 Å²	128	130.8 Å²	130.8	66%	0.656	77%	0.766	S	S	*	*			cis	-177.2	167.6	-45	-105.5	160.2	0	0	0	107.4
625	S	32.1	Very low	29.6	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	77%	0.772	S	S	*	*			trans	76.3	119.7	172.9	72.4	0	0	0	0	115.8
626	I	29.4	Very low	29.5	Very low	152 Å²	152	137.2 Å²	137.2	78%	0.779	78%	0.779	S	S	*	*			cis	93	104.9	25.2	-55.9	164	0	0	0	114.5
627	S	32.4	Very low	29.6	Very low	115 Å²	115	138.9 Å²	138.9	80%	0.804	78%	0.779	S	S	*	*			trans	167.1	109.7	141.2	51.7	0	0	0	0	108
628	K	30.6	Very low	29.6	Very low	211 Å²	211	141.4 Å²	141.4	92%	0.917	78%	0.777	S	S	*	*				64.4	98.1	58.1	-90.7	-166.5	176	-176.9	0	116.4
629	S	32.2	Very low	29.7	Very low	120 Å²	120	142.6 Å²	142.6	84%	0.839	78%	0.78	S	S	*	*			trans	173.6	122.5	143.7	-171.2	0	0	0	0	106.1
630	G	30.7	Very low	29.7	Very low	68 Å²	68	146.8 Å²	146.8	70%	0.701	78%	0.784	S	S	*	*				88.5	141	77.1	0	0	0	0	0	110.4
631	N	32.2	Very low	29.8	Very low	138 Å²	138	144.7 Å²	144.7	74%	0.738	78%	0.779	S	S	*	*			cis	-168.1	146.8	-13.2	-146.3	8.7	0	0	0	108.6
632	H	31.5	Very low	29.7	Very low	166 Å²	166	145.7 Å²	145.7	77%	0.769	79%	0.786	S	S	*	*			trans	59.6	164.2	169	-60.6	-75	0	0	0	117.7
633	S	27.6	Very low	30	Very low	102 Å²	102	144.6 Å²	144.6	71%	0.713	79%	0.792	S	S	*	*			cis	-167.1	170.7	-21	45	0	0	0	0	109.8
634	A	29.8	Very low	29.8	Very low	89 Å²	89	141.4 Å²	141.4	74%	0.736	79%	0.792	S	S	*	*			trans	65.7	117.8	171.9	0	0	0	0	0	116.8
635	Q	27.5	Very low	29.7	Very low	194 Å²	194	142.9 Å²	142.9	91%	0.907	80%	0.798	S	S	*	*				66.3	95.6	72.9	-77.8	-171.6	-23.6	0	0	115.5
636	Q	28.7	Very low	29.5	Very low	197 Å²	197	146.8 Å²	146.8	92%	0.921	80%	0.803	S	S	*	*			trans	-154.3	145.4	135.6	-120.6	175.5	5.5	0	0	111.5
637	K	26.7	Very low	29.6	Very low	196 Å²	196	146.7 Å²	146.7	85%	0.852	80%	0.799	S	S	*	*			trans	-149.9	101.7	-172.2	-178.3	-169.9	-178.6	-172.4	0	109.8
638	Q	29.4	Very low	29.4	Very low	177 Å²	177	149.3 Å²	149.3	83%	0.827	80%	0.798	S	S	*	*			trans	-141.2	121.6	165.2	-67.8	-176.9	-19.3	0	0	106
639	N	27.3	Very low	29.4	Very low	143 Å²	143	146.8 Å²	146.8	77%	0.765	80%	0.795	S	S	*	*				50.1	110.7	71.3	-79.6	3.9	0	0	0	113.2
640	F	30.8	Very low	29.2	Very low	198 Å²	198	145 Å²	145	87%	0.868	78%	0.78	S	S	*	*				-164.6	166.6	107.5	-124.3	-97.7	0	0	0	113.3
641	N	28.5	Very low	29.2	Very low	138 Å²	138	151.5 Å²	151.5	74%	0.738	79%	0.785	S	S	*	*			trans	-95.3	172	-173.9	-70.8	-55.2	0	0	0	113.7
642	S	28.3	Very low	29.3	Very low	119 Å²	119	153.6 Å²	153.6	83%	0.832	80%	0.795	S	S	*	*			trans	88.6	157.7	141.9	-82.2	0	0	0	0	119
643	P	32.8	Very low	29	Very low	126 Å²	126	152 Å²	152	82%	0.818	80%	0.802	S	S	*	*				-128.5	158	-127.2	42.4	-30.1	0	0	0	117.4
644	A	29	Very low	29	Very low	90 Å²	90	152.4 Å²	152.4	74%	0.744	81%	0.805	S	S	*	*			trans	-152.5	135.5	159.5	0	0	0	0	0	107
645	M	25.5	Very low	29.2	Very low	159 Å²	159	154 Å²	154	78%	0.783	81%	0.81	S	S	*	*				63.7	81.3	57.6	-163	-165.2	100.8	0	0	113.7
646	F	29.3	Very low	29.4	Very low	184 Å²	184	156.3 Å²	156.3	81%	0.807	81%	0.81	S	S	*	*			trans	-162.3	146.9	148.8	-96.3	-85.8	0	0	0	105
647	Q	32	Very low	29.4	Very low	151 Å²	151	150.6 Å²	150.6	71%	0.706	80%	0.804	S	S	*	*			cis	-178.2	157.9	-19.6	177.3	126.8	-32.3	0	0	103	D649	Q647-D649 PolarHBondContact O-N 2.9Å
648	H	27.7	Very low	29.7	Very low	169 Å²	169	146.7 Å²	146.7	78%	0.782	80%	0.802	S	S	*	*			trans	-60.2	125.6	176.5	-108.2	-105.2	0	0	0	112.3
649	D	29.7	Very low	30	Very low	159 Å²	159	146.5 Å²	146.5	85%	0.85	80%	0.801	S	S	*	*			trans	-115.5	101.4	154.8	-93.3	-33	0	0	0	108.8	Q647 Y651	Q647-D649 PolarHBondContact O-N 2.9Å; D649-Y651 PolarHBondContact O-N 3.36Å
650	P	29.4	Very low	31	Very low	82 Å²	82	144.4 Å²	144.4	53%	0.532	79%	0.793	S	S	.	*			trans	-93.3	37.4	-172.5	36.5	-34.2	0	0	0	113.9
651	Y	30.2	Very low	31.7	Very low	204 Å²	204	140 Å²	140	80%	0.8	78%	0.778	S	S	*	*			trans	-139.3	76.8	-176.4	-62.9	-74.3	0	0	0	114.6	D649	D649-Y651 PolarHBondContact O-N 3.36Å
652	L	33.2	Very low	32.9	Very low	182 Å²	182	137 Å²	137	95%	0.953	76%	0.76	S	S	*	*			trans	-163.5	68.3	152.6	-111.2	158.1	0	0	0	111
653	C	25.9	Very low	34.4	Very low	134 Å²	134	137 Å²	137	91%	0.905	75%	0.747	S	S	*	*			trans	-98.9	116.5	174.2	-163.4	0	0	0	0	110
654	S	27.5	Very low	36	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	74%	0.736	S	S	*	*			trans	156.3	85.4	141.8	-170.7	0	0	0	0	111.8
655	S	34.4	Very low	38	Very low	122 Å²	122	132 Å²	132	85%	0.853	71%	0.706	S	S	*	*	S	Bend	trans	-159.1	78	156.2	-87.4	0	0	0	0	110.9	G657	S655-G657 PolarHBondContact O-N 3.38Å
656	R	31.4	Very low	40.6	Very low	242 Å²	242	127.5 Å²	127.5	91%	0.913	69%	0.687	S	S	*	*			trans	30.8	84.2	160	-69.7	178.6	171.5	162	-2.4	116.7	S658	R656-S658 PolarHBondContact O-N 2.78Å
657	G	28.7	Very low	43.1	Very low	77 Å²	77	123.7 Å²	123.7	79%	0.794	67%	0.672	S	S	*	*			trans	-60.1	122.1	161	0	0	0	0	0	111	S655 E659	S655-G657 PolarHBondContact O-N 3.38Å; G657-E659 PolarHBondContact O-N 2.93Å
658	S	33	Very low	45.5	Very low	115 Å²	115	125 Å²	125	80%	0.804	68%	0.675	S	S	*	*			trans	-80.3	96.9	172.9	-70.5	0	0	0	0	110.1	R656 V660	R656-S658 PolarHBondContact O-N 2.78Å; S658-V660 PolarHBondContact O-N 2.84Å
659	E	35.5	Very low	48.1	Very low	172 Å²	172	121 Å²	121	80%	0.804	66%	0.657	S	S	*	*			trans	-57.7	120	168.9	-79.3	-169.1	125.6	0	0	110.8	G657 I661	G657-E659 PolarHBondContact O-N 2.93Å; E659-I661 PolarHBondContact O-N 3.42Å
660	V	47.6	Very low	50.7	Low	100 Å²	100	116.1 Å²	116.1	61%	0.606	63%	0.628	S	S	*	*			trans	-79.3	88.5	172.5	-177.8	0	0	0	0	108.4	P488 S658 M662	P488-V660 HydrophobicContact CB-CG1 4.07Å; S658-V660 PolarHBondContact O-N 2.84Å; V660-M662 HydrophobicContact CG1-SD 4.49Å; V660-M662 PolarHBondContact O-N 3.45Å
661	I	46.5	Very low	53.4	Low	105 Å²	105	116.5 Å²	116.5	54%	0.538	63%	0.625	S	S	.	*			trans	-65.9	104.3	173.8	-57.5	175.1	0	0	0	108.5	E659 H663	E659-I661 PolarHBondContact O-N 3.42Å; I661-H663 PolarHBondContact O-N 3.18Å
662	M	53.6	Low	56.2	Low	74 Å²	74	109.1 Å²	109.1	37%	0.365	61%	0.606	S	S	.	*	B	Isolated β-bridge	trans	-78.3	115.5	172.2	-68	-76.2	-77.3	0	0	108.5	M486 V660 P664	M486-M662 HydrophobicContact CB-CE 3.48Å; M486-M662 VanDerWaalsContact CB-CE 3.48Å; M486-M662 HydrophobicContact CG-CE 4.25Å; M486-M662 HydrophobicContact SD-CE 3.86Å; V660-M662 HydrophobicContact CG1-SD 4.49Å; V660-M662 PolarHBondContact O-N 3.45Å; M662-P664 WeakPolarHBondContact O-CD 3.37Å
663	H	59.1	Low	58.8	Low	119 Å²	119	101.1 Å²	101.1	55%	0.551	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-66.7	123.3	178.4	-147.8	-71	0	0	0	109.9	I661	I661-H663 PolarHBondContact O-N 3.18Å
664	P	67.2	Low	61.8	Low	93 Å²	93	98.1 Å²	98.1	60%	0.604	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-67	138.4	172.1	28.4	-33.2	0	0	0	109.1	M662	M662-P664 WeakPolarHBondContact O-CD 3.37Å
665	L	70.2	Confident	64.8	Low	19 Å²	19	97.1 Å²	97.1	10%	0.099	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-67.1	134.7	174.8	-85.6	72.3	0	0	0	110.1	W482 H485 M486 E669 K670 V673	W482-L665 HydrophobicContact CE3-CD2 4.32Å; H485-L665 HydrophobicContact CB-CD1 4.38Å; H485-L665 HydrophobicContact CB-CD2 3.84Å; M486-L665 HydrophobicContact CE-CD1 4.16Å; M486-L665 HydrophobicContact CG-CD1 3.54Å; L665-E669 WeakPolarHBondContact CA-OE2 3.25Å; L665-E669 HydrophobicContact CB-CB 4.24Å; L665-E669 HydrophobicContact CD2-CB 4.31Å; L665-E669 HydrophobicContact CG-CB 4.33Å; L665-K670 HydrophobicContact CB-CG 4.06Å; L665-K670 VanDerWaalsContact O-CE 3.25Å; L665-K670 WeakPolarHBondContact O-CE 3.49Å; L665-V673 HydrophobicContact CD2-CG2 4.37Å
666	T	80.7	Confident	67.4	Low	64 Å²	64	94.8 Å²	94.8	39%	0.393	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-66.2	157.2	173.3	68.7	0	0	0	0	111	K668 E669 K670	T666-K668 PolarHBondContact O-N 3.14Å; T666-E669 WeakPolarHBondContact CB-OE1 3.39Å; T666-E669 WeakPolarHBondContact CG2-OE1 3.28Å; T666-E669 PolarHBondContact N-OE2 2.88Å; T666-E669 WeakPolarHBondContact O-CB 3.39Å; T666-E669 PolarHBondContact O-N 3.21Å; T666-E669 VanDerWaalsContact O-N 3.11Å; T666-E669 WeakPolarHBondContact OG1-CG 3.46Å; T666-E669 PolarHBondContact OG1-N 3.25Å; T666-E669 PolarHBondContact OG1-OE1 3.41Å; T666-K670 WeakPolarHBondContact O-CG 3.47Å; T666-K670 PolarHBondContact O-N 3.49Å
667	E	81.9	Confident	70.2	Confident	105 Å²	105	84.1 Å²	84.1	49%	0.491	46%	0.46	S	S	.	.	H	α-helix	trans	-61.3	-30.7	176.2	-78.6	-54.8	137.7	0	0	112.6	K670 I671 R674	E667-K670 PolarHBondContact O-N 3.39Å; E667-K670 WeakPolarHBondContact OE1-CD 3.45Å; E667-K670 WeakPolarHBondContact OE1-CE 3.42Å; E667-K670 IonicContact OE1-NZ 3.58Å; E667-K670 PolarHBondContact OE1-NZ 2.89Å; E667-I671 VanDerWaalsContact O-CG1 3.26Å; E667-I671 WeakPolarHBondContact O-CG1 3.32Å; E667-I671 PolarHBondContact O-N 3.26Å; E667-R674 IonicContact OE2-NH2 2.7Å; E667-R674 PolarHBondContact OE2-NH2 2.93Å
668	K	82.8	Confident	73	Confident	177 Å²	177	85.5 Å²	85.5	77%	0.77	45%	0.445	S	S	*	.	H	α-helix	trans	-61.8	-46.7	172.5	-66	-175.3	179.1	-178.1	0	111.1	T666 I671 A672	T666-K668 PolarHBondContact O-N 3.14Å; K668-I671 PolarHBondContact O-N 3.13Å; K668-A672 PolarHBondContact O-N 2.87Å
669	E	82.7	Confident	75.8	Confident	85 Å²	85	82.4 Å²	82.4	40%	0.397	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-41.6	173.4	-71.7	144.8	-130.9	0	0	112.3	L665 T666 I671 A672 V673	L665-E669 WeakPolarHBondContact CA-OE2 3.25Å; L665-E669 HydrophobicContact CB-CB 4.24Å; L665-E669 HydrophobicContact CD2-CB 4.31Å; L665-E669 HydrophobicContact CG-CB 4.33Å; T666-E669 WeakPolarHBondContact CB-OE1 3.39Å; T666-E669 WeakPolarHBondContact CG2-OE1 3.28Å; T666-E669 PolarHBondContact N-OE2 2.88Å; T666-E669 WeakPolarHBondContact O-CB 3.39Å; T666-E669 PolarHBondContact O-N 3.21Å; T666-E669 VanDerWaalsContact O-N 3.11Å; T666-E669 WeakPolarHBondContact OG1-CG 3.46Å; T666-E669 PolarHBondContact OG1-N 3.25Å; T666-E669 PolarHBondContact OG1-OE1 3.41Å; E669-I671 VanDerWaalsContact C-N 3.29Å; E669-I671 PolarHBondContact O-N 3.27Å; E669-A672 PolarHBondContact O-N 3.47Å; E669-V673 WeakPolarHBondContact O-CB 3.44Å; E669-V673 WeakPolarHBondContact O-CG2 3.49Å; E669-V673 PolarHBondContact O-N 3.19Å
670	K	84.5	Confident	78.4	Confident	57 Å²	57	77.1 Å²	77.1	25%	0.248	39%	0.391	C	S	.	.	H	α-helix	trans	-64.2	-33.2	176.4	-65.2	-176	-155.3	162.2	0	112.4	W482 L665 T666 E667 R674	W482-K670 HydrophobicContact CE3-CG 4.12Å; W482-K670 HydrophobicContact CH2-CB 3.91Å; W482-K670 HydrophobicContact CH2-CD 4.39Å; W482-K670 HydrophobicContact CH2-CG 4.07Å; W482-K670 HydrophobicContact CZ3-CB 3.87Å; W482-K670 HydrophobicContact CZ3-CD 4.44Å; W482-K670 HydrophobicContact CZ3-CG 3.77Å; L665-K670 HydrophobicContact CB-CG 4.06Å; L665-K670 VanDerWaalsContact O-CE 3.25Å; L665-K670 WeakPolarHBondContact O-CE 3.49Å; T666-K670 WeakPolarHBondContact O-CG 3.47Å; T666-K670 PolarHBondContact O-N 3.49Å; E667-K670 PolarHBondContact O-N 3.39Å; E667-K670 WeakPolarHBondContact OE1-CD 3.45Å; E667-K670 WeakPolarHBondContact OE1-CE 3.42Å; E667-K670 IonicContact OE1-NZ 3.58Å; E667-K670 PolarHBondContact OE1-NZ 2.89Å; K670-R674 WeakPolarHBondContact O-CB 3.29Å; K670-R674 VanDerWaalsContact O-CG 3.31Å; K670-R674 WeakPolarHBondContact O-CG 3.48Å; K670-R674 PolarHBondContact O-N 3.09Å; K670-R674 VanDerWaalsContact O-N 3.11Å; K670-R674 PolarHBondContact O-NE 2.87Å
671	I	86.2	Confident	80.5	Confident	90 Å²	90	74 Å²	74	46%	0.462	37%	0.369	S	S	.	.	H	α-helix	trans	-67.8	-48.2	172.3	-69	165.5	0	0	0	109.8	E667 K668 E669 V673 R674 V675	E667-I671 VanDerWaalsContact O-CG1 3.26Å; E667-I671 WeakPolarHBondContact O-CG1 3.32Å; E667-I671 PolarHBondContact O-N 3.26Å; K668-I671 PolarHBondContact O-N 3.13Å; E669-I671 VanDerWaalsContact C-N 3.29Å; E669-I671 PolarHBondContact O-N 3.27Å; I671-V673 PolarHBondContact O-N 3.08Å; I671-R674 WeakPolarHBondContact O-CB 3.44Å; I671-R674 PolarHBondContact O-N 2.68Å; I671-R674 VanDerWaalsContact O-N 3.1Å; I671-V675 WeakPolarHBondContact O-CG2 3.47Å; I671-V675 PolarHBondContact O-N 3.29Å
672	A	88.3	Confident	82.6	Confident	50 Å²	50	73.3 Å²	73.3	41%	0.413	36%	0.363	S	S	.	.	H	α-helix	trans	-57.5	-46.7	176.9	0	0	0	0	0	112	K668 E669 R674 V675 I676	K668-A672 PolarHBondContact O-N 2.87Å; E669-A672 PolarHBondContact O-N 3.47Å; A672-R674 VanDerWaalsContact C-N 3.31Å; A672-R674 PolarHBondContact O-N 3.04Å; A672-V675 PolarHBondContact O-N 3.32Å; A672-V675 VanDerWaalsContact O-N 3.13Å; A672-I676 WeakPolarHBondContact O-CG1 3.22Å; A672-I676 PolarHBondContact O-N 2.93Å
673	V	87.4	Confident	84.4	Confident	14 Å²	14	71.8 Å²	71.8	9%	0.085	36%	0.357	C	S	.	.	H	α-helix	trans	-60.9	-37.3	175.5	170.4	0	0	0	0	112	W482 L665 E669 I671 R677	W482-V673 HydrophobicContact CZ3-CB 4.21Å; W482-V673 HydrophobicContact CZ3-CG1 3.91Å; L665-V673 HydrophobicContact CD2-CG2 4.37Å; E669-V673 WeakPolarHBondContact O-CB 3.44Å; E669-V673 WeakPolarHBondContact O-CG2 3.49Å; E669-V673 PolarHBondContact O-N 3.19Å; I671-V673 PolarHBondContact O-N 3.08Å; V673-R677 VanDerWaalsContact CG1-NE 3.29Å; V673-R677 WeakPolarHBondContact O-CB 3.4Å; V673-R677 WeakPolarHBondContact O-CG 3.41Å; V673-R677 PolarHBondContact O-N 3.04Å
674	R	89.1	Confident	85.9	Confident	71 Å²	71	66.4 Å²	66.4	27%	0.268	33%	0.333	S	S	.	.	H	α-helix	trans	-63.6	-43	173.5	-82.6	175.4	-86.7	166.3	-18.7	111.8	A472 E667 K670 I671 A672 R677 K678	A472-R674 HydrophobicContact CB-CG 4.26Å; A472-R674 WeakPolarHBondContact O-CD 3.34Å; A472-R674 VanDerWaalsContact O-CG 3.32Å; A472-R674 WeakPolarHBondContact O-CG 3.45Å; E667-R674 IonicContact OE2-NH2 2.7Å; E667-R674 PolarHBondContact OE2-NH2 2.93Å; K670-R674 WeakPolarHBondContact O-CB 3.29Å; K670-R674 VanDerWaalsContact O-CG 3.31Å; K670-R674 WeakPolarHBondContact O-CG 3.48Å; K670-R674 PolarHBondContact O-N 3.09Å; K670-R674 VanDerWaalsContact O-N 3.11Å; K670-R674 PolarHBondContact O-NE 2.87Å; I671-R674 WeakPolarHBondContact O-CB 3.44Å; I671-R674 PolarHBondContact O-N 2.68Å; I671-R674 VanDerWaalsContact O-N 3.1Å; A672-R674 VanDerWaalsContact C-N 3.31Å; A672-R674 PolarHBondContact O-N 3.04Å; R674-R677 PolarHBondContact O-N 2.92Å; R674-K678 PolarHBondContact O-N 2.96Å; R674-K678 VanDerWaalsContact O-N 3.08Å
675	V	89.6	Confident	87	Confident	89 Å²	89	65.9 Å²	65.9	54%	0.539	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-50.6	176.5	175	0	0	0	0	110.9	I671 A672 R677 K678 M679	I671-V675 WeakPolarHBondContact O-CG2 3.47Å; I671-V675 PolarHBondContact O-N 3.29Å; A672-V675 PolarHBondContact O-N 3.32Å; A672-V675 VanDerWaalsContact O-N 3.13Å; V675-R677 VanDerWaalsContact C-N 3.29Å; V675-R677 PolarHBondContact O-N 3.34Å; V675-K678 WeakPolarHBondContact O-CB 3.27Å; V675-K678 PolarHBondContact O-N 3.43Å; V675-K678 VanDerWaalsContact O-N 3.09Å; V675-M679 WeakPolarHBondContact O-CB 3.27Å; V675-M679 PolarHBondContact O-N 3.36Å
676	I	90.2	Very high	87.8	Confident	73 Å²	73	70.4 Å²	70.4	37%	0.374	34%	0.335	S	S	.	.	H	α-helix	trans	-57.4	-40.2	178.3	-67	163.7	0	0	0	111.5	A672 M679 R680	A672-I676 WeakPolarHBondContact O-CG1 3.22Å; A672-I676 PolarHBondContact O-N 2.93Å; I676-M679 WeakPolarHBondContact O-CB 3.44Å; I676-R680 WeakPolarHBondContact O-CB 3.27Å; I676-R680 WeakPolarHBondContact O-CG 3.43Å; I676-R680 PolarHBondContact O-N 2.93Å
677	R	88.8	Confident	88.1	Confident	17 Å²	17	73.3 Å²	73.3	6%	0.064	34%	0.342	C	S	.	.	H	α-helix	trans	-65.8	-44.3	176	-73.5	170.6	-173.3	-132.8	7.2	112	R468 C469 T481 H485 V673 R674 V675 M679 R680 F681	R468-R677 WeakPolarHBondContact O-CD 3.23Å; R468-R677 PolarHBondContact O-NH1 3.03Å; C469-R677 PolarHBondContact SG-O 3.22Å; T481-R677 PolarHBondContact O-NH2 3.02Å; H485-R677 PolarHBondContact CD2-NH2 3.23Å; H485-R677 PolarHBondContact NE2-NH2 3.4Å; V673-R677 VanDerWaalsContact CG1-NE 3.29Å; V673-R677 WeakPolarHBondContact O-CB 3.4Å; V673-R677 WeakPolarHBondContact O-CG 3.41Å; V673-R677 PolarHBondContact O-N 3.04Å; R674-R677 PolarHBondContact O-N 2.92Å; V675-R677 VanDerWaalsContact C-N 3.29Å; V675-R677 PolarHBondContact O-N 3.34Å; R677-M679 VanDerWaalsContact C-N 3.33Å; R677-M679 PolarHBondContact O-N 3.5Å; R677-R680 PolarHBondContact O-N 2.94Å; R677-F681 PolarHBondContact O-N 2.97Å
678	K	89.3	Confident	88.4	Confident	106 Å²	106	69.8 Å²	69.8	46%	0.461	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-42.5	177.8	-167.4	-177.1	-178.8	-169.9	0	111.5	R674 V675 F681 F682	R674-K678 PolarHBondContact O-N 2.96Å; R674-K678 VanDerWaalsContact O-N 3.08Å; V675-K678 WeakPolarHBondContact O-CB 3.27Å; V675-K678 PolarHBondContact O-N 3.43Å; V675-K678 VanDerWaalsContact O-N 3.09Å; K678-F681 PolarHBondContact O-N 3.38Å; K678-F682 HydrophobicContact CD-CE2 4.33Å; K678-F682 HydrophobicContact CG-CD2 4.28Å; K678-F682 HydrophobicContact CG-CE2 3.82Å; K678-F682 VanDerWaalsContact O-CD2 3.22Å; K678-F682 WeakPolarHBondContact O-CD2 3.5Å; K678-F682 PolarHBondContact O-N 3.46Å
679	M	90.4	Very high	88.5	Confident	51 Å²	51	67.4 Å²	67.4	25%	0.251	31%	0.311	S	S	.	.	H	α-helix	trans	-58.6	-52.5	172.2	-174.8	-174.4	-173.2	0	0	111.3	F564 V675 I676 R677 F681 F682 V683	F564-M679 HydrophobicContact CB-CE 3.77Å; F564-M679 HydrophobicContact CD1-CE 3.59Å; F564-M679 HydrophobicContact CD2-CE 3.27Å; F564-M679 HydrophobicContact CD2-CG 4.13Å; F564-M679 HydrophobicContact CE1-CE 3.89Å; F564-M679 HydrophobicContact CE2-CE 3.6Å; F564-M679 HydrophobicContact CE2-CG 3.52Å; F564-M679 HydrophobicContact CE2-SD 4.41Å; F564-M679 HydrophobicContact CG-CE 3.24Å; F564-M679 HydrophobicContact CZ-CE 3.89Å; F564-M679 HydrophobicContact CZ-CG 3.8Å; V675-M679 WeakPolarHBondContact O-CB 3.27Å; V675-M679 PolarHBondContact O-N 3.36Å; I676-M679 WeakPolarHBondContact O-CB 3.44Å; R677-M679 VanDerWaalsContact C-N 3.33Å; R677-M679 PolarHBondContact O-N 3.5Å; M679-F681 VanDerWaalsContact C-N 3.3Å; M679-F681 PolarHBondContact O-N 2.9Å; M679-F682 PolarHBondContact O-N 3.29Å; M679-F682 VanDerWaalsContact O-N 3.07Å; M679-V683 WeakPolarHBondContact O-CG2 3.44Å; M679-V683 PolarHBondContact O-N 2.84Å
680	R	90	Very high	88.4	Confident	60 Å²	60	66.5 Å²	66.5	23%	0.226	31%	0.307	C	S	.	.	H	α-helix	trans	-57.8	-36.4	174.5	-79.6	-179.1	156.1	158.6	-4	113.4	E556 D557 V560 I676 R677 A684	E556-R680 PolarHBondContact O-NH2 3.38Å; D557-R680 IonicContact OD1-CZ 2.7Å; D557-R680 VanDerWaalsContact OD1-CZ 3.22Å; D557-R680 IonicContact OD1-NH1 3.98Å; D557-R680 PolarHBondContact OD1-NH1 3.18Å; D557-R680 IonicContact OD1-NH2 3.01Å; D557-R680 PolarHBondContact OD1-NH2 2.95Å; V560-R680 HydrophobicContact CG1-CG 4.27Å; I676-R680 WeakPolarHBondContact O-CB 3.27Å; I676-R680 WeakPolarHBondContact O-CG 3.43Å; I676-R680 PolarHBondContact O-N 2.93Å; R677-R680 PolarHBondContact O-N 2.94Å; R680-A684 WeakPolarHBondContact O-CB 3.36Å; R680-A684 PolarHBondContact O-N 3.3Å
681	F	91.3	Very high	88.2	Confident	36 Å²	36	64.3 Å²	64.3	16%	0.158	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-42.8	173.1	164.1	-100.3	0	0	0	112.6	L462 C465 L466 C469 R677 K678 M679 A684 R685	L462-F681 HydrophobicContact CD1-CD2 4.01Å; L462-F681 HydrophobicContact CD1-CE2 3.76Å; C465-F681 HydrophobicContact CB-CB 4.24Å; L466-F681 HydrophobicContact CB-CD2 4.06Å; L466-F681 HydrophobicContact CB-CE2 4.01Å; L466-F681 HydrophobicContact CD1-CD2 4.3Å; L466-F681 HydrophobicContact CD1-CE2 3.79Å; L466-F681 HydrophobicContact CD1-CZ 4.29Å; L466-F681 HydrophobicContact CG-CE2 4.4Å; C469-F681 VanDerWaalsContact SG-CB 3.59Å; R677-F681 PolarHBondContact O-N 2.97Å; K678-F681 PolarHBondContact O-N 3.38Å; M679-F681 VanDerWaalsContact C-N 3.3Å; M679-F681 PolarHBondContact O-N 2.9Å; F681-A684 PolarHBondContact O-N 3.08Å; F681-R685 WeakPolarHBondContact O-CB 3.39Å; F681-R685 PolarHBondContact O-N 2.96Å
682	F	92.3	Very high	87.7	Confident	90 Å²	90	62.9 Å²	62.9	40%	0.395	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-41.1	175.7	-73.6	-56.6	0	0	0	112.4	K678 M679 R685 R686	K678-F682 HydrophobicContact CD-CE2 4.33Å; K678-F682 HydrophobicContact CG-CD2 4.28Å; K678-F682 HydrophobicContact CG-CE2 3.82Å; K678-F682 VanDerWaalsContact O-CD2 3.22Å; K678-F682 WeakPolarHBondContact O-CD2 3.5Å; K678-F682 PolarHBondContact O-N 3.46Å; M679-F682 PolarHBondContact O-N 3.29Å; M679-F682 VanDerWaalsContact O-N 3.07Å; F682-R685 PolarHBondContact O-N 2.81Å; F682-R686 PolarHBondContact O-N 3.3Å
683	V	91.1	Very high	87	Confident	41 Å²	41	67 Å²	67	25%	0.248	30%	0.297	C	S	.	.	H	α-helix	trans	-61	-46.4	173.3	175.7	0	0	0	0	111.1	F564 M679 R685 R686 K687	F564-V683 HydrophobicContact CD2-CG2 4.29Å; F564-V683 HydrophobicContact CE2-CG2 3.8Å; M679-V683 WeakPolarHBondContact O-CG2 3.44Å; M679-V683 PolarHBondContact O-N 2.84Å; V683-R685 VanDerWaalsContact C-N 3.3Å; V683-R685 PolarHBondContact O-N 3.34Å; V683-R686 PolarHBondContact O-N 3.26Å; V683-K687 HydrophobicContact CG1-CD 4.27Å; V683-K687 WeakPolarHBondContact O-CG 3.5Å; V683-K687 PolarHBondContact O-N 3.05Å
684	A	90.3	Very high	86	Confident	6 Å²	6	71.7 Å²	71.7	5%	0.05	33%	0.328	C	S	.	.	H	α-helix	trans	-62.4	-36.7	176.3	0	0	0	0	0	112.4	T461 L462 C465 R680 F681 F688	T461-A684 HydrophobicContact CG2-CB 4.1Å; L462-A684 HydrophobicContact CB-CB 4.49Å; L462-A684 HydrophobicContact CD1-CB 4.42Å; C465-A684 HydrophobicContact CB-CB 4.1Å; R680-A684 WeakPolarHBondContact O-CB 3.36Å; R680-A684 PolarHBondContact O-N 3.3Å; F681-A684 PolarHBondContact O-N 3.08Å; A684-F688 WeakPolarHBondContact O-CB 3.18Å; A684-F688 PolarHBondContact O-N 3.16Å
685	R	90.2	Very high	84.9	Confident	83 Å²	83	73.2 Å²	73.2	31%	0.313	34%	0.335	S	S	.	.	H	α-helix	trans	-68.8	-35.6	175.1	-168.3	179.7	73.8	152.5	1.7	112.3	L462 F681 F682 V683 R689	L462-R685 HydrophobicContact CD1-CB 3.96Å; L462-R685 HydrophobicContact CD1-CG 4.48Å; F681-R685 WeakPolarHBondContact O-CB 3.39Å; F681-R685 PolarHBondContact O-N 2.96Å; F682-R685 PolarHBondContact O-N 2.81Å; V683-R685 VanDerWaalsContact C-N 3.3Å; V683-R685 PolarHBondContact O-N 3.34Å; R685-R689 WeakPolarHBondContact O-CG 3.11Å; R685-R689 PolarHBondContact O-N 3.19Å; R685-R689 PolarHBondContact O-NE 2.85Å
686	R	87.7	Confident	83.9	Confident	114 Å²	114	73.6 Å²	73.6	43%	0.43	33%	0.334	S	S	.	.	H	α-helix	trans	-64.4	-55.8	171.9	175.1	169.2	171.6	-169.1	-6.4	110.3	D567 F682 V683 F688 R689 E690	D567-R686 IonicContact OD1-NH2 2.73Å; D567-R686 IonicContact OD2-CZ 2.68Å; D567-R686 IonicContact OD2-NH1 2.59Å; D567-R686 PolarHBondContact OD2-NH1 3.29Å; D567-R686 IonicContact OD2-NH2 3.27Å; F682-R686 PolarHBondContact O-N 3.3Å; V683-R686 PolarHBondContact O-N 3.26Å; R686-F688 VanDerWaalsContact C-N 3.29Å; R686-F688 PolarHBondContact O-N 3.35Å; R686-R689 PolarHBondContact O-N 3.16Å; R686-E690 WeakPolarHBondContact CD-OE1 3.46Å; R686-E690 VanDerWaalsContact CG-CD 3.48Å; R686-E690 WeakPolarHBondContact CG-OE1 3.45Å; R686-E690 IonicContact CZ-OE1 2.87Å; R686-E690 IonicContact NE-OE1 3.68Å; R686-E690 PolarHBondContact NE-OE1 3.32Å; R686-E690 IonicContact NH2-OE1 3.28Å; R686-E690 PolarHBondContact O-N 3.17Å
687	K	86.9	Confident	83.4	Confident	124 Å²	124	74.9 Å²	74.9	54%	0.539	35%	0.345	S	S	.	.	H	α-helix	trans	-57.9	-35	178.3	-68.4	-172.8	177.9	-171.3	0	114.1	V683 E690 A691	V683-K687 HydrophobicContact CG1-CD 4.27Å; V683-K687 WeakPolarHBondContact O-CG 3.5Å; V683-K687 PolarHBondContact O-N 3.05Å; K687-E690 VanDerWaalsContact CA-OE2 3.3Å; K687-E690 WeakPolarHBondContact CA-OE2 3.22Å; K687-E690 PolarHBondContact N-OE2 2.84Å; K687-A691 WeakPolarHBondContact O-CB 3.08Å; K687-A691 PolarHBondContact O-N 3.04Å
688	F	88.2	Confident	82.8	Confident	31 Å²	31	80.4 Å²	80.4	14%	0.136	37%	0.369	C	S	.	.	H	α-helix	trans	-69	-39.1	173.9	179.3	-113.6	0	0	0	112.8	P458 A459 L462 A684 R686 A691 L692	P458-F688 HydrophobicContact CB-CB 4.3Å; P458-F688 HydrophobicContact CB-CD2 4.3Å; A459-F688 HydrophobicContact CB-CD2 3.98Å; A459-F688 HydrophobicContact CB-CE2 3.69Å; L462-F688 HydrophobicContact CB-CB 4.44Å; L462-F688 HydrophobicContact CD2-CB 3.93Å; L462-F688 HydrophobicContact CD2-CD1 3.48Å; L462-F688 VanDerWaalsContact CD2-CD1 3.48Å; L462-F688 HydrophobicContact CD2-CE1 4.19Å; L462-F688 HydrophobicContact CD2-CG 3.79Å; A684-F688 WeakPolarHBondContact O-CB 3.18Å; A684-F688 PolarHBondContact O-N 3.16Å; R686-F688 VanDerWaalsContact C-N 3.29Å; R686-F688 PolarHBondContact O-N 3.35Å; F688-A691 PolarHBondContact O-N 3.25Å; F688-L692 HydrophobicContact CE1-CD1 4.19Å; F688-L692 HydrophobicContact CZ-CD1 4.45Å; F688-L692 HydrophobicContact CZ-CD2 4.43Å; F688-L692 PolarHBondContact O-N 3.03Å
689	R	85	Confident	82.3	Confident	128 Å²	128	77 Å²	77	48%	0.483	36%	0.356	S	S	.	.	H	α-helix	trans	-70.2	-38.5	175.8	-71.9	-179.1	-62.3	-175.4	11.9	112.3	R685 R686 A691 L692	R685-R689 WeakPolarHBondContact O-CG 3.11Å; R685-R689 PolarHBondContact O-N 3.19Å; R685-R689 PolarHBondContact O-NE 2.85Å; R686-R689 PolarHBondContact O-N 3.16Å; R689-A691 VanDerWaalsContact C-N 3.33Å; R689-A691 PolarHBondContact O-N 3.28Å; R689-L692 WeakPolarHBondContact O-CB 3.46Å; R689-L692 PolarHBondContact O-N 2.88Å; R689-L692 VanDerWaalsContact O-N 3.1Å
690	E	79.7	Confident	81.8	Confident	66 Å²	66	78.9 Å²	78.9	31%	0.308	37%	0.37	S	S	.	.	H	α-helix	trans	-60.4	-43.5	172.5	-72.5	154.2	174.3	0	0	110.6	R686 K687 L692 R693	R686-E690 WeakPolarHBondContact CD-OE1 3.46Å; R686-E690 VanDerWaalsContact CG-CD 3.48Å; R686-E690 WeakPolarHBondContact CG-OE1 3.45Å; R686-E690 IonicContact CZ-OE1 2.87Å; R686-E690 IonicContact NE-OE1 3.68Å; R686-E690 PolarHBondContact NE-OE1 3.32Å; R686-E690 IonicContact NH2-OE1 3.28Å; R686-E690 PolarHBondContact O-N 3.17Å; K687-E690 VanDerWaalsContact CA-OE2 3.3Å; K687-E690 WeakPolarHBondContact CA-OE2 3.22Å; K687-E690 PolarHBondContact N-OE2 2.84Å; E690-L692 PolarHBondContact O-N 3.32Å; E690-L692 VanDerWaalsContact O-N 3.13Å; E690-R693 WeakPolarHBondContact O-CB 3.32Å; E690-R693 PolarHBondContact O-N 3.36Å
691	A	80.4	Confident	81.5	Confident	10 Å²	10	81.2 Å²	81.2	8%	0.083	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-10.1	174.6	0	0	0	0	0	115.3	R455 P458 K687 F688 R689	R455-A691 HydrophobicContact CG-CB 4.48Å; R455-A691 WeakPolarHBondContact CG-O 3.5Å; R455-A691 PolarHBondContact NE-O 3.45Å; R455-A691 VanDerWaalsContact NE-O 3.1Å; P458-A691 HydrophobicContact CB-CB 4.26Å; P458-A691 HydrophobicContact CG-CB 3.95Å; K687-A691 WeakPolarHBondContact O-CB 3.08Å; K687-A691 PolarHBondContact O-N 3.04Å; F688-A691 PolarHBondContact O-N 3.25Å; R689-A691 VanDerWaalsContact C-N 3.33Å; R689-A691 PolarHBondContact O-N 3.28Å
692	L	76.6	Confident	81.1	Confident	60 Å²	60	84.7 Å²	84.7	31%	0.314	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-29.3	170.3	-68.8	172.3	0	0	0	112.2	R455 F688 R689 E690	R455-L692 PolarHBondContact NH2-O 2.96Å; F688-L692 HydrophobicContact CE1-CD1 4.19Å; F688-L692 HydrophobicContact CZ-CD1 4.45Å; F688-L692 HydrophobicContact CZ-CD2 4.43Å; F688-L692 PolarHBondContact O-N 3.03Å; R689-L692 WeakPolarHBondContact O-CB 3.46Å; R689-L692 PolarHBondContact O-N 2.88Å; R689-L692 VanDerWaalsContact O-N 3.1Å; E690-L692 PolarHBondContact O-N 3.32Å; E690-L692 VanDerWaalsContact O-N 3.13Å
693	R	72.4	Confident	80.4	Confident	137 Å²	137	85.8 Å²	85.8	52%	0.517	41%	0.409	S	S	.	.	S	Bend	trans	-63.8	149.8	178.1	-65.4	-178.4	176.8	161.8	-2.5	111.2	E690	E690-R693 WeakPolarHBondContact O-CB 3.32Å; E690-R693 PolarHBondContact O-N 3.36Å
694	P	66.9	Low	80.3	Confident	113 Å²	113	91.6 Å²	91.6	73%	0.734	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-62.4	152.7	166.6	29.3	-34.5	0	0	0	109.9	D696	P694-D696 PolarHBondContact O-N 3.4Å
695	Y	66.2	Low	80.3	Confident	102 Å²	102	94 Å²	94	40%	0.4	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-61.7	126.8	170.7	-90.6	-95.2	0	0	0	109.8	H451 R454 D699	H451-Y695 HydrophobicContact CB-CE2 4.33Å; H451-Y695 AromaticContact CD2-CD2 3.54Å; H451-Y695 AromaticContact CD2-CE2 3.8Å; H451-Y695 AromaticContact CE1-CD2 3.65Å; H451-Y695 AromaticContact CE1-CE2 3.44Å; H451-Y695 VanDerWaalsContact CE1-CE2 3.44Å; H451-Y695 WeakPolarHBondContact CE1-CE2 3.18Å; H451-Y695 AromaticContact CG-CD2 3.85Å; H451-Y695 AromaticContact CG-CE2 3.61Å; H451-Y695 AromaticContact ND1-CD2 3.92Å; H451-Y695 AromaticContact ND1-CE2 3.38Å; H451-Y695 WeakPolarHBondContact ND1-CE2 2.98Å; H451-Y695 AromaticContact NE2-CD2 3.42Å; H451-Y695 WeakPolarHBondContact NE2-CD2 3.42Å; H451-Y695 AromaticContact NE2-CE2 3.71Å; R454-Y695 WeakPolarHBondContact CD-OH 3.45Å; R454-Y695 PolarHBondContact NE-OH 3.32Å; R454-Y695 VanDerWaalsContact NH1-CE1 3.3Å; R454-Y695 VanDerWaalsContact NH1-CE2 3.27Å; Y695-D699 HydrophobicContact CD1-CB 3.95Å; Y695-D699 HydrophobicContact CE1-CB 4.49Å
696	D	68.9	Low	80.1	Confident	98 Å²	98	92.9 Å²	92.9	52%	0.524	45%	0.453	S	S	.	.			trans	-110.1	163.3	174.3	-173.2	9.6	0	0	0	109.7	P694 K698 D699	P694-D696 PolarHBondContact O-N 3.4Å; D696-K698 HydrophobicContact CB-CB 4.19Å; D696-K698 PolarHBondContact O-N 3.07Å; D696-K698 WeakPolarHBondContact OD2-CB 3.33Å; D696-D699 WeakPolarHBondContact O-CB 3.21Å; D696-D699 PolarHBondContact O-N 3.33Å
697	V	78.1	Confident	80.2	Confident	100 Å²	100	89.2 Å²	89.2	61%	0.606	45%	0.451	S	S	*	.	H	α-helix	trans	-57.5	-29.5	168.9	-177.5	0	0	0	0	110.1	D699 V700 I701	V697-D699 VanDerWaalsContact C-N 3.32Å; V697-D699 PolarHBondContact O-N 2.79Å; V697-V700 WeakPolarHBondContact O-CA 3.46Å; V697-V700 WeakPolarHBondContact O-CB 3.34Å; V697-V700 PolarHBondContact O-N 3.39Å; V697-I701 HydrophobicContact CG1-CD1 4.16Å; V697-I701 HydrophobicContact CG1-CG1 4.46Å; V697-I701 PolarHBondContact O-N 3.35Å
698	K	76.8	Confident	80.5	Confident	132 Å²	132	87.3 Å²	87.3	57%	0.574	44%	0.444	S	S	*	.	H	α-helix	trans	-54.1	-40.8	170.3	-174	171.8	178.5	169.5	0	113.5	D696 V700 I701 E702	D696-K698 HydrophobicContact CB-CB 4.19Å; D696-K698 PolarHBondContact O-N 3.07Å; D696-K698 WeakPolarHBondContact OD2-CB 3.33Å; K698-V700 PolarHBondContact O-N 3.03Å; K698-I701 PolarHBondContact O-N 2.9Å; K698-E702 VanDerWaalsContact O-CB 3.3Å; K698-E702 WeakPolarHBondContact O-CB 3.24Å; K698-E702 PolarHBondContact O-N 3.48Å
699	D	79.4	Confident	80.6	Confident	34 Å²	34	90 Å²	90	18%	0.182	46%	0.462	C	S	.	.	H	α-helix	trans	-61.2	-30.9	176.3	-91.3	47.6	0	0	0	111.9	R454 Y695 D696 V697 Q703	R454-D699 IonicContact CZ-OD2 3.24Å; R454-D699 VanDerWaalsContact CZ-OD2 3.26Å; R454-D699 IonicContact NH1-OD2 2.89Å; R454-D699 PolarHBondContact NH1-OD2 2.51Å; R454-D699 IonicContact NH2-OD2 3.84Å; R454-D699 PolarHBondContact NH2-OD2 3.17Å; Y695-D699 HydrophobicContact CD1-CB 3.95Å; Y695-D699 HydrophobicContact CE1-CB 4.49Å; D696-D699 WeakPolarHBondContact O-CB 3.21Å; D696-D699 PolarHBondContact O-N 3.33Å; V697-D699 VanDerWaalsContact C-N 3.32Å; V697-D699 PolarHBondContact O-N 2.79Å; D699-Q703 WeakPolarHBondContact O-CB 3.48Å; D699-Q703 VanDerWaalsContact O-CG 3.23Å; D699-Q703 WeakPolarHBondContact O-CG 3.44Å; D699-Q703 PolarHBondContact O-N 3.36Å; D699-Q703 VanDerWaalsContact O-N 3.1Å; D699-Q703 PolarHBondContact O-NE2 2.92Å
700	V	79.3	Confident	80.9	Confident	92 Å²	92	87.4 Å²	87.4	56%	0.558	46%	0.458	S	S	*	.	H	α-helix	trans	-78	-42.8	178.6	-175	0	0	0	0	110.3	V697 K698 E702 Q703 Y704	V697-V700 WeakPolarHBondContact O-CA 3.46Å; V697-V700 WeakPolarHBondContact O-CB 3.34Å; V697-V700 PolarHBondContact O-N 3.39Å; K698-V700 PolarHBondContact O-N 3.03Å; V700-E702 VanDerWaalsContact C-N 3.34Å; V700-Q703 PolarHBondContact O-N 2.98Å; V700-Y704 WeakPolarHBondContact O-CB 3.27Å; V700-Y704 PolarHBondContact O-N 2.99Å
701	I	84.6	Confident	81.4	Confident	109 Å²	109	90.1 Å²	90.1	56%	0.559	47%	0.472	S	S	*	.	H	α-helix	trans	-62.4	-41.8	174.7	-64.3	168.5	0	0	0	110.6	V697 K698 Y704 S705	V697-I701 HydrophobicContact CG1-CD1 4.16Å; V697-I701 HydrophobicContact CG1-CG1 4.46Å; V697-I701 PolarHBondContact O-N 3.35Å; K698-I701 PolarHBondContact O-N 2.9Å; I701-Y704 PolarHBondContact O-N 3.31Å; I701-S705 WeakPolarHBondContact O-CB 3.49Å; I701-S705 PolarHBondContact O-N 2.77Å; I701-S705 PolarHBondContact O-OG 3.29Å
702	E	81.5	Confident	81.9	Confident	108 Å²	108	93.7 Å²	93.7	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-67.9	-37.6	177.3	-168.8	179	146.1	0	0	112.2	K698 V700 S705 A706	K698-E702 VanDerWaalsContact O-CB 3.3Å; K698-E702 WeakPolarHBondContact O-CB 3.24Å; K698-E702 PolarHBondContact O-N 3.48Å; V700-E702 VanDerWaalsContact C-N 3.34Å; E702-S705 PolarHBondContact O-OG 3.1Å; E702-S705 VanDerWaalsContact O-OG 3.13Å; E702-A706 VanDerWaalsContact O-CB 3.24Å; E702-A706 WeakPolarHBondContact O-CB 3.44Å; E702-A706 PolarHBondContact O-N 3.11Å
703	Q	79.4	Confident	82.5	Confident	113 Å²	113	93 Å²	93	53%	0.528	49%	0.492	S	S	.	.	H	α-helix	trans	-67.5	-39.2	171.4	-80.2	167.4	66.1	0	0	112.3	D699 V700 G707	D699-Q703 WeakPolarHBondContact O-CB 3.48Å; D699-Q703 VanDerWaalsContact O-CG 3.23Å; D699-Q703 WeakPolarHBondContact O-CG 3.44Å; D699-Q703 PolarHBondContact O-N 3.36Å; D699-Q703 VanDerWaalsContact O-N 3.1Å; D699-Q703 PolarHBondContact O-NE2 2.92Å; V700-Q703 PolarHBondContact O-N 2.98Å; Q703-G707 PolarHBondContact O-N 3.13Å
704	Y	87.7	Confident	83.4	Confident	163 Å²	163	93.6 Å²	93.6	64%	0.639	49%	0.494	S	S	*	.	H	α-helix	trans	-67.2	-46.1	177	-179.2	-97.6	0	0	0	111.5	V700 I701 G707 H708	V700-Y704 WeakPolarHBondContact O-CB 3.27Å; V700-Y704 PolarHBondContact O-N 2.99Å; I701-Y704 PolarHBondContact O-N 3.31Å; Y704-G707 PolarHBondContact O-N 3.2Å; Y704-H708 VanDerWaalsContact O-CB 3.23Å; Y704-H708 WeakPolarHBondContact O-CB 3.5Å; Y704-H708 PolarHBondContact O-N 3.18Å
705	S	90.5	Very high	84.6	Confident	57 Å²	57	91.7 Å²	91.7	40%	0.399	48%	0.48	S	S	.	.	H	α-helix	trans	-64	-45.5	178.1	65.9	0	0	0	0	111.5	I701 E702 G707 H708 V709	I701-S705 WeakPolarHBondContact O-CB 3.49Å; I701-S705 PolarHBondContact O-N 2.77Å; I701-S705 PolarHBondContact O-OG 3.29Å; E702-S705 PolarHBondContact O-OG 3.1Å; E702-S705 VanDerWaalsContact O-OG 3.13Å; S705-G707 PolarHBondContact O-N 3.02Å; S705-H708 PolarHBondContact O-N 3.09Å; S705-V709 WeakPolarHBondContact O-CB 3.48Å; S705-V709 VanDerWaalsContact O-CG2 3.26Å; S705-V709 WeakPolarHBondContact O-CG2 3.44Å; S705-V709 PolarHBondContact O-N 2.96Å
706	A	86.9	Confident	85.8	Confident	59 Å²	59	94 Å²	94	49%	0.488	49%	0.493	S	S	.	.	H	α-helix	trans	-61.3	-42.8	175.3	0	0	0	0	0	112.4	E702 D710	E702-A706 VanDerWaalsContact O-CB 3.24Å; E702-A706 WeakPolarHBondContact O-CB 3.44Å; E702-A706 PolarHBondContact O-N 3.11Å; A706-D710 PolarHBondContact O-N 2.8Å
707	G	89	Confident	86.8	Confident	38 Å²	38	93.9 Å²	93.9	39%	0.392	49%	0.491	S	S	.	.	H	α-helix	trans	-66.3	-40	176.7	0	0	0	0	0	113.2	Q703 Y704 S705 M711	Q703-G707 PolarHBondContact O-N 3.13Å; Y704-G707 PolarHBondContact O-N 3.2Å; S705-G707 PolarHBondContact O-N 3.02Å; G707-M711 WeakPolarHBondContact O-CB 3.27Å; G707-M711 PolarHBondContact O-N 3.23Å
708	H	92.7	Very high	87.3	Confident	84 Å²	84	94.4 Å²	94.4	39%	0.389	49%	0.49	S	S	.	.	H	α-helix	trans	-68.8	-39.1	177	-170	-106.2	0	0	0	111.7	Y704 S705 M711 L712	Y704-H708 VanDerWaalsContact O-CB 3.23Å; Y704-H708 WeakPolarHBondContact O-CB 3.5Å; Y704-H708 PolarHBondContact O-N 3.18Å; S705-H708 PolarHBondContact O-N 3.09Å; H708-M711 PolarHBondContact O-N 2.96Å; H708-L712 WeakPolarHBondContact O-CB 3.37Å; H708-L712 VanDerWaalsContact O-CG 3.31Å; H708-L712 WeakPolarHBondContact O-CG 3.48Å; H708-L712 PolarHBondContact O-N 3.35Å
709	V	90.1	Very high	87.7	Confident	87 Å²	87	93.4 Å²	93.4	53%	0.527	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-43.5	174.7	169.8	0	0	0	0	111.7	S705 L712 A713	S705-V709 WeakPolarHBondContact O-CB 3.48Å; S705-V709 VanDerWaalsContact O-CG2 3.26Å; S705-V709 WeakPolarHBondContact O-CG2 3.44Å; S705-V709 PolarHBondContact O-N 2.96Å; V709-L712 PolarHBondContact O-N 3.34Å; V709-A713 VanDerWaalsContact O-CB 3.32Å; V709-A713 WeakPolarHBondContact O-CB 3.31Å; V709-A713 PolarHBondContact O-N 3.34Å
710	D	91.5	Very high	87.7	Confident	74 Å²	74	94.6 Å²	94.6	40%	0.396	50%	0.502	S	S	.	.	H	α-helix	trans	-63	-41.8	173.4	176.4	35.5	0	0	0	111.7	A706 A713 R714	A706-D710 PolarHBondContact O-N 2.8Å; D710-A713 PolarHBondContact O-N 2.99Å; D710-R714 VanDerWaalsContact CG-NE 3.34Å; D710-R714 VanDerWaalsContact CG-NH2 3.33Å; D710-R714 VanDerWaalsContact O-CG 3.25Å; D710-R714 WeakPolarHBondContact O-CG 3.33Å; D710-R714 PolarHBondContact O-N 3.21Å; D710-R714 IonicContact OD1-CZ 3.38Å; D710-R714 IonicContact OD1-NE 2.84Å; D710-R714 PolarHBondContact OD1-NE 3.41Å; D710-R714 IonicContact OD1-NH2 2.65Å; D710-R714 PolarHBondContact OD1-NH2 3.35Å; D710-R714 IonicContact OD2-CZ 3.99Å; D710-R714 IonicContact OD2-NE 3.34Å; D710-R714 PolarHBondContact OD2-NE 2.84Å; D710-R714 IonicContact OD2-NH2 3.71Å; D710-R714 PolarHBondContact OD2-NH2 3.2Å
711	M	90.1	Very high	87.8	Confident	123 Å²	123	97.7 Å²	97.7	61%	0.606	50%	0.503	S	S	*	.	H	α-helix	trans	-61.7	-48.5	174.5	-176.7	172.7	173.1	0	0	112.1	G707 H708 A713 R714 V715	G707-M711 WeakPolarHBondContact O-CB 3.27Å; G707-M711 PolarHBondContact O-N 3.23Å; H708-M711 PolarHBondContact O-N 2.96Å; M711-A713 VanDerWaalsContact C-N 3.35Å; M711-A713 PolarHBondContact O-N 3.25Å; M711-R714 PolarHBondContact O-N 3.32Å; M711-V715 WeakPolarHBondContact O-CG2 3.49Å; M711-V715 PolarHBondContact O-N 2.89Å
712	L	92.1	Very high	87.6	Confident	85 Å²	85	96.9 Å²	96.9	45%	0.445	50%	0.5	S	S	.	.	H	α-helix	trans	-60.9	-41.3	176.3	-76.7	174.5	0	0	0	112.2	H708 V709 R714 V715 K716	H708-L712 WeakPolarHBondContact O-CB 3.37Å; H708-L712 VanDerWaalsContact O-CG 3.31Å; H708-L712 WeakPolarHBondContact O-CG 3.48Å; H708-L712 PolarHBondContact O-N 3.35Å; V709-L712 PolarHBondContact O-N 3.34Å; L712-R714 VanDerWaalsContact C-N 3.34Å; L712-R714 PolarHBondContact O-N 3.15Å; L712-V715 PolarHBondContact O-N 3.5Å; L712-K716 PolarHBondContact O-N 3.39Å
713	A	88.9	Confident	87.4	Confident	44 Å²	44	95.6 Å²	95.6	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-42.9	176.2	0	0	0	0	0	111.3	V709 D710 M711 K716 I717	V709-A713 VanDerWaalsContact O-CB 3.32Å; V709-A713 WeakPolarHBondContact O-CB 3.31Å; V709-A713 PolarHBondContact O-N 3.34Å; D710-A713 PolarHBondContact O-N 2.99Å; M711-A713 VanDerWaalsContact C-N 3.35Å; M711-A713 PolarHBondContact O-N 3.25Å; A713-K716 PolarHBondContact O-N 2.91Å; A713-I717 WeakPolarHBondContact O-CD1 3.47Å; A713-I717 VanDerWaalsContact O-CG1 3.27Å; A713-I717 WeakPolarHBondContact O-CG1 3.47Å; A713-I717 PolarHBondContact O-N 3.41Å
714	R	90.9	Very high	87.2	Confident	150 Å²	150	95.3 Å²	95.3	57%	0.566	50%	0.495	S	S	*	.	H	α-helix	trans	-65	-40.7	175.1	-68.6	169	-167.9	-153.1	7.2	112.5	D710 M711 L712 I717 L718	D710-R714 VanDerWaalsContact CG-NE 3.34Å; D710-R714 VanDerWaalsContact CG-NH2 3.33Å; D710-R714 VanDerWaalsContact O-CG 3.25Å; D710-R714 WeakPolarHBondContact O-CG 3.33Å; D710-R714 PolarHBondContact O-N 3.21Å; D710-R714 IonicContact OD1-CZ 3.38Å; D710-R714 IonicContact OD1-NE 2.84Å; D710-R714 PolarHBondContact OD1-NE 3.41Å; D710-R714 IonicContact OD1-NH2 2.65Å; D710-R714 PolarHBondContact OD1-NH2 3.35Å; D710-R714 IonicContact OD2-CZ 3.99Å; D710-R714 IonicContact OD2-NE 3.34Å; D710-R714 PolarHBondContact OD2-NE 2.84Å; D710-R714 IonicContact OD2-NH2 3.71Å; D710-R714 PolarHBondContact OD2-NH2 3.2Å; M711-R714 PolarHBondContact O-N 3.32Å; L712-R714 VanDerWaalsContact C-N 3.34Å; L712-R714 PolarHBondContact O-N 3.15Å; R714-I717 PolarHBondContact O-N 3.49Å; R714-L718 WeakPolarHBondContact O-CG 3.5Å; R714-L718 PolarHBondContact O-N 2.75Å
715	V	92.3	Very high	86.5	Confident	73 Å²	73	91.6 Å²	91.6	44%	0.442	49%	0.485	S	S	.	.	H	α-helix	trans	-62.3	-44.9	174.8	171.6	0	0	0	0	110.7	M711 L712 I717 L718 Q719	M711-V715 WeakPolarHBondContact O-CG2 3.49Å; M711-V715 PolarHBondContact O-N 2.89Å; L712-V715 PolarHBondContact O-N 3.5Å; V715-I717 VanDerWaalsContact C-N 3.35Å; V715-I717 PolarHBondContact O-N 2.95Å; V715-L718 PolarHBondContact O-N 2.96Å; V715-Q719 WeakPolarHBondContact O-CB 3.47Å; V715-Q719 PolarHBondContact O-N 3.36Å
716	K	91.2	Very high	85.3	Confident	151 Å²	151	93.6 Å²	93.6	66%	0.657	49%	0.491	S	S	*	.	H	α-helix	trans	-62.4	-37.6	174.3	-75.9	-170	174.7	-174.4	0	113.1	L712 A713 Q719 A720	L712-K716 PolarHBondContact O-N 3.39Å; A713-K716 PolarHBondContact O-N 2.91Å; K716-Q719 PolarHBondContact O-N 2.82Å; K716-A720 WeakPolarHBondContact O-CB 3.37Å; K716-A720 PolarHBondContact O-N 3.28Å
717	I	89.3	Confident	84.1	Confident	95 Å²	95	91.5 Å²	91.5	49%	0.487	48%	0.475	S	S	.	.	H	α-helix	trans	-66.8	-38.4	174.4	-69.7	163	0	0	0	111.3	A713 R714 V715 R721	A713-I717 WeakPolarHBondContact O-CD1 3.47Å; A713-I717 VanDerWaalsContact O-CG1 3.27Å; A713-I717 WeakPolarHBondContact O-CG1 3.47Å; A713-I717 PolarHBondContact O-N 3.41Å; R714-I717 PolarHBondContact O-N 3.49Å; V715-I717 VanDerWaalsContact C-N 3.35Å; V715-I717 PolarHBondContact O-N 2.95Å; I717-R721 WeakPolarHBondContact O-CB 3.43Å; I717-R721 VanDerWaalsContact O-CG 3.27Å; I717-R721 WeakPolarHBondContact O-CG 3.36Å; I717-R721 PolarHBondContact O-N 3.17Å; I717-R721 VanDerWaalsContact O-N 3.08Å
718	L	88.7	Confident	82.6	Confident	112 Å²	112	99.9 Å²	99.9	59%	0.586	50%	0.495	S	S	*	.	H	α-helix	trans	-67.1	-43.6	174.4	-74.9	168.9	0	0	0	111.5	R714 V715 R721 L722	R714-L718 WeakPolarHBondContact O-CG 3.5Å; R714-L718 PolarHBondContact O-N 2.75Å; V715-L718 PolarHBondContact O-N 2.96Å; L718-R721 PolarHBondContact O-N 3.31Å; L718-L722 WeakPolarHBondContact O-CB 3.48Å; L718-L722 PolarHBondContact O-N 3.45Å
719	Q	85.5	Confident	80.7	Confident	111 Å²	111	102.3 Å²	102.3	52%	0.519	52%	0.518	S	S	.	.	H	α-helix	trans	-59.6	-52.1	174.9	-175.8	178.8	-4.6	0	0	111.1	V715 K716 R721 L722 D723	V715-Q719 WeakPolarHBondContact O-CB 3.47Å; V715-Q719 PolarHBondContact O-N 3.36Å; K716-Q719 PolarHBondContact O-N 2.82Å; Q719-R721 PolarHBondContact O-N 3.26Å; Q719-L722 CarbonylContact O-C 3.48Å; Q719-L722 WeakPolarHBondContact O-CA 3.38Å; Q719-L722 WeakPolarHBondContact O-CB 3.49Å; Q719-L722 PolarHBondContact O-N 3.41Å; Q719-D723 VanDerWaalsContact O-CG 3.23Å; Q719-D723 PolarHBondContact O-N 3.2Å
720	A	80.5	Confident	78.8	Confident	59 Å²	59	101.5 Å²	101.5	49%	0.488	53%	0.528	S	S	.	.	H	α-helix	trans	-60.6	-31.6	178.3	0	0	0	0	0	113.3	K716 Q724	K716-A720 WeakPolarHBondContact O-CB 3.37Å; K716-A720 PolarHBondContact O-N 3.28Å; A720-Q724 WeakPolarHBondContact O-CB 3.1Å; A720-Q724 PolarHBondContact O-N 3.02Å
721	R	80.3	Confident	76.8	Confident	156 Å²	156	100.8 Å²	100.8	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-72.8	-37.9	171.4	-76.8	175.6	176.5	-161.5	-0.6	112.5	I717 L718 Q719 Q724 I725	I717-R721 WeakPolarHBondContact O-CB 3.43Å; I717-R721 VanDerWaalsContact O-CG 3.27Å; I717-R721 WeakPolarHBondContact O-CG 3.36Å; I717-R721 PolarHBondContact O-N 3.17Å; I717-R721 VanDerWaalsContact O-N 3.08Å; L718-R721 PolarHBondContact O-N 3.31Å; Q719-R721 PolarHBondContact O-N 3.26Å; R721-Q724 PolarHBondContact O-N 3.44Å; R721-I725 WeakPolarHBondContact O-CD1 3.33Å; R721-I725 VanDerWaalsContact O-CG1 3.24Å; R721-I725 WeakPolarHBondContact O-CG1 3.3Å; R721-I725 PolarHBondContact O-N 3.48Å
722	L	81	Confident	74.8	Confident	93 Å²	93	105 Å²	105	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-67.5	-42.8	177	-171.6	66.4	0	0	0	110.7	L718 Q719 Q724 I725 L726	L718-L722 WeakPolarHBondContact O-CB 3.48Å; L718-L722 PolarHBondContact O-N 3.45Å; Q719-L722 CarbonylContact O-C 3.48Å; Q719-L722 WeakPolarHBondContact O-CA 3.38Å; Q719-L722 WeakPolarHBondContact O-CB 3.49Å; Q719-L722 PolarHBondContact O-N 3.41Å; L722-Q724 VanDerWaalsContact C-N 3.25Å; L722-Q724 PolarHBondContact O-N 3.09Å; L722-I725 PolarHBondContact O-N 3.29Å; L722-L726 HydrophobicContact CD1-CD1 4.15Å; L722-L726 HydrophobicContact CD1-CG 4.24Å; L722-L726 HydrophobicContact CD2-CD1 4.33Å; L722-L726 HydrophobicContact CG-CD1 3.82Å; L722-L726 HydrophobicContact CG-CG 4.28Å; L722-L726 WeakPolarHBondContact O-CB 3.45Å; L722-L726 WeakPolarHBondContact O-CG 3.46Å; L722-L726 PolarHBondContact O-N 2.9Å
723	D	77.7	Confident	73	Confident	80 Å²	80	102.1 Å²	102.1	43%	0.428	54%	0.535	S	S	.	.	H	α-helix	trans	-59.7	-35.8	172.4	-61.9	-23.8	0	0	0	111.5	Q719 G727	Q719-D723 VanDerWaalsContact O-CG 3.23Å; Q719-D723 PolarHBondContact O-N 3.2Å; D723-G727 CarbonylContact O-C 3.57Å; D723-G727 VanDerWaalsContact O-CA 3.27Å; D723-G727 WeakPolarHBondContact O-CA 3.3Å; D723-G727 PolarHBondContact O-N 2.85Å
724	Q	73.4	Confident	71.3	Confident	108 Å²	108	107 Å²	107	51%	0.505	56%	0.555	S	S	.	*	H	α-helix	trans	-73.3	-26.1	173.8	-170.8	179.1	21.7	0	0	113.4	A720 R721 L722 C742	A720-Q724 WeakPolarHBondContact O-CB 3.1Å; A720-Q724 PolarHBondContact O-N 3.02Å; R721-Q724 PolarHBondContact O-N 3.44Å; L722-Q724 VanDerWaalsContact C-N 3.25Å; L722-Q724 PolarHBondContact O-N 3.09Å; Q724-C742 PolarHBondContact O-SG 3.4Å
725	I	73	Confident	69.6	Low	84 Å²	84	107 Å²	107	43%	0.431	57%	0.566	S	S	.	*	H	α-helix	trans	-84.8	-46.9	178.1	-70.6	162	0	0	0	110.8	R721 L722 C742 L743	R721-I725 WeakPolarHBondContact O-CD1 3.33Å; R721-I725 VanDerWaalsContact O-CG1 3.24Å; R721-I725 WeakPolarHBondContact O-CG1 3.3Å; R721-I725 PolarHBondContact O-N 3.48Å; L722-I725 PolarHBondContact O-N 3.29Å; I725-C742 CarbonylContact O-C 3.58Å; I725-C742 WeakPolarHBondContact O-CA 3.3Å; I725-L743 WeakPolarHBondContact O-CB 3.49Å; I725-L743 PolarHBondContact O-N 3.2Å
726	L	66.8	Low	67.6	Low	100 Å²	100	106.3 Å²	106.3	52%	0.524	56%	0.562	S	S	.	*	H	α-helix	trans	-71.5	-33.1	178.4	-66.3	174.5	0	0	0	111.7	L722	L722-L726 HydrophobicContact CD1-CD1 4.15Å; L722-L726 HydrophobicContact CD1-CG 4.24Å; L722-L726 HydrophobicContact CD2-CD1 4.33Å; L722-L726 HydrophobicContact CG-CD1 3.82Å; L722-L726 HydrophobicContact CG-CG 4.28Å; L722-L726 WeakPolarHBondContact O-CB 3.45Å; L722-L726 WeakPolarHBondContact O-CG 3.46Å; L722-L726 PolarHBondContact O-N 2.9Å
727	G	60.8	Low	65.6	Low	15 Å²	15	103.3 Å²	103.3	16%	0.155	55%	0.547	C	S	.	.			trans	86.6	151.9	-169.4	0	0	0	0	0	111.2	D723 P729 C742	D723-G727 CarbonylContact O-C 3.57Å; D723-G727 VanDerWaalsContact O-CA 3.27Å; D723-G727 WeakPolarHBondContact O-CA 3.3Å; D723-G727 PolarHBondContact O-N 2.85Å; G727-P729 VanDerWaalsContact O-CD 3.27Å; G727-P729 WeakPolarHBondContact O-CD 3.35Å; G727-C742 WeakPolarHBondContact CA-SG 3.42Å; G727-C742 PolarHBondContact N-SG 3.23Å; G727-C742 VanDerWaalsContact N-SG 3.41Å
728	R	58.4	Low	63.7	Low	213 Å²	213	104.4 Å²	104.4	80%	0.804	55%	0.554	S	S	*	*			trans	-70.2	117.8	172.8	-76.4	-169.8	179.1	-167.8	1.8	109.2	G730	R728-G730 PolarHBondContact O-N 3.45Å
729	P	51.4	Low	62.1	Low	135 Å²	135	101.7 Å²	101.7	88%	0.877	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	120	172	27.5	-32.7	0	0	0	108.9	G727	G727-P729 VanDerWaalsContact O-CD 3.27Å; G727-P729 WeakPolarHBondContact O-CD 3.35Å
730	G	51.1	Low	60.6	Low	71 Å²	71	103.5 Å²	103.5	73%	0.732	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	112.4	2.9	173.5	0	0	0	0	0	117.5	R728 K732	R728-G730 PolarHBondContact O-N 3.45Å; G730-K732 PolarHBondContact O-N 3.19Å
731	S	49.4	Very low	59.5	Low	59 Å²	59	105 Å²	105	41%	0.413	55%	0.549	S	S	.	.			trans	-84.1	102.1	171.6	-157.3	0	0	0	0	111	G733	S731-G733 PolarHBondContact O-N 3Å
732	K	47.9	Very low	58.6	Low	210 Å²	210	98.1 Å²	98.1	91%	0.913	53%	0.525	S	S	*	.			trans	-84.6	29.1	-178	-60.6	-174.8	176.1	-175.6	0	114.1	G730	G730-K732 PolarHBondContact O-N 3.19Å
733	G	54.5	Low	57.9	Low	26 Å²	26	98 Å²	98	27%	0.268	52%	0.524	S	S	.	.			trans	-99.9	131.1	178.4	0	0	0	0	0	111.2	S731 D735 V736	S731-G733 PolarHBondContact O-N 3Å; G733-D735 PolarHBondContact O-N 2.94Å; G733-V736 WeakPolarHBondContact O-CB 3.5Å; G733-V736 PolarHBondContact O-N 3.49Å
734	D	53.4	Low	57.2	Low	146 Å²	146	95.7 Å²	95.7	78%	0.781	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-56.1	-34.8	178.8	-62.7	-37	0	0	0	111.7	V736 Y737	D734-V736 PolarHBondContact O-N 3.38Å; D734-Y737 PolarHBondContact O-N 3.18Å; D734-Y737 VanDerWaalsContact O-N 3.13Å
735	D	54.5	Low	56.7	Low	151 Å²	151	90.7 Å²	90.7	81%	0.807	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-51.4	-25.7	174.9	-49.8	25.7	0	0	0	114.3	G733	G733-D735 PolarHBondContact O-N 2.94Å
736	V	51.1	Low	56.4	Low	57 Å²	57	94.8 Å²	94.8	35%	0.345	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-79.9	-25.1	-175.1	-179.2	0	0	0	0	111.8	G733 D734 D738 S745	G733-V736 WeakPolarHBondContact O-CB 3.5Å; G733-V736 PolarHBondContact O-N 3.49Å; D734-V736 PolarHBondContact O-N 3.38Å; V736-D738 VanDerWaalsContact C-N 3.33Å; V736-D738 PolarHBondContact O-N 2.91Å; V736-S745 PolarHBondContact O-OG 3.04Å
737	Y	49.3	Very low	56.6	Low	88 Å²	88	94 Å²	94	35%	0.345	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-8.8	-175.4	-76.3	-80.8	0	0	0	114.2	D734 S745 V748	D734-Y737 PolarHBondContact O-N 3.18Å; D734-Y737 VanDerWaalsContact O-N 3.13Å; Y737-S745 WeakPolarHBondContact O-CB 3.45Å; Y737-V748 HydrophobicContact CD1-CB 3.73Å; Y737-V748 HydrophobicContact CD1-CG1 3.97Å; Y737-V748 HydrophobicContact CD1-CG2 3.87Å; Y737-V748 HydrophobicContact CE1-CB 3.75Å; Y737-V748 HydrophobicContact CE1-CG1 4.21Å; Y737-V748 HydrophobicContact CE1-CG2 3.32Å
738	D	49.5	Very low	57.1	Low	118 Å²	118	94.7 Å²	94.7	63%	0.631	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-8.9	-177.3	-144.2	17	0	0	0	114.4	V736 H740 K749	V736-D738 VanDerWaalsContact C-N 3.33Å; V736-D738 PolarHBondContact O-N 2.91Å; D738-H740 PolarHBondContact O-N 3Å; D738-H740 VanDerWaalsContact O-N 3.16Å; D738-K749 IonicContact OD1-NZ 2.64Å; D738-K749 PolarHBondContact OD1-NZ 3.33Å
739	S	53.9	Low	57.8	Low	55 Å²	55	88.2 Å²	88.2	39%	0.385	48%	0.478	S	S	.	.			trans	-72.1	112.4	172.2	97.7	0	0	0	0	111.1	Q741 S745	S739-Q741 PolarHBondContact O-N 3.46Å; S739-S745 VanDerWaalsContact O-CB 3.3Å; S739-S745 WeakPolarHBondContact O-CB 3.41Å; S739-S745 PolarHBondContact O-OG 3.5Å
740	H	54	Low	59	Low	149 Å²	149	86.5 Å²	86.5	69%	0.69	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	10.3	176.4	-89	-103.3	0	0	0	115.1	D738	D738-H740 PolarHBondContact O-N 3Å; D738-H740 VanDerWaalsContact O-N 3.16Å
741	Q	57.7	Low	60.3	Low	92 Å²	92	87.6 Å²	87.6	43%	0.43	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-18.3	-171.3	-72.4	159.2	41.9	0	0	113.9	S739	S739-Q741 PolarHBondContact O-N 3.46Å
742	C	61.6	Low	61.8	Low	11 Å²	11	90.7 Å²	90.7	7%	0.074	45%	0.453	C	S	.	.			trans	-85	138.1	176.5	-111.8	0	0	0	0	111.3	Q724 I725 G727 S745 R746	Q724-C742 PolarHBondContact O-SG 3.4Å; I725-C742 CarbonylContact O-C 3.58Å; I725-C742 WeakPolarHBondContact O-CA 3.3Å; G727-C742 WeakPolarHBondContact CA-SG 3.42Å; G727-C742 PolarHBondContact N-SG 3.23Å; G727-C742 VanDerWaalsContact N-SG 3.41Å; C742-S745 WeakPolarHBondContact CB-OG 3.4Å; C742-S745 WeakPolarHBondContact O-CB 3.39Å; C742-S745 PolarHBondContact O-N 3.29Å; C742-R746 PolarHBondContact O-N 2.95Å
743	L	65.7	Low	63.4	Low	89 Å²	89	87.9 Å²	87.9	47%	0.466	44%	0.441	S	S	.	.	H	α-helix	trans	-67.3	-40.4	175.7	-132.5	166.9	0	0	0	110.2	I725 S745 R746 I747	I725-L743 WeakPolarHBondContact O-CB 3.49Å; I725-L743 PolarHBondContact O-N 3.2Å; L743-S745 VanDerWaalsContact C-N 3.31Å; L743-S745 PolarHBondContact O-N 3.01Å; L743-R746 WeakPolarHBondContact O-CA 3.19Å; L743-R746 WeakPolarHBondContact O-CB 3.18Å; L743-R746 PolarHBondContact O-N 2.63Å; L743-I747 HydrophobicContact CD2-CD1 4.1Å; L743-I747 HydrophobicContact CD2-CG1 4.3Å; L743-I747 WeakPolarHBondContact O-CG1 3.37Å; L743-I747 PolarHBondContact O-N 3.11Å
744	A	63.1	Low	64.8	Low	32 Å²	32	90.8 Å²	90.8	26%	0.264	45%	0.45	S	S	.	.	H	α-helix	trans	-54.9	-43.8	169.6	0	0	0	0	0	112.4	R746 I747 V748	A744-R746 PolarHBondContact O-N 3.24Å; A744-I747 PolarHBondContact O-N 3.25Å; A744-V748 PolarHBondContact O-N 3Å
745	S	62.6	Low	66.1	Low	3 Å²	3	87.7 Å²	87.7	2%	0.021	43%	0.433	C	S	.	.	H	α-helix	trans	-64.7	-24.9	176.2	-48.5	0	0	0	0	113.5	V736 Y737 S739 C742 L743 K749	V736-S745 PolarHBondContact O-OG 3.04Å; Y737-S745 WeakPolarHBondContact O-CB 3.45Å; S739-S745 VanDerWaalsContact O-CB 3.3Å; S739-S745 WeakPolarHBondContact O-CB 3.41Å; S739-S745 PolarHBondContact O-OG 3.5Å; C742-S745 WeakPolarHBondContact CB-OG 3.4Å; C742-S745 WeakPolarHBondContact O-CB 3.39Å; C742-S745 PolarHBondContact O-N 3.29Å; L743-S745 VanDerWaalsContact C-N 3.31Å; L743-S745 PolarHBondContact O-N 3.01Å; S745-K749 WeakPolarHBondContact O-CB 3.25Å; S745-K749 VanDerWaalsContact O-CG 3.26Å; S745-K749 WeakPolarHBondContact O-CG 3.26Å; S745-K749 PolarHBondContact O-N 2.68Å
746	R	67.3	Low	67.5	Low	171 Å²	171	82.6 Å²	82.6	65%	0.645	41%	0.412	S	S	*	.	H	α-helix	trans	-82.5	-37	173.1	-63	177.9	98.3	-177.3	5.9	111.8	C742 L743 A744 K749 I750	C742-R746 PolarHBondContact O-N 2.95Å; L743-R746 WeakPolarHBondContact O-CA 3.19Å; L743-R746 WeakPolarHBondContact O-CB 3.18Å; L743-R746 PolarHBondContact O-N 2.63Å; A744-R746 PolarHBondContact O-N 3.24Å; R746-K749 PolarHBondContact O-N 2.92Å; R746-I750 WeakPolarHBondContact O-CD1 3.39Å; R746-I750 VanDerWaalsContact O-CG1 3.3Å; R746-I750 WeakPolarHBondContact O-CG1 3.45Å; R746-I750 PolarHBondContact O-N 3.01Å; R746-I750 VanDerWaalsContact O-N 3.09Å
747	I	72.4	Confident	69	Low	83 Å²	83	84.3 Å²	84.3	43%	0.426	42%	0.422	S	S	.	.	H	α-helix	trans	-62.8	-51.4	176.2	-68.5	165	0	0	0	110.3	L743 A744 K749 I750 E751	L743-I747 HydrophobicContact CD2-CD1 4.1Å; L743-I747 HydrophobicContact CD2-CG1 4.3Å; L743-I747 WeakPolarHBondContact O-CG1 3.37Å; L743-I747 PolarHBondContact O-N 3.11Å; A744-I747 PolarHBondContact O-N 3.25Å; I747-K749 VanDerWaalsContact C-N 3.29Å; I747-K749 PolarHBondContact O-N 3.3Å; I747-I750 CarbonylContact O-C 3.58Å; I747-I750 WeakPolarHBondContact O-CA 3.33Å; I747-I750 WeakPolarHBondContact O-CB 3.25Å; I747-I750 PolarHBondContact O-N 3.25Å; I747-E751 PolarHBondContact O-N 3.16Å
748	V	70.2	Confident	70.6	Confident	29 Å²	29	85.4 Å²	85.4	18%	0.176	43%	0.431	C	S	.	.	H	α-helix	trans	-64.3	-32.8	179.2	173.4	0	0	0	0	112.4	Y737 A744 I750 E751 H752	Y737-V748 HydrophobicContact CD1-CB 3.73Å; Y737-V748 HydrophobicContact CD1-CG1 3.97Å; Y737-V748 HydrophobicContact CD1-CG2 3.87Å; Y737-V748 HydrophobicContact CE1-CB 3.75Å; Y737-V748 HydrophobicContact CE1-CG1 4.21Å; Y737-V748 HydrophobicContact CE1-CG2 3.32Å; A744-V748 PolarHBondContact O-N 3Å; V748-I750 VanDerWaalsContact C-N 3.25Å; V748-I750 PolarHBondContact O-N 3.06Å; V748-E751 WeakPolarHBondContact CA-OE2 3.41Å; V748-E751 PolarHBondContact O-N 3.21Å; V748-H752 WeakPolarHBondContact CG1-ND1 3.46Å; V748-H752 PolarHBondContact O-N 3.3Å; V748-H752 PolarHBondContact O-ND1 3.33Å
749	K	73.5	Confident	72.2	Confident	78 Å²	78	85.9 Å²	85.9	34%	0.339	43%	0.431	S	S	.	.	H	α-helix	trans	-71.9	-13.5	171	-74.5	179.7	179.3	-178	0	113.6	D738 S745 R746 I747 K753	D738-K749 IonicContact OD1-NZ 2.64Å; D738-K749 PolarHBondContact OD1-NZ 3.33Å; S745-K749 WeakPolarHBondContact O-CB 3.25Å; S745-K749 VanDerWaalsContact O-CG 3.26Å; S745-K749 WeakPolarHBondContact O-CG 3.26Å; S745-K749 PolarHBondContact O-N 2.68Å; R746-K749 PolarHBondContact O-N 2.92Å; I747-K749 VanDerWaalsContact C-N 3.29Å; I747-K749 PolarHBondContact O-N 3.3Å; K749-K753 WeakPolarHBondContact O-CD 3.48Å; K749-K753 WeakPolarHBondContact O-CG 3.26Å
750	I	76.9	Confident	73.8	Confident	98 Å²	98	90.2 Å²	90.2	50%	0.503	44%	0.443	S	S	.	.	H	α-helix	trans	-88.5	-43.9	169.6	-70.6	162.4	0	0	0	109.8	R746 I747 V748 K753 I754	R746-I750 WeakPolarHBondContact O-CD1 3.39Å; R746-I750 VanDerWaalsContact O-CG1 3.3Å; R746-I750 WeakPolarHBondContact O-CG1 3.45Å; R746-I750 PolarHBondContact O-N 3.01Å; R746-I750 VanDerWaalsContact O-N 3.09Å; I747-I750 CarbonylContact O-C 3.58Å; I747-I750 WeakPolarHBondContact O-CA 3.33Å; I747-I750 WeakPolarHBondContact O-CB 3.25Å; I747-I750 PolarHBondContact O-N 3.25Å; V748-I750 VanDerWaalsContact C-N 3.25Å; V748-I750 PolarHBondContact O-N 3.06Å; I750-K753 CarbonylContact O-C 3.47Å; I750-K753 WeakPolarHBondContact O-CA 3.29Å; I750-K753 WeakPolarHBondContact O-CB 3.03Å; I750-K753 PolarHBondContact O-N 3.13Å; I750-I754 HydrophobicContact CG2-CD1 3.9Å; I750-I754 HydrophobicContact CG2-CG1 4.42Å; I750-I754 WeakPolarHBondContact O-CG1 3.44Å; I750-I754 PolarHBondContact O-N 2.87Å
751	E	78.5	Confident	75.3	Confident	95 Å²	95	87.7 Å²	87.7	44%	0.444	43%	0.434	S	S	.	.	H	α-helix	trans	-54.8	-53.7	174.4	-68.8	168.6	160.9	0	0	110.9	I747 V748 K753 I754 D755	I747-E751 PolarHBondContact O-N 3.16Å; V748-E751 WeakPolarHBondContact CA-OE2 3.41Å; V748-E751 PolarHBondContact O-N 3.21Å; E751-K753 PolarHBondContact O-N 3.18Å; E751-I754 CarbonylContact O-C 3.59Å; E751-I754 WeakPolarHBondContact O-CA 3.35Å; E751-I754 WeakPolarHBondContact O-CB 3.36Å; E751-I754 PolarHBondContact O-N 3.45Å; E751-D755 VanDerWaalsContact O-CG 3.28Å; E751-D755 PolarHBondContact O-N 3.07Å
752	H	79.8	Confident	76.6	Confident	123 Å²	123	87.7 Å²	87.7	57%	0.569	44%	0.437	S	S	*	.	H	α-helix	trans	-58.2	-23.8	175.7	-76.4	71.2	0	0	0	114.1	V748 A756	V748-H752 WeakPolarHBondContact CG1-ND1 3.46Å; V748-H752 PolarHBondContact O-N 3.3Å; V748-H752 PolarHBondContact O-ND1 3.33Å; H752-A756 VanDerWaalsContact O-CB 3.31Å; H752-A756 WeakPolarHBondContact O-CB 3.15Å; H752-A756 PolarHBondContact O-N 3.5Å
753	K	81.8	Confident	77.7	Confident	151 Å²	151	96 Å²	96	66%	0.657	47%	0.466	S	S	*	.	H	α-helix	trans	-82.2	-32.7	173.7	-78.7	179.6	177.5	-174.3	0	112.3	K749 I750 E751 V757	K749-K753 WeakPolarHBondContact O-CD 3.48Å; K749-K753 WeakPolarHBondContact O-CG 3.26Å; I750-K753 CarbonylContact O-C 3.47Å; I750-K753 WeakPolarHBondContact O-CA 3.29Å; I750-K753 WeakPolarHBondContact O-CB 3.03Å; I750-K753 PolarHBondContact O-N 3.13Å; E751-K753 PolarHBondContact O-N 3.18Å; K753-V757 VanDerWaalsContact O-CG2 3.27Å; K753-V757 WeakPolarHBondContact O-CG2 3.4Å; K753-V757 PolarHBondContact O-N 3.32Å
754	I	83	Confident	78.6	Confident	88 Å²	88	96.4 Å²	96.4	45%	0.451	47%	0.469	S	S	.	.	H	α-helix	trans	-66.5	-49.3	172.3	-67.6	167.5	0	0	0	108.4	I750 E751 A756 V757 E758	I750-I754 HydrophobicContact CG2-CD1 3.9Å; I750-I754 HydrophobicContact CG2-CG1 4.42Å; I750-I754 WeakPolarHBondContact O-CG1 3.44Å; I750-I754 PolarHBondContact O-N 2.87Å; E751-I754 CarbonylContact O-C 3.59Å; E751-I754 WeakPolarHBondContact O-CA 3.35Å; E751-I754 WeakPolarHBondContact O-CB 3.36Å; E751-I754 PolarHBondContact O-N 3.45Å; I754-A756 VanDerWaalsContact C-N 3.29Å; I754-A756 PolarHBondContact O-N 3.34Å; I754-V757 CarbonylContact O-C 3.58Å; I754-V757 WeakPolarHBondContact O-CA 3.49Å; I754-V757 WeakPolarHBondContact O-CB 3.48Å; I754-V757 PolarHBondContact O-N 3.16Å; I754-E758 HydrophobicContact CG2-CG 4.43Å; I754-E758 PolarHBondContact O-N 3.31Å
755	D	82	Confident	79.6	Confident	80 Å²	80	98.9 Å²	98.9	43%	0.428	48%	0.476	S	S	.	.	H	α-helix	trans	-55.3	-44.1	175.3	-54	-21	0	0	0	111.5	E751 V757 E758 M759	E751-D755 VanDerWaalsContact O-CG 3.28Å; E751-D755 PolarHBondContact O-N 3.07Å; D755-V757 VanDerWaalsContact C-N 3.26Å; D755-V757 PolarHBondContact O-N 3.27Å; D755-E758 PolarHBondContact O-N 2.87Å; D755-M759 WeakPolarHBondContact O-CG 3.38Å; D755-M759 PolarHBondContact O-N 3.02Å
756	A	83	Confident	80.5	Confident	44 Å²	44	103.6 Å²	103.6	36%	0.364	50%	0.501	S	S	.	.	H	α-helix	trans	-69.9	-18.9	176.4	0	0	0	0	0	114.1	H752 I754 K760	H752-A756 VanDerWaalsContact O-CB 3.31Å; H752-A756 WeakPolarHBondContact O-CB 3.15Å; H752-A756 PolarHBondContact O-N 3.5Å; I754-A756 VanDerWaalsContact C-N 3.29Å; I754-A756 PolarHBondContact O-N 3.34Å; A756-K760 WeakPolarHBondContact O-CD 3.31Å; A756-K760 VanDerWaalsContact O-CG 3.24Å; A756-K760 WeakPolarHBondContact O-CG 3.4Å
757	V	83.7	Confident	81.3	Confident	93 Å²	93	100.9 Å²	100.9	56%	0.564	50%	0.499	S	S	*	.	H	α-helix	trans	-84	-40.4	170.2	166.1	0	0	0	0	110.4	K753 I754 D755 K760 L761	K753-V757 VanDerWaalsContact O-CG2 3.27Å; K753-V757 WeakPolarHBondContact O-CG2 3.4Å; K753-V757 PolarHBondContact O-N 3.32Å; I754-V757 CarbonylContact O-C 3.58Å; I754-V757 WeakPolarHBondContact O-CA 3.49Å; I754-V757 WeakPolarHBondContact O-CB 3.48Å; I754-V757 PolarHBondContact O-N 3.16Å; D755-V757 VanDerWaalsContact C-N 3.26Å; D755-V757 PolarHBondContact O-N 3.27Å; V757-K760 CarbonylContact O-C 3.56Å; V757-K760 WeakPolarHBondContact O-CB 3.34Å; V757-K760 PolarHBondContact O-N 3.48Å; V757-K760 VanDerWaalsContact O-N 3.14Å; V757-L761 WeakPolarHBondContact O-CB 3.46Å; V757-L761 PolarHBondContact O-N 3.13Å
758	E	83	Confident	81.7	Confident	112 Å²	112	102.1 Å²	102.1	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-60.3	-49.5	173.1	-69.3	-171.4	165.8	0	0	111	I754 D755 K760 L761 D762	I754-E758 HydrophobicContact CG2-CG 4.43Å; I754-E758 PolarHBondContact O-N 3.31Å; D755-E758 PolarHBondContact O-N 2.87Å; E758-K760 PolarHBondContact O-N 3.42Å; E758-K760 VanDerWaalsContact O-N 3.13Å; E758-L761 CarbonylContact O-C 3.56Å; E758-L761 WeakPolarHBondContact O-CA 3.42Å; E758-L761 WeakPolarHBondContact O-CB 3.45Å; E758-L761 PolarHBondContact O-N 3.26Å; E758-D762 PolarHBondContact O-N 2.86Å
759	M	83.4	Confident	82.1	Confident	127 Å²	127	107 Å²	107	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-57.9	-30.3	173.8	-70.4	-171.4	82.7	0	0	113.6	D755 R763	D755-M759 WeakPolarHBondContact O-CG 3.38Å; D755-M759 PolarHBondContact O-N 3.02Å; M759-R763 WeakPolarHBondContact O-CG 3.27Å; M759-R763 PolarHBondContact O-N 2.88Å
760	K	86.7	Confident	82.3	Confident	147 Å²	147	106 Å²	106	64%	0.639	53%	0.531	S	S	*	.	H	α-helix	trans	-77.2	-37.1	174.5	-78.1	173.7	-176.8	178.5	0	111.8	A756 V757 E758 R763 L764	A756-K760 WeakPolarHBondContact O-CD 3.31Å; A756-K760 VanDerWaalsContact O-CG 3.24Å; A756-K760 WeakPolarHBondContact O-CG 3.4Å; V757-K760 CarbonylContact O-C 3.56Å; V757-K760 WeakPolarHBondContact O-CB 3.34Å; V757-K760 PolarHBondContact O-N 3.48Å; V757-K760 VanDerWaalsContact O-N 3.14Å; E758-K760 PolarHBondContact O-N 3.42Å; E758-K760 VanDerWaalsContact O-N 3.13Å; K760-R763 PolarHBondContact O-N 3.27Å; K760-L764 PolarHBondContact O-N 3.23Å
761	L	86	Confident	82.4	Confident	96 Å²	96	105.1 Å²	105.1	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-66	-44	175.3	-170.4	64.6	0	0	0	110.4	V757 E758 R763 L764 I765	V757-L761 WeakPolarHBondContact O-CB 3.46Å; V757-L761 PolarHBondContact O-N 3.13Å; E758-L761 CarbonylContact O-C 3.56Å; E758-L761 WeakPolarHBondContact O-CA 3.42Å; E758-L761 WeakPolarHBondContact O-CB 3.45Å; E758-L761 PolarHBondContact O-N 3.26Å; L761-R763 VanDerWaalsContact C-N 3.35Å; L761-R763 PolarHBondContact O-N 2.8Å; L761-L764 CarbonylContact O-C 3.57Å; L761-L764 WeakPolarHBondContact O-CA 3.25Å; L761-L764 WeakPolarHBondContact O-CB 3.45Å; L761-L764 PolarHBondContact O-N 3.32Å; L761-I765 HydrophobicContact CG-CD1 4.08Å; L761-I765 VanDerWaalsContact O-CG1 3.3Å; L761-I765 WeakPolarHBondContact O-CG1 3.39Å; L761-I765 PolarHBondContact O-N 3.34Å
762	D	85.4	Confident	82.2	Confident	91 Å²	91	108.4 Å²	108.4	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-61.2	-40.4	173.1	-77.6	-27.3	0	0	0	112.3	E758 L764 I765 N766	E758-D762 PolarHBondContact O-N 2.86Å; D762-L764 VanDerWaalsContact C-N 3.34Å; D762-I765 PolarHBondContact O-N 3.25Å; D762-N766 WeakPolarHBondContact O-CB 3.44Å; D762-N766 PolarHBondContact O-N 2.84Å; D762-N766 PolarHBondContact O-ND2 3.06Å
763	R	83.9	Confident	81.8	Confident	185 Å²	185	108.1 Å²	108.1	70%	0.698	54%	0.537	S	S	*	.	H	α-helix	trans	-61.4	-42.4	171.1	-81.3	-178.5	176	-165.5	0.1	111.8	M759 K760 L761 N766 I767	M759-R763 WeakPolarHBondContact O-CG 3.27Å; M759-R763 PolarHBondContact O-N 2.88Å; K760-R763 PolarHBondContact O-N 3.27Å; L761-R763 VanDerWaalsContact C-N 3.35Å; L761-R763 PolarHBondContact O-N 2.8Å; R763-N766 PolarHBondContact O-N 2.86Å; R763-I767 WeakPolarHBondContact O-CD1 3.38Å; R763-I767 VanDerWaalsContact O-CG1 3.26Å; R763-I767 WeakPolarHBondContact O-CG1 3.45Å; R763-I767 PolarHBondContact O-N 3Å
764	L	83.7	Confident	81.1	Confident	99 Å²	99	104.9 Å²	104.9	52%	0.518	53%	0.532	S	S	.	.	H	α-helix	trans	-65.1	-43.8	177.7	-162.1	79.5	0	0	0	111.6	K760 L761 D762 N766 I767 L768	K760-L764 PolarHBondContact O-N 3.23Å; L761-L764 CarbonylContact O-C 3.57Å; L761-L764 WeakPolarHBondContact O-CA 3.25Å; L761-L764 WeakPolarHBondContact O-CB 3.45Å; L761-L764 PolarHBondContact O-N 3.32Å; D762-L764 VanDerWaalsContact C-N 3.34Å; L764-N766 PolarHBondContact O-N 3.28Å; L764-I767 PolarHBondContact O-N 3.14Å; L764-L768 HydrophobicContact CD2-CD1 4.5Å; L764-L768 HydrophobicContact CG-CD1 4.27Å; L764-L768 WeakPolarHBondContact O-CB 3.36Å; L764-L768 WeakPolarHBondContact O-CG 3.24Å; L764-L768 PolarHBondContact O-N 2.83Å
765	I	84.5	Confident	80.3	Confident	83 Å²	83	106.7 Å²	106.7	43%	0.426	54%	0.537	S	S	.	.	H	α-helix	trans	-60	-45.4	175.1	-70.4	165.6	0	0	0	110.2	L761 D762 I767 L768 K769	L761-I765 HydrophobicContact CG-CD1 4.08Å; L761-I765 VanDerWaalsContact O-CG1 3.3Å; L761-I765 WeakPolarHBondContact O-CG1 3.39Å; L761-I765 PolarHBondContact O-N 3.34Å; D762-I765 PolarHBondContact O-N 3.25Å; I765-I767 PolarHBondContact O-N 2.59Å; I765-L768 PolarHBondContact O-N 3.04Å; I765-K769 WeakPolarHBondContact O-CB 3.34Å; I765-K769 PolarHBondContact O-N 3.28Å
766	N	81.8	Confident	79.5	Confident	102 Å²	102	109.3 Å²	109.3	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-65.1	-38.2	177.5	-77.7	-55.9	0	0	0	112.7	D762 R763 L764 K769 A770	D762-N766 WeakPolarHBondContact O-CB 3.44Å; D762-N766 PolarHBondContact O-N 2.84Å; D762-N766 PolarHBondContact O-ND2 3.06Å; R763-N766 PolarHBondContact O-N 2.86Å; L764-N766 PolarHBondContact O-N 3.28Å; N766-K769 PolarHBondContact O-N 2.87Å; N766-A770 WeakPolarHBondContact O-CB 3.3Å; N766-A770 PolarHBondContact O-N 3.06Å
767	I	84.7	Confident	78.3	Confident	115 Å²	115	115.5 Å²	115.5	59%	0.59	56%	0.556	S	S	*	*	H	α-helix	trans	-65.9	-46.1	174.1	-69	163.8	0	0	0	110.9	R763 L764 I765 K769 A770 D771	R763-I767 WeakPolarHBondContact O-CD1 3.38Å; R763-I767 VanDerWaalsContact O-CG1 3.26Å; R763-I767 WeakPolarHBondContact O-CG1 3.45Å; R763-I767 PolarHBondContact O-N 3Å; L764-I767 PolarHBondContact O-N 3.14Å; I765-I767 PolarHBondContact O-N 2.59Å; I767-K769 VanDerWaalsContact C-N 3.32Å; I767-K769 PolarHBondContact O-N 3.5Å; I767-A770 PolarHBondContact O-N 2.95Å; I767-D771 PolarHBondContact O-N 3.18Å
768	L	79.6	Confident	76.9	Confident	108 Å²	108	114.5 Å²	114.5	57%	0.565	55%	0.553	S	S	*	*	H	α-helix	trans	-62.3	-39.5	176.6	-73.5	167.7	0	0	0	111.9	L764 I765 D771 Y772	L764-L768 HydrophobicContact CD2-CD1 4.5Å; L764-L768 HydrophobicContact CG-CD1 4.27Å; L764-L768 WeakPolarHBondContact O-CB 3.36Å; L764-L768 WeakPolarHBondContact O-CG 3.24Å; L764-L768 PolarHBondContact O-N 2.83Å; I765-L768 PolarHBondContact O-N 3.04Å; L768-D771 PolarHBondContact O-N 3.06Å; L768-Y772 WeakPolarHBondContact O-CB 3.47Å; L768-Y772 PolarHBondContact O-N 3.2Å
769	K	79.5	Confident	75.3	Confident	131 Å²	131	116 Å²	116	57%	0.57	56%	0.56	S	S	*	*	H	α-helix	trans	-66.5	-36.9	175.5	-164.8	172.5	-174.3	176.9	0	111.5	I765 N766 I767 M773	I765-K769 WeakPolarHBondContact O-CB 3.34Å; I765-K769 PolarHBondContact O-N 3.28Å; N766-K769 PolarHBondContact O-N 2.87Å; I767-K769 VanDerWaalsContact C-N 3.32Å; I767-K769 PolarHBondContact O-N 3.5Å; K769-M773 WeakPolarHBondContact O-CB 3.35Å; K769-M773 WeakPolarHBondContact O-CG 3.35Å; K769-M773 PolarHBondContact O-N 2.97Å
770	A	77.3	Confident	73.8	Confident	59 Å²	59	114 Å²	114	49%	0.488	56%	0.555	S	S	.	*	H	α-helix	trans	-67.9	-43.3	173.4	0	0	0	0	0	112.5	N766 I767 M773 C774	N766-A770 WeakPolarHBondContact O-CB 3.3Å; N766-A770 PolarHBondContact O-N 3.06Å; I767-A770 PolarHBondContact O-N 2.95Å; A770-M773 PolarHBondContact O-N 3.44Å; A770-C774 WeakPolarHBondContact O-CB 3.38Å; A770-C774 PolarHBondContact O-N 3.4Å
771	D	78.5	Confident	71.9	Confident	78 Å²	78	114 Å²	114	42%	0.417	56%	0.557	S	S	.	*	H	α-helix	trans	-65.2	-40.5	176.7	-169	59.8	0	0	0	111.7	I767 L768 C774 K775	I767-D771 PolarHBondContact O-N 3.18Å; L768-D771 PolarHBondContact O-N 3.06Å; D771-C774 PolarHBondContact O-N 2.8Å; D771-K775 PolarHBondContact O-N 2.79Å; D771-K775 IonicContact OD2-NZ 2.71Å; D771-K775 PolarHBondContact OD2-NZ 3.49Å
772	Y	75.4	Confident	70	Confident	165 Å²	165	115.8 Å²	115.8	65%	0.647	57%	0.567	S	S	*	*	H	α-helix	trans	-62.2	-45.1	173.4	-164.5	-87	0	0	0	111.8	L768 C774 K775 Y776	L768-Y772 WeakPolarHBondContact O-CB 3.47Å; L768-Y772 PolarHBondContact O-N 3.2Å; Y772-C774 VanDerWaalsContact C-N 3.31Å; Y772-C774 PolarHBondContact O-N 2.87Å; Y772-K775 PolarHBondContact O-N 2.92Å; Y772-Y776 HydrophobicContact CE1-CD2 4.47Å; Y772-Y776 WeakPolarHBondContact O-CB 3.38Å; Y772-Y776 PolarHBondContact O-N 3.37Å
773	M	71.6	Confident	67.9	Low	116 Å²	116	116.6 Å²	116.6	57%	0.571	58%	0.575	S	S	*	*	H	α-helix	trans	-64.9	-32.8	175.1	-73.5	-70.1	-174.7	0	0	112.9	K769 A770 R777	K769-M773 WeakPolarHBondContact O-CB 3.35Å; K769-M773 WeakPolarHBondContact O-CG 3.35Å; K769-M773 PolarHBondContact O-N 2.97Å; A770-M773 PolarHBondContact O-N 3.44Å; M773-R777 VanDerWaalsContact O-CB 3.32Å; M773-R777 WeakPolarHBondContact O-CB 3.22Å; M773-R777 PolarHBondContact O-N 3.13Å
774	C	66.3	Low	65.7	Low	83 Å²	83	115.1 Å²	115.1	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-68.9	-47	175.7	-169.5	0	0	0	0	111.4	A770 D771 Y772 Y776 R777 S778	A770-C774 WeakPolarHBondContact O-CB 3.38Å; A770-C774 PolarHBondContact O-N 3.4Å; D771-C774 PolarHBondContact O-N 2.8Å; Y772-C774 VanDerWaalsContact C-N 3.31Å; Y772-C774 PolarHBondContact O-N 2.87Å; C774-Y776 PolarHBondContact O-N 3.5Å; C774-R777 PolarHBondContact O-N 2.74Å; C774-S778 PolarHBondContact O-N 3.42Å
775	K	67.2	Low	63.5	Low	126 Å²	126	117.1 Å²	117.1	55%	0.548	60%	0.597	S	S	.	*	H	α-helix	trans	-61.1	-42.7	173.2	-78.5	169.7	177.9	147.5	0	112.4	D771 Y772 S778 Q779	D771-K775 PolarHBondContact O-N 2.79Å; D771-K775 IonicContact OD2-NZ 2.71Å; D771-K775 PolarHBondContact OD2-NZ 3.49Å; Y772-K775 PolarHBondContact O-N 2.92Å; K775-S778 PolarHBondContact O-N 2.83Å; K775-Q779 PolarHBondContact O-N 3.44Å
776	Y	63.6	Low	61.3	Low	136 Å²	136	118.6 Å²	118.6	53%	0.533	62%	0.615	S	S	.	*	H	α-helix	trans	-63.4	-43.4	177	-159.4	-92.5	0	0	0	111.5	Y772 C774 S778 Q779 V780	Y772-Y776 HydrophobicContact CE1-CD2 4.47Å; Y772-Y776 WeakPolarHBondContact O-CB 3.38Å; Y772-Y776 PolarHBondContact O-N 3.37Å; C774-Y776 PolarHBondContact O-N 3.5Å; Y776-S778 PolarHBondContact O-N 2.89Å; Y776-Q779 PolarHBondContact O-N 3.45Å; Y776-V780 HydrophobicContact CD1-CG2 4Å; Y776-V780 HydrophobicContact CE1-CG2 3.88Å; Y776-V780 VanDerWaalsContact O-CG2 3.3Å; Y776-V780 WeakPolarHBondContact O-CG2 3.49Å; Y776-V780 PolarHBondContact O-N 3.27Å
777	R	58.6	Low	59.5	Low	174 Å²	174	118.3 Å²	118.3	66%	0.657	62%	0.617	S	S	*	*	H	α-helix	trans	-60.7	-43.3	174.6	-178.8	174.1	-71.3	-116.2	-0.8	112.3	M773 C774 Q779 V780 E781	M773-R777 VanDerWaalsContact O-CB 3.32Å; M773-R777 WeakPolarHBondContact O-CB 3.22Å; M773-R777 PolarHBondContact O-N 3.13Å; C774-R777 PolarHBondContact O-N 2.74Å; R777-Q779 VanDerWaalsContact C-N 3.31Å; R777-Q779 PolarHBondContact O-N 2.81Å; R777-V780 PolarHBondContact O-N 3.38Å; R777-E781 PolarHBondContact O-N 3.42Å; R777-E781 VanDerWaalsContact O-N 3.12Å
778	S	53.9	Low	57.3	Low	71 Å²	71	123 Å²	123	50%	0.497	63%	0.633	S	S	.	*	H	α-helix	trans	-69.6	-25.7	179.6	-168.1	0	0	0	0	113.5	C774 K775 Y776 N782	C774-S778 PolarHBondContact O-N 3.42Å; K775-S778 PolarHBondContact O-N 2.83Å; Y776-S778 PolarHBondContact O-N 2.89Å; S778-N782 PolarHBondContact O-ND2 3.47Å; S778-N782 VanDerWaalsContact O-ND2 3.13Å
779	Q	49.4	Very low	55.7	Low	143 Å²	143	126.3 Å²	126.3	67%	0.668	65%	0.645	S	S	*	*	H	α-helix	trans	-76.7	-33.4	169.1	-74.6	-176.3	-16.8	0	0	112.9	K775 Y776 R777 E781 N782	K775-Q779 PolarHBondContact O-N 3.44Å; Y776-Q779 PolarHBondContact O-N 3.45Å; R777-Q779 VanDerWaalsContact C-N 3.31Å; R777-Q779 PolarHBondContact O-N 2.81Å; Q779-E781 VanDerWaalsContact C-N 3.34Å; Q779-N782 PolarHBondContact O-N 2.95Å
780	V	52.2	Low	54	Low	86 Å²	86	123.6 Å²	123.6	52%	0.521	64%	0.643	S	S	.	*	H	α-helix	trans	-75.7	-19.6	178.8	171.2	0	0	0	0	113.1	Y776 R777 N782	Y776-V780 HydrophobicContact CD1-CG2 4Å; Y776-V780 HydrophobicContact CE1-CG2 3.88Å; Y776-V780 VanDerWaalsContact O-CG2 3.3Å; Y776-V780 WeakPolarHBondContact O-CG2 3.49Å; Y776-V780 PolarHBondContact O-N 3.27Å; R777-V780 PolarHBondContact O-N 3.38Å; V780-N782 VanDerWaalsContact C-N 3.31Å; V780-N782 PolarHBondContact O-N 3.33Å
781	E	47.4	Very low	52.2	Low	147 Å²	147	125.9 Å²	125.9	69%	0.687	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	1.4	174.4	-80.8	174.4	159.8	0	0	114.6	R777 Q779	R777-E781 PolarHBondContact O-N 3.42Å; R777-E781 VanDerWaalsContact O-N 3.12Å; Q779-E781 VanDerWaalsContact C-N 3.34Å
782	N	45.4	Very low	50.5	Low	134 Å²	134	129 Å²	129	72%	0.717	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	20.4	-178.3	-77.9	-69.9	0	0	0	114.7	S778 Q779 V780	S778-N782 PolarHBondContact O-ND2 3.47Å; S778-N782 VanDerWaalsContact O-ND2 3.13Å; Q779-N782 PolarHBondContact O-N 2.95Å; V780-N782 VanDerWaalsContact C-N 3.31Å; V780-N782 PolarHBondContact O-N 3.33Å
783	T	40.8	Very low	48.8	Very low	107 Å²	107	127.2 Å²	127.2	66%	0.656	66%	0.66	S	S	*	*	S	Bend	trans	-135.6	135.7	175.2	49.6	0	0	0	0	112.1
784	D	38.7	Very low	47.4	Very low	155 Å²	155	124.9 Å²	124.9	83%	0.829	66%	0.655	S	S	*	*			trans	-62.4	158.4	-168.1	-79.2	-65.5	0	0	0	116.7
785	V	37.5	Very low	46.3	Very low	141 Å²	141	125.8 Å²	125.8	86%	0.855	65%	0.653	S	S	*	*	S	Bend	trans	-22	125.7	161.1	-172.7	0	0	0	0	114
786	S	38.9	Very low	44.9	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	66%	0.659	S	S	*	*	S	Bend	trans	133.7	20.3	156.7	-156.4	0	0	0	0	117.4
787	V	43.1	Very low	43.5	Very low	96 Å²	96	129.6 Å²	129.6	58%	0.582	67%	0.67	S	S	*	*			trans	-133.6	42.3	169.7	-155.5	0	0	0	0	113.4	S790	V787-S790 WeakPolarHBondContact CG1-OG 3.26Å
788	K	39.4	Very low	42.5	Very low	213 Å²	213	128.5 Å²	128.5	93%	0.926	68%	0.676	S	S	*	*	S	Bend	trans	-93	4.4	176.3	-80.4	-173.4	176.1	177.1	0	115
789	H	44.4	Very low	41.7	Very low	179 Å²	179	132.2 Å²	132.2	83%	0.829	69%	0.686	S	S	*	*	S	Bend	trans	-133.5	7.4	-168.2	-133.5	-67	0	0	0	116.1
790	S	43.6	Very low	41	Very low	74 Å²	74	132.9 Å²	132.9	52%	0.517	69%	0.689	S	S	.	*	S	Bend	trans	-128	2.4	-175.3	54.7	0	0	0	0	115.3	V787	V787-S790 WeakPolarHBondContact CG1-OG 3.26Å
791	L	39.8	Very low	40.1	Very low	107 Å²	107	134.9 Å²	134.9	56%	0.56	70%	0.701	S	S	*	*	S	Bend	trans	-112.1	3.6	176.3	-81	165.1	0	0	0	113.5	I795	L791-I795 WeakPolarHBondContact O-CD1 3.38Å
792	Q	42.4	Very low	39.2	Very low	142 Å²	142	135.7 Å²	135.7	66%	0.664	71%	0.71	S	S	*	*	S	Bend	trans	-73.9	-34.3	175.5	-167.1	64.1	20.4	0	0	111.6	S794	Q792-S794 PolarHBondContact O-N 3.33Å
793	D	41.1	Very low	38.3	Very low	128 Å²	128	134.8 Å²	134.8	68%	0.684	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-16.1	-174.9	-57.6	-34.7	0	0	0	113.6
794	S	42.2	Very low	37.8	Very low	68 Å²	68	134.4 Å²	134.4	48%	0.476	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.9	-16.6	177.8	-0.3	0	0	0	0	113.3	Q792	Q792-S794 PolarHBondContact O-N 3.33Å
795	I	43.4	Very low	37.4	Very low	102 Å²	102	135.2 Å²	135.2	52%	0.523	72%	0.719	S	S	.	*	G	3₁₀ helix	trans	-80.6	-23.4	-177.3	-67.7	172.7	0	0	0	111.4	L791 Y797	L791-I795 WeakPolarHBondContact O-CD1 3.38Å; I795-Y797 VanDerWaalsContact C-N 3.3Å; I795-Y797 PolarHBondContact O-N 3.35Å
796	Q	36.6	Very low	37	Very low	141 Å²	141	137.5 Å²	137.5	66%	0.659	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-76.5	-11.2	-173.4	-154.8	160.4	-3.6	0	0	114.4
797	Y	35	Very low	36.5	Very low	200 Å²	200	139.8 Å²	139.8	78%	0.784	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-92.7	-8.7	-178.8	-135	-91.1	0	0	0	115	I795	I795-Y797 VanDerWaalsContact C-N 3.3Å; I795-Y797 PolarHBondContact O-N 3.35Å
798	I	37.1	Very low	35.7	Very low	151 Å²	151	141.3 Å²	141.3	77%	0.774	73%	0.725	S	S	*	*	S	Bend	trans	-104.3	-4.2	177.4	-64.5	176.4	0	0	0	111.2
799	Q	37	Very low	35.1	Very low	150 Å²	150	138.4 Å²	138.4	70%	0.701	72%	0.715	S	S	*	*	S	Bend	trans	-96.6	16.6	-173.9	-132.5	164.2	-6.4	0	0	114
800	Q	34.7	Very low	34.2	Very low	157 Å²	157	137.3 Å²	137.3	73%	0.734	71%	0.71	S	S	*	*			trans	-114.9	12.8	-166.9	-128.4	174.5	21.1	0	0	115.9
801	T	34.6	Very low	33.3	Very low	127 Å²	127	139.6 Å²	139.6	78%	0.779	72%	0.721	S	S	*	*	S	Bend	trans	-125.6	43.7	177.3	47.7	0	0	0	0	113.2
802	N	28.2	Very low	32.7	Very low	164 Å²	164	143 Å²	143	88%	0.877	73%	0.734	S	S	*	*			trans	-161.1	98.7	166.6	-104.2	-32	0	0	0	113.1
803	C	26.8	Very low	31.9	Very low	116 Å²	116	140.7 Å²	140.7	78%	0.784	73%	0.732	S	S	*	*			trans	-169.1	113.7	148.4	-120.8	0	0	0	0	107
804	S	28.4	Very low	31.3	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	74%	0.736	S	S	*	*				68.7	104.4	95.1	-59.9	0	0	0	0	113.3
805	D	31.3	Very low	30.8	Very low	171 Å²	171	145.2 Å²	145.2	91%	0.914	76%	0.757	S	S	*	*				-163.8	149.4	120.4	-103.9	-28.1	0	0	0	114
806	K	28.2	Very low	30	Very low	189 Å²	189	146.8 Å²	146.8	82%	0.822	77%	0.766	S	S	*	*			trans	-95.9	132.2	172	-57.2	163.8	179.1	169.8	0	108.2
807	L	29.3	Very low	29.5	Very low	162 Å²	162	148.6 Å²	148.6	85%	0.848	77%	0.772	S	S	*	*				-174.7	166.4	127.8	-127.5	65.6	0	0	0	114.6
808	N	25.8	Very low	29.1	Very low	127 Å²	127	143.6 Å²	143.6	68%	0.679	77%	0.766	S	S	*	*			trans	-55.6	174.5	176.8	-59.2	-34.2	0	0	0	116.7
809	H	27.9	Very low	28.8	Very low	153 Å²	153	142.6 Å²	142.6	71%	0.708	77%	0.769	S	S	*	*			trans	85.3	103.1	162.8	-66.5	-70.8	0	0	0	116.7
810	Q	24.9	Very low	28.5	Very low	156 Å²	156	140.7 Å²	140.7	73%	0.729	77%	0.77	S	S	*	*				76.9	104.9	70.3	-173.1	173.3	12.2	0	0	112.5
811	T	24.3	Very low	28.5	Very low	122 Å²	122	138.2 Å²	138.2	75%	0.748	77%	0.768	S	S	*	*			trans	68.7	109.3	151	-50.2	0	0	0	0	118.2
812	Q	26.8	Very low	28.2	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	77%	0.771	S	S	*	*				-157.9	139.2	124.6	-112.9	178.9	9.9	0	0	113.8
813	C	26.2	Very low	28.1	Very low	94 Å²	94	140.6 Å²	140.6	64%	0.635	76%	0.763	S	S	*	*			trans	40.4	108.8	145.5	-63.6	0	0	0	0	119.9
814	N	27.9	Very low	28.2	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	76%	0.761	S	S	*	*				84.3	95.8	75.2	-73	-12	0	0	0	113.9
815	T	33.2	Very low	28.1	Very low	150 Å²	150	142.6 Å²	142.6	92%	0.92	77%	0.768	S	S	*	*			trans	-134.6	123	142.8	24.2	0	0	0	0	109.5
816	L	25.5	Very low	28	Very low	136 Å²	136	138.3 Å²	138.3	71%	0.712	76%	0.764	S	S	*	*			trans	-68.8	152.7	-170.4	-95.8	66.8	0	0	0	114.4
817	F	27.2	Very low	27.9	Very low	179 Å²	179	137.5 Å²	137.5	79%	0.785	76%	0.763	S	S	*	*			trans	75	109.9	144.4	-80.3	-130.9	0	0	0	120.7
818	S	26.5	Very low	27.8	Very low	95 Å²	95	138.1 Å²	138.1	66%	0.664	76%	0.755	S	S	*	*				59.7	119	118.6	-48.2	0	0	0	0	121.7
819	P	31.3	Very low	28.1	Very low	130 Å²	130	138.3 Å²	138.3	84%	0.844	76%	0.764	S	S	*	*			trans	-117.2	114	154.1	34.8	-23.4	0	0	0	113.6
820	P	30.8	Very low	28	Very low	109 Å²	109	139.3 Å²	139.3	71%	0.708	77%	0.766	S	S	*	*			trans	-94.5	-173.1	147.9	39.4	-30.9	0	0	0	109.4
821	P	33.8	Very low	28.2	Very low	106 Å²	106	138.7 Å²	138.7	69%	0.688	77%	0.773	S	S	*	*				-130.7	177.5	-62.8	41.4	-27.9	0	0	0	113.1
822	R	27.6	Very low	28.5	Very low	224 Å²	224	138.2 Å²	138.2	85%	0.845	77%	0.774	S	S	*	*			trans	74.6	138.1	153.4	-74.7	-175.6	-168	-144.2	2.2	122.5
823	T	27.1	Very low	28.6	Very low	116 Å²	116	138.8 Å²	138.8	71%	0.712	78%	0.777	S	S	*	*			trans	89.7	130	136.7	38.3	0	0	0	0	122.9
824	T	28.8	Very low	28.8	Very low	121 Å²	121	141.6 Å²	141.6	74%	0.742	79%	0.785	S	S	*	*			trans	64.2	132.4	146.5	46.7	0	0	0	0	119
825	T	26	Very low	29	Very low	137 Å²	137	142.4 Å²	142.4	84%	0.84	78%	0.782	S	S	*	*			cis	173.8	134	-13.2	14.1	0	0	0	0	103.6
826	G	29.6	Very low	28.7	Very low	81 Å²	81	141.9 Å²	141.9	84%	0.835	78%	0.778	S	S	*	*			trans	-162.2	143.3	177.2	0	0	0	0	0	111
827	Q	26.7	Very low	29	Very low	172 Å²	172	140.6 Å²	140.6	80%	0.804	77%	0.767	S	S	*	*			trans	-113.2	137.4	-154.2	-83.4	177.1	-45.1	0	0	116
828	Y	25.6	Very low	29.1	Very low	174 Å²	174	138.8 Å²	138.8	68%	0.682	77%	0.771	S	S	*	*			trans	65.3	150.5	139.9	-70.3	-48.7	0	0	0	119.6	K830	Y828-K830 HydrophobicContact CD1-CG 4.24Å; Y828-K830 HydrophobicContact CE1-CG 4.43Å
829	P	31.7	Very low	29.3	Very low	131 Å²	131	139.7 Å²	139.7	85%	0.851	77%	0.767	S	S	*	*				-124.3	169	51.3	28.9	-8.5	0	0	0	117.9
830	K	25.9	Very low	29.3	Very low	174 Å²	174	142 Å²	142	76%	0.757	77%	0.766	S	S	*	*			trans	-87.9	146.2	-174.5	-62.5	169.3	177	172.5	0	112.5	Y828	Y828-K830 HydrophobicContact CD1-CG 4.24Å; Y828-K830 HydrophobicContact CE1-CG 4.43Å
831	V	30.8	Very low	29.2	Very low	144 Å²	144	146.9 Å²	146.9	87%	0.873	77%	0.771	S	S	*	*			trans	-129.9	149.1	161.3	179.6	0	0	0	0	109.2
832	S	29.8	Very low	28.9	Very low	111 Å²	111	152.1 Å²	152.1	78%	0.776	78%	0.777	S	S	*	*			trans	-76.2	147	-155.6	49.7	0	0	0	0	117.4
833	E	28	Very low	28.9	Very low	190 Å²	190	147.3 Å²	147.3	89%	0.888	78%	0.775	S	S	*	*			trans	-70.5	140.5	174.6	-53.6	174.7	135.2	0	0	113
834	D	32	Very low	29	Very low	152 Å²	152	147.5 Å²	147.5	81%	0.813	78%	0.779	S	S	*	*			trans	-130.9	148.4	165.9	-136.5	-18.3	0	0	0	113.2
835	K	30.8	Very low	28.9	Very low	159 Å²	159	149.7 Å²	149.7	69%	0.691	79%	0.786	S	S	*	*			trans	-93.8	119.4	-148.8	-66.4	148	-174.5	150.4	0	114.6	F837	K835-F837 HydrophobicContact CB-CD2 4.28Å; K835-F837 HydrophobicContact CB-CE2 3.54Å; K835-F837 HydrophobicContact CB-CZ 3.9Å; K835-F837 HydrophobicContact CD-CZ 4.36Å; K835-F837 WeakPolarHBondContact O-CD2 3.37Å
836	V	27.7	Very low	29	Very low	138 Å²	138	154.4 Å²	154.4	84%	0.836	79%	0.789	S	S	*	*			trans	-78.4	131.9	168.1	-178.3	0	0	0	0	110.9
837	F	30.7	Very low	29.1	Very low	109 Å²	109	158 Å²	158	48%	0.478	78%	0.778	S	S	.	*			trans	-125.8	128	175.7	-66.3	-83.9	0	0	0	111.1	K835 K849	K835-F837 HydrophobicContact CB-CD2 4.28Å; K835-F837 HydrophobicContact CB-CE2 3.54Å; K835-F837 HydrophobicContact CB-CZ 3.9Å; K835-F837 HydrophobicContact CD-CZ 4.36Å; K835-F837 WeakPolarHBondContact O-CD2 3.37Å; F837-K849 HydrophobicContact CD1-CD 3.65Å; F837-K849 HydrophobicContact CD1-CG 4.08Å; F837-K849 VanDerWaalsContact CD2-NZ 3.31Å; F837-K849 HydrophobicContact CE1-CD 3.55Å; F837-K849 HydrophobicContact CE1-CG 4.32Å; F837-K849 HydrophobicContact CG-CD 4.32Å; F837-K849 HydrophobicContact CZ-CD 4.14Å
838	V	29.1	Very low	29.3	Very low	141 Å²	141	158.5 Å²	158.5	86%	0.855	78%	0.78	S	S	*	*			trans	-86.1	131.4	171.1	179.4	0	0	0	0	109.9
839	I	31	Very low	29.6	Very low	115 Å²	115	157.3 Å²	157.3	59%	0.59	78%	0.779	S	S	*	*			trans	-103.2	116	178.5	-73.9	169	0	0	0	109.3	Y847	I839-Y847 HydrophobicContact CB-CE1 4.49Å; I839-Y847 HydrophobicContact CD1-CE1 4.16Å; I839-Y847 HydrophobicContact CG1-CD1 4.41Å; I839-Y847 HydrophobicContact CG1-CE1 4.24Å; I839-Y847 HydrophobicContact CG2-CD1 4.09Å; I839-Y847 HydrophobicContact CG2-CE1 3.47Å; I839-Y847 VanDerWaalsContact CG2-CE1 3.47Å
840	Q	32.5	Very low	29.7	Very low	178 Å²	178	159.6 Å²	159.6	83%	0.832	78%	0.778	S	S	*	*			trans	-106.1	117.5	174.1	-161.2	171.7	9.4	0	0	110.2
841	R	27.1	Very low	30	Very low	211 Å²	211	160.9 Å²	160.9	80%	0.796	78%	0.784	S	S	*	*			trans	-84	113.9	178.3	-84.5	-175.6	168.2	176.8	-1.4	111.3
842	R	29.1	Very low	30.3	Very low	217 Å²	217	159.4 Å²	159.4	82%	0.819	77%	0.77	S	S	*	*			trans	-91.1	157.3	155.9	-74.7	-169	-175.2	-170.5	4.3	110.1
843	P	27	Very low	30.6	Very low	123 Å²	123	158 Å²	158	80%	0.799	76%	0.758	S	S	*	*	S	Bend	trans	-67.8	136.8	172.9	28.6	-33.8	0	0	0	110.4
844	C	28.6	Very low	30.9	Very low	119 Å²	119	153 Å²	153	80%	0.804	74%	0.743	S	S	*	*	S	Bend	trans	82.8	134.9	-171.4	-49.5	0	0	0	0	115.1	R846	C844-R846 PolarHBondContact O-N 3.4Å
845	N	27.2	Very low	31.2	Very low	167 Å²	167	150.4 Å²	150.4	89%	0.893	74%	0.737	S	S	*	*	S	Bend	trans	-70.8	91.9	-165	-65	-24.8	0	0	0	113.7
846	R	29.1	Very low	31.7	Very low	237 Å²	237	147.9 Å²	147.9	89%	0.894	73%	0.728	S	S	*	*			trans	-148.5	131.2	154.1	-99.6	-179.8	-171.2	-179.3	2.2	110.3	C844	C844-R846 PolarHBondContact O-N 3.4Å
847	Y	30.3	Very low	32	Very low	156 Å²	156	148.9 Å²	148.9	61%	0.612	72%	0.716	S	S	*	*			trans	-102.3	126.7	170.1	-73.2	-112.2	0	0	0	107.6	I839	I839-Y847 HydrophobicContact CB-CE1 4.49Å; I839-Y847 HydrophobicContact CD1-CE1 4.16Å; I839-Y847 HydrophobicContact CG1-CD1 4.41Å; I839-Y847 HydrophobicContact CG1-CE1 4.24Å; I839-Y847 HydrophobicContact CG2-CD1 4.09Å; I839-Y847 HydrophobicContact CG2-CE1 3.47Å; I839-Y847 VanDerWaalsContact CG2-CE1 3.47Å
848	Q	31.9	Very low	32.1	Very low	182 Å²	182	150.3 Å²	150.3	85%	0.85	73%	0.729	S	S	*	*			trans	-126.1	120.4	174	-169.5	166.2	-7.1	0	0	108.2
849	K	30.9	Very low	32.3	Very low	149 Å²	149	148.3 Å²	148.3	65%	0.648	72%	0.722	S	S	*	*			trans	-84.1	123.1	175.3	-74.9	179.7	168.8	-166.4	0	108.3	F837	F837-K849 HydrophobicContact CD1-CD 3.65Å; F837-K849 HydrophobicContact CD1-CG 4.08Å; F837-K849 VanDerWaalsContact CD2-NZ 3.31Å; F837-K849 HydrophobicContact CE1-CD 3.55Å; F837-K849 HydrophobicContact CE1-CG 4.32Å; F837-K849 HydrophobicContact CG-CD 4.32Å; F837-K849 HydrophobicContact CZ-CD 4.14Å
850	Q	34.8	Very low	32.3	Very low	179 Å²	179	149.4 Å²	149.4	84%	0.836	73%	0.728	S	S	*	*			trans	-114.1	137.3	172.8	-145	165.9	2.2	0	0	108.3
851	K	30.8	Very low	32	Very low	201 Å²	201	145.9 Å²	145.9	87%	0.874	72%	0.719	S	S	*	*			trans	-104.6	108.8	-172.7	-175.2	-175.5	-179.1	-171.8	0	108.1
852	L	37.7	Very low	32.1	Very low	113 Å²	113	141.6 Å²	141.6	59%	0.592	72%	0.716	S	S	*	*			trans	-65.6	147	176.5	-94.8	73.3	0	0	0	111.1	E856	L852-E856 HydrophobicContact CD2-CB 4.38Å; L852-E856 WeakPolarHBondContact CD2-OE2 3.32Å; L852-E856 WeakPolarHBondContact CG-OE2 3.18Å
853	T	36.1	Very low	32.2	Very low	83 Å²	83	137.3 Å²	137.3	51%	0.509	71%	0.709	S	S	.	*			trans	-83.5	168.1	-174.2	47	0	0	0	0	112.1	S855	T853-S855 VanDerWaalsContact C-N 3.28Å; T853-S855 PolarHBondContact O-N 2.96Å
854	S	34.1	Very low	32.2	Very low	84 Å²	84	140.4 Å²	140.4	59%	0.587	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-15.4	-169.8	-53.5	0	0	0	0	115.3	R857	S854-R857 PolarHBondContact OG-NH2 3.26Å
855	S	38.3	Very low	32.2	Very low	98 Å²	98	139 Å²	139	69%	0.685	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-28	-179.7	45.5	0	0	0	0	113.9	T853 R857	T853-S855 VanDerWaalsContact C-N 3.28Å; T853-S855 PolarHBondContact O-N 2.96Å; S855-R857 VanDerWaalsContact C-N 3.28Å; S855-R857 PolarHBondContact O-N 2.94Å
856	E	41.4	Very low	32.2	Very low	105 Å²	105	139 Å²	139	49%	0.491	70%	0.699	S	S	.	*	G	3₁₀ helix	trans	-82.9	-3	-179.9	-62.7	-179.9	127.4	0	0	113.3	L852	L852-E856 HydrophobicContact CD2-CB 4.38Å; L852-E856 WeakPolarHBondContact CD2-OE2 3.32Å; L852-E856 WeakPolarHBondContact CG-OE2 3.18Å
857	R	34.1	Very low	32.2	Very low	159 Å²	159	131.8 Å²	131.8	60%	0.6	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-86.5	-8.7	-175.5	-75	-171.7	-88.5	159.6	-2.1	115	S854 S855	S854-R857 PolarHBondContact OG-NH2 3.26Å; S855-R857 VanDerWaalsContact C-N 3.28Å; S855-R857 PolarHBondContact O-N 2.94Å
858	N	32.7	Very low	32.2	Very low	139 Å²	139	129.9 Å²	129.9	74%	0.743	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-104.6	6	-174	-68.2	-1.7	0	0	0	114.5
859	S	34.6	Very low	32.2	Very low	100 Å²	100	128.8 Å²	128.8	70%	0.699	68%	0.683	S	S	*	*	S	Bend	trans	-107.8	11.4	177.4	58.7	0	0	0	0	114.3
860	L	29.5	Very low	32.3	Very low	137 Å²	137	128 Å²	128	72%	0.717	69%	0.691	S	S	*	*			trans	-126.7	46.3	-176.8	-91.9	162.2	0	0	0	112.7	V862	L860-V862 VanDerWaalsContact C-N 3.29Å; L860-V862 PolarHBondContact O-N 2.89Å
861	T	26.8	Very low	32.1	Very low	105 Å²	105	126.4 Å²	126.4	64%	0.644	68%	0.683	S	S	*	*			trans	-79.9	72.4	172.7	-43.6	0	0	0	0	110.9	N863	T861-N863 VanDerWaalsContact C-N 3.3Å; T861-N863 PolarHBondContact O-N 2.87Å; T861-N863 VanDerWaalsContact O-N 3.08Å
862	V	30.1	Very low	31.9	Very low	121 Å²	121	126.2 Å²	126.2	73%	0.733	68%	0.677	S	S	*	*			trans	-82.5	82.5	169.2	-173.3	0	0	0	0	108.9	L860	L860-V862 VanDerWaalsContact C-N 3.29Å; L860-V862 PolarHBondContact O-N 2.89Å
863	N	30.4	Very low	31.5	Very low	126 Å²	126	132.5 Å²	132.5	67%	0.674	69%	0.693	S	S	*	*			trans	-58.1	138.3	165.7	-72.4	-36	0	0	0	109.6	T861 P865	T861-N863 VanDerWaalsContact C-N 3.3Å; T861-N863 PolarHBondContact O-N 2.87Å; T861-N863 VanDerWaalsContact O-N 3.08Å; N863-P865 WeakPolarHBondContact O-CD 3.38Å
864	F	26.4	Very low	31.2	Very low	189 Å²	189	138.1 Å²	138.1	83%	0.829	71%	0.71	S	S	*	*			trans	-77.7	130.8	162.3	-85.9	-105.4	0	0	0	109.4
865	P	29.4	Very low	30.8	Very low	90 Å²	90	138.9 Å²	138.9	58%	0.584	72%	0.716	S	S	*	*			trans	-128	105	149.2	24.8	-5.7	0	0	0	110.3	N863 S867	N863-P865 WeakPolarHBondContact O-CD 3.38Å; P865-S867 PolarHBondContact O-N 3.33Å
866	L	27.1	Very low	30.5	Very low	166 Å²	166	140.8 Å²	140.8	87%	0.869	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	61.4	178.3	-132.7	155.6	0	0	0	109.9
867	S	29.3	Very low	29.8	Very low	86 Å²	86	142.8 Å²	142.8	60%	0.601	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.6	-7	-176.4	55.7	0	0	0	0	118.4	P865	P865-S867 PolarHBondContact O-N 3.33Å
868	L	30.2	Very low	29.5	Very low	116 Å²	116	141.8 Å²	141.8	61%	0.607	74%	0.743	S	S	*	*			trans	-123	25.1	-163.7	-79.4	169.5	0	0	0	117.3
869	I	32	Very low	29.5	Very low	158 Å²	158	144.1 Å²	144.1	81%	0.81	75%	0.749	S	S	*	*	S	Bend	trans	-102.8	-14.5	179.7	-66.5	178.6	0	0	0	113.4
870	T	33.1	Very low	29.1	Very low	134 Å²	134	145.9 Å²	145.9	82%	0.822	76%	0.756	S	S	*	*	S	Bend	trans	-86.1	-16.4	177.4	8.5	0	0	0	0	114.9
871	E	29.9	Very low	29	Very low	145 Å²	145	144.4 Å²	144.4	68%	0.678	76%	0.757	S	S	*	*	S	Bend	trans	-97.7	-15.8	-175.2	-76.3	-72	120.4	0	0	114.2	W873	E871-W873 PolarHBondContact O-N 3.2Å
872	R	26.2	Very low	29.1	Very low	197 Å²	197	145.2 Å²	145.2	74%	0.743	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-2.6	-168.9	-162.5	163.3	-178.3	169.3	2.8	115.7
873	W	29.7	Very low	29	Very low	245 Å²	245	148 Å²	148	93%	0.928	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	23.4	178.6	-83.7	93.8	0	0	0	113.7	E871	E871-W873 PolarHBondContact O-N 3.2Å
874	K	29.6	Very low	28.8	Very low	200 Å²	200	147.6 Å²	147.6	87%	0.87	76%	0.762	S	S	*	*	S	Bend	trans	-143.7	10.4	-173	-123.5	-178.8	-178.7	-173.7	0	116.9
875	S	26.9	Very low	29	Very low	101 Å²	101	145.3 Å²	145.3	71%	0.706	76%	0.758	S	S	*	*			trans	-151.9	33.6	-166.8	-171.2	0	0	0	0	115.6
876	I	30.3	Very low	29	Very low	138 Å²	138	151.5 Å²	151.5	71%	0.708	77%	0.772	S	S	*	*			trans	-132.9	54.3	168.7	-44.9	-179.5	0	0	0	109.9
877	D	27.6	Very low	29.3	Very low	147 Å²	147	148.7 Å²	148.7	79%	0.786	76%	0.763	S	S	*	*	S	Bend	trans	-107.1	142.7	147.1	-72.4	-57	0	0	0	106.7
878	T	28.7	Very low	29.3	Very low	137 Å²	137	151.1 Å²	151.1	84%	0.84	77%	0.769	S	S	*	*			trans	75.5	154.1	175.2	68.2	0	0	0	0	119.9
879	E	31	Very low	29.5	Very low	189 Å²	189	153 Å²	153	88%	0.883	78%	0.78	S	S	*	*			trans	83.4	73.4	165.9	-50.8	-150.1	143.6	0	0	120.7
880	T	26.1	Very low	29.3	Very low	136 Å²	136	152 Å²	152	83%	0.834	77%	0.772	S	S	*	*			trans	-70.1	129.6	144.6	45.2	0	0	0	0	112.8
881	S	27.4	Very low	29.2	Very low	106 Å²	106	153.1 Å²	153.1	74%	0.741	77%	0.765	S	S	*	*			trans	177.6	149.1	133	-93.1	0	0	0	0	116.1
882	T	30.6	Very low	29.2	Very low	122 Å²	122	152.4 Å²	152.4	75%	0.748	77%	0.766	S	S	*	*			trans	58.2	117.7	154	51	0	0	0	0	119.2
883	K	27.5	Very low	29.5	Very low	181 Å²	181	149.1 Å²	149.1	79%	0.787	76%	0.763	S	S	*	*				63.2	136.4	79.2	-80.9	-158.5	170	-176.5	0	112.9
884	N	26.6	Very low	29.4	Very low	116 Å²	116	142.4 Å²	142.4	62%	0.62	75%	0.749	S	S	*	*			cis	-166.1	-177.1	8.2	-135.7	38.1	0	0	0	111.5
885	D	30.2	Very low	29.6	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	75%	0.746	S	S	*	*			trans	93.4	124	150.9	-54	-27.9	0	0	0	123.2
886	Y	29.3	Very low	29.8	Very low	221 Å²	221	140.5 Å²	140.5	87%	0.867	74%	0.744	S	S	*	*			trans	-98.9	173.4	165.8	-93.4	-83.4	0	0	0	107.8
887	P	33.7	Very low	30	Very low	106 Å²	106	141.1 Å²	141.1	69%	0.688	75%	0.748	S	S	*	*				-164.1	172.8	59.2	44.3	-20	0	0	0	121.9
888	N	28.4	Very low	30.1	Very low	137 Å²	137	140.7 Å²	140.7	73%	0.733	74%	0.744	S	S	*	*			trans	41.9	136.2	138.7	-58	-8.3	0	0	0	124.3
889	N	34.6	Very low	30	Very low	155 Å²	155	145.1 Å²	145.1	83%	0.829	75%	0.747	S	S	*	*				176.2	154.4	122.3	-86.2	-19.4	0	0	0	109.5
890	E	27.7	Very low	30	Very low	138 Å²	138	142.1 Å²	142.1	65%	0.645	74%	0.737	S	S	*	*			cis	-170.9	165.7	-38.9	-148.2	-164.9	173	0	0	107.3
891	K	31.6	Very low	30.1	Very low	157 Å²	157	142.7 Å²	142.7	68%	0.683	73%	0.73	S	S	*	*			trans	71.7	145.4	157.8	-72.8	-178.8	173.2	96.1	0	119.4
892	L	29.3	Very low	30.4	Very low	131 Å²	131	144.2 Å²	144.2	69%	0.686	73%	0.73	S	S	*	*			cis	-171.3	140.2	-11.6	-173.4	62.8	0	0	0	111.9
893	N	31.6	Very low	30.2	Very low	127 Å²	127	146.5 Å²	146.5	68%	0.679	74%	0.738	S	S	*	*			trans	56.2	153.8	152.5	-69.8	6.5	0	0	0	122.6
894	T	29.2	Very low	30.4	Very low	105 Å²	105	145 Å²	145	64%	0.644	74%	0.738	S	S	*	*			cis	-163.7	139.2	-21.7	22.4	0	0	0	0	108
895	D	33.1	Very low	30.4	Very low	151 Å²	151	145.9 Å²	145.9	81%	0.807	74%	0.743	S	S	*	*			trans	146.7	142.5	135	-79.1	-28.2	0	0	0	114.4
896	T	30.6	Very low	30.3	Very low	109 Å²	109	150.3 Å²	150.3	67%	0.669	75%	0.749	S	S	*	*			cis	-159.6	154.5	-41.4	-79.9	0	0	0	0	106.7
897	I	34.1	Very low	30.1	Very low	152 Å²	152	148 Å²	148	78%	0.779	75%	0.746	S	S	*	*			trans	78.2	123.9	172.1	-38.3	-169.3	0	0	0	118.5
898	I	31.3	Very low	29.8	Very low	138 Å²	138	152.5 Å²	152.5	71%	0.708	76%	0.755	S	S	*	*			cis	-161.4	129.4	-40	-105.5	150.3	0	0	0	106.6
899	Y	25.3	Very low	29.7	Very low	229 Å²	229	151 Å²	151	90%	0.898	75%	0.75	S	S	*	*			trans	-140.7	120.1	168	-127.8	-79.5	0	0	0	106.2
900	N	30.8	Very low	29.4	Very low	127 Å²	127	155.2 Å²	155.2	68%	0.679	76%	0.756	S	S	*	*			trans	-135.5	144.8	176.1	-86.6	-2.5	0	0	0	106.5
901	Q	30.1	Very low	29.4	Very low	147 Å²	147	152.3 Å²	152.3	69%	0.687	75%	0.751	S	S	*	*			cis	-157.2	179.9	0.4	-134.4	173.3	-84.5	0	0	110.4
902	D	31.8	Very low	29.1	Very low	139 Å²	139	155.4 Å²	155.4	74%	0.743	76%	0.764	S	S	*	*			trans	73.1	82.2	161.3	-53.7	-13.4	0	0	0	117.8
903	N	27.5	Very low	28.9	Very low	169 Å²	169	152.3 Å²	152.3	90%	0.904	75%	0.754	S	S	*	*			trans	-67	137.8	147.6	-79.9	-48	0	0	0	109.8
904	D	31.9	Very low	28.6	Very low	149 Å²	149	154.6 Å²	154.6	80%	0.797	76%	0.76	S	S	*	*			trans	-145.2	154.7	143.9	-150.2	-5.2	0	0	0	112.5
905	N	26.6	Very low	28.4	Very low	135 Å²	135	159.8 Å²	159.8	72%	0.722	77%	0.774	S	S	*	*			trans	-80.7	141.3	-170.7	-59.3	-91.1	0	0	0	111.2
906	R	26.8	Very low	28	Very low	235 Å²	235	158.8 Å²	158.8	89%	0.887	77%	0.768	S	S	*	*				165.3	143.3	128.3	-90	159.3	-163.9	-159.8	7.7	114.3
907	H	26	Very low	27.7	Very low	173 Å²	173	158 Å²	158	80%	0.801	77%	0.767	S	S	*	*			trans	-10.6	130.3	146.4	-65.4	-99.8	0	0	0	118.6
908	K	27.6	Very low	27.4	Very low	200 Å²	200	159.1 Å²	159.1	87%	0.87	77%	0.768	S	S	*	*			trans	-167.4	108.6	132.4	-99.6	150.1	-175.8	-179	0	107.9
909	V	25.7	Very low	27.1	Very low	105 Å²	105	157.3 Å²	157.3	64%	0.636	77%	0.768	S	S	*	*				59.6	100.8	79.7	180	0	0	0	0	111.6
910	Y	28.8	Very low	27.2	Very low	244 Å²	244	155.9 Å²	155.9	96%	0.957	77%	0.77	S	S	*	*			trans	-100.7	93.1	147.5	-105.6	-77.9	0	0	0	107.9
911	S	27.5	Very low	26.9	Very low	77 Å²	77	158.2 Å²	158.2	54%	0.538	78%	0.777	S	S	.	*			trans	-74.8	127	-172.3	33.2	0	0	0	0	111.9	S913	S911-S913 VanDerWaalsContact C-N 3.34Å; S911-S913 WeakPolarHBondContact CB-OG 3.33Å; S911-S913 PolarHBondContact O-N 2.92Å
912	K	25	Very low	26.8	Very low	221 Å²	221	161 Å²	161	96%	0.961	79%	0.787	S	S	*	*			trans	-86.7	80.4	151.9	-168.1	177.8	-175.5	-178.3	0	107.3
913	S	26	Very low	26.6	Very low	67 Å²	67	159.5 Å²	159.5	47%	0.469	79%	0.785	S	S	.	*			trans	-134.7	111.9	175.4	58.1	0	0	0	0	108.6	S911	S911-S913 VanDerWaalsContact C-N 3.34Å; S911-S913 WeakPolarHBondContact CB-OG 3.33Å; S911-S913 PolarHBondContact O-N 2.92Å
914	Q	26	Very low	26.7	Very low	174 Å²	174	158.7 Å²	158.7	81%	0.813	78%	0.779	S	S	*	*				43.8	82.8	90.3	-77.4	-176.4	-33.3	0	0	112.1
915	F	24.3	Very low	26.4	Very low	214 Å²	214	156.8 Å²	156.8	94%	0.939	77%	0.773	S	S	*	*			trans	-83	109.1	152.2	-98.2	-93	0	0	0	107.5
916	I	24.7	Very low	26.4	Very low	131 Å²	131	158.6 Å²	158.6	67%	0.672	78%	0.775	S	S	*	*			trans	-129	125.1	167.3	-71.4	179.7	0	0	0	107
917	S	24.3	Very low	26.4	Very low	93 Å²	93	156.4 Å²	156.4	65%	0.65	77%	0.766	S	S	*	*			trans	45.1	125.5	164.5	65.1	0	0	0	0	120
918	H	26.6	Very low	26.5	Very low	174 Å²	174	158 Å²	158	81%	0.806	77%	0.765	S	S	*	*				-157.2	139.1	104.6	-112.4	-81.9	0	0	0	111.8
919	S	24.9	Very low	26.6	Very low	101 Å²	101	152 Å²	152	71%	0.706	75%	0.749	S	S	*	*			trans	38.2	108.7	157.5	55.3	0	0	0	0	120
920	E	28.6	Very low	26.7	Very low	199 Å²	199	156.1 Å²	156.1	93%	0.93	76%	0.759	S	S	*	*				-160.4	142.2	95.9	-103.5	175.4	179.2	0	0	110.8
921	E	24.8	Very low	27.1	Very low	176 Å²	176	149.7 Å²	149.7	82%	0.822	75%	0.746	S	S	*	*			trans	-82.4	140.7	179.2	-65.7	171.4	108.6	0	0	110.9
922	F	26.6	Very low	27.3	Very low	206 Å²	206	153.8 Å²	153.8	90%	0.904	76%	0.762	S	S	*	*			trans	-166	108.8	138.2	-105.2	-65.4	0	0	0	111.2
923	P	27.5	Very low	27.4	Very low	107 Å²	107	151.4 Å²	151.4	70%	0.695	75%	0.754	S	S	*	*			trans	-103.9	111.5	179.1	34.6	-27.4	0	0	0	112.3
924	L	30.1	Very low	27.6	Very low	151 Å²	151	153.6 Å²	153.6	79%	0.791	77%	0.769	S	S	*	*			trans	-136.6	89.3	167	-81.9	-179.3	0	0	0	114.1
925	T	25.6	Very low	27.6	Very low	110 Å²	110	150.8 Å²	150.8	68%	0.675	76%	0.764	S	S	*	*				43.5	139.6	125.6	66.3	0	0	0	0	122.7
926	K	27.3	Very low	27.9	Very low	173 Å²	173	145.9 Å²	145.9	75%	0.752	76%	0.757	S	S	*	*			trans	96.3	126.2	136.9	-87.8	170.6	180	165.9	0	120.8
927	R	26.2	Very low	28	Very low	188 Å²	188	144.3 Å²	144.3	71%	0.709	76%	0.757	S	S	*	*			trans	81.6	113.6	137.3	-80	-177.9	176.3	-167.9	0.1	116.7
928	R	27.5	Very low	28.3	Very low	206 Å²	206	148.8 Å²	148.8	78%	0.777	77%	0.765	S	S	*	*				78.9	144.4	88.7	-87.6	-170.6	179.1	-179.6	-3.1	110.8
929	S	29.7	Very low	28.4	Very low	75 Å²	75	144.4 Å²	144.4	52%	0.524	75%	0.748	S	S	.	*			cis	-177.6	154.4	-2.5	39.1	0	0	0	0	105.7
930	F	29.6	Very low	28.6	Very low	192 Å²	192	146.7 Å²	146.7	84%	0.842	75%	0.75	S	S	*	*				-172.7	164.1	61.9	-90.9	-77.3	0	0	0	111.5
931	P	35.9	Very low	28.6	Very low	108 Å²	108	144 Å²	144	70%	0.701	74%	0.742	S	S	*	*			trans	-117.3	168.2	176.3	41.7	-30.9	0	0	0	114.7
932	L	31.8	Very low	28.9	Very low	164 Å²	164	139.7 Å²	139.7	86%	0.859	73%	0.731	S	S	*	*			trans	-148.9	118.9	150.7	-71.6	179.4	0	0	0	108
933	Q	27.7	Very low	29.1	Very low	170 Å²	170	135.8 Å²	135.8	79%	0.794	72%	0.72	S	S	*	*				85.3	108.5	55.5	-112.2	-173.8	-8.4	0	0	116.5
934	S	30	Very low	29.4	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	72%	0.721	S	S	*	*			trans	155.6	139	137.3	50.5	0	0	0	0	110.7
935	T	26.6	Very low	29.4	Very low	115 Å²	115	140.9 Å²	140.9	71%	0.706	73%	0.727	S	S	*	*			cis	176.3	148.5	-35.4	21.1	0	0	0	0	106.5
936	S	29.4	Very low	29.6	Very low	111 Å²	111	139 Å²	139	78%	0.776	73%	0.73	S	S	*	*			trans	82	146.2	154.4	80.8	0	0	0	0	120.7
937	S	27.8	Very low	29.8	Very low	98 Å²	98	139.4 Å²	139.4	69%	0.685	74%	0.739	S	S	*	*			cis	-171.7	173.4	-21.8	-94.9	0	0	0	0	110.7
938	F	30.7	Very low	29.8	Very low	186 Å²	186	135 Å²	135	82%	0.816	74%	0.738	S	S	*	*			trans	99.4	69.7	159.2	-67.7	-76.7	0	0	0	120.7
939	N	28	Very low	29.8	Very low	82 Å²	82	131.1 Å²	131.1	44%	0.439	74%	0.737	S	S	.	*				23.7	140.4	104.4	-64.8	-5.2	0	0	0	120.9
940	I	30	Very low	29.7	Very low	149 Å²	149	138.2 Å²	138.2	76%	0.764	75%	0.754	S	S	*	*				178.2	105.7	116.5	-89.7	157.1	0	0	0	107.6
941	L	28.7	Very low	29.7	Very low	143 Å²	143	133.9 Å²	133.9	75%	0.749	75%	0.747	S	S	*	*				71.5	143.2	97.4	-108.2	87.6	0	0	0	114.3
942	S	30.2	Very low	29.3	Very low	86 Å²	86	137.8 Å²	137.8	60%	0.601	76%	0.756	S	S	*	*			cis	-170.3	153.6	-9.4	-152.5	0	0	0	0	109.7
943	N	31.4	Very low	29	Very low	123 Å²	123	135.5 Å²	135.5	66%	0.658	75%	0.754	S	S	*	*				164.4	133.3	98.4	-116.9	-23.8	0	0	0	115.4
944	K	33.1	Very low	28.9	Very low	168 Å²	168	133.6 Å²	133.6	73%	0.73	76%	0.758	S	S	*	*			trans	60.3	114.5	149.6	-66.8	166.9	-176.6	-172.6	0	118.7
945	Q	29.7	Very low	28.8	Very low	197 Å²	197	136 Å²	136	92%	0.921	76%	0.761	S	S	*	*			cis	67.3	128.5	39.8	-60.7	-175.4	-43.5	0	0	116.4
946	G	30.6	Very low	28.8	Very low	70 Å²	70	139.5 Å²	139.5	72%	0.722	77%	0.766	S	S	*	*			trans	175	84.2	169	0	0	0	0	0	116.5
947	L	30.8	Very low	28.6	Very low	183 Å²	183	140.5 Å²	140.5	96%	0.958	77%	0.768	S	S	*	*			trans	92.6	153	152.9	-85.8	71.8	0	0	0	122
948	S	27.6	Very low	28.6	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	77%	0.769	S	S	*	*			trans	-155.8	176.1	-155.3	60	0	0	0	0	112.4
949	T	27	Very low	28.6	Very low	124 Å²	124	139.4 Å²	139.4	76%	0.761	77%	0.767	S	S	*	*			trans	72.9	147.7	150.3	42.8	0	0	0	0	121.2
950	Y	27.9	Very low	28.5	Very low	224 Å²	224	141 Å²	141	88%	0.878	78%	0.775	S	S	*	*			trans	95.7	124.3	-176	-78.3	-94.1	0	0	0	115.4
951	S	28.9	Very low	28.6	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	78%	0.776	S	S	*	*			cis	-168	147.1	-14.1	41.9	0	0	0	0	110
952	E	27.8	Very low	28.5	Very low	190 Å²	190	140.2 Å²	140.2	89%	0.888	77%	0.774	S	S	*	*			trans	-68.7	138.1	166.7	-66.1	176.1	112.3	0	0	111.5
953	S	25.1	Very low	28.3	Very low	115 Å²	115	144.2 Å²	144.2	80%	0.804	78%	0.78	S	S	*	*			trans	-176.8	159.6	146.7	-86.4	0	0	0	0	112
954	C	26.8	Very low	28.1	Very low	130 Å²	130	143.8 Å²	143.8	88%	0.878	78%	0.778	S	S	*	*			trans	75.5	63.4	169.2	-58.4	0	0	0	0	118
955	L	27.1	Very low	27.9	Very low	165 Å²	165	145.5 Å²	145.5	86%	0.864	78%	0.781	S	S	*	*			trans	-80.7	144.5	142.9	-129.2	169.7	0	0	0	108.7
956	K	26.2	Very low	27.7	Very low	188 Å²	188	142.8 Å²	142.8	82%	0.817	77%	0.773	S	S	*	*			trans	68.5	117.3	178.9	-56.2	174.9	177.2	174.9	0	116.6
957	T	25.5	Very low	27.5	Very low	132 Å²	132	145.7 Å²	145.7	81%	0.81	77%	0.772	S	S	*	*			trans	179.3	127.2	138.8	-78.2	0	0	0	0	108.9
958	V	28.4	Very low	27.4	Very low	119 Å²	119	145.6 Å²	145.6	72%	0.721	77%	0.766	S	S	*	*			trans	53.5	104.7	158.6	172.1	0	0	0	0	115.6
959	N	29.4	Very low	27.3	Very low	142 Å²	142	145.6 Å²	145.6	76%	0.759	77%	0.766	S	S	*	*			cis	32.8	116.7	47.2	-154.8	34.3	0	0	0	116.3
960	N	26.9	Very low	27.1	Very low	116 Å²	116	144.1 Å²	144.1	62%	0.62	76%	0.76	S	S	*	*			trans	83.7	108.3	-177.1	-54.2	-25.5	0	0	0	116.6
961	N	31.6	Very low	27	Very low	145 Å²	145	142.9 Å²	142.9	78%	0.775	76%	0.759	S	S	*	*				156.7	95.3	126.3	-75.7	-19.3	0	0	0	108.1
962	N	26.9	Very low	26.9	Very low	131 Å²	131	143.3 Å²	143.3	70%	0.701	76%	0.762	S	S	*	*				54.3	119.5	90.1	-88.4	-30.6	0	0	0	114
963	K	25.3	Very low	26.9	Very low	170 Å²	170	142.6 Å²	142.6	74%	0.739	76%	0.756	S	S	*	*			trans	66.4	137.9	130.8	-66.8	-169.7	-178.3	-173	0	117.7
964	D	27.2	Very low	27	Very low	113 Å²	113	145.5 Å²	145.5	60%	0.604	76%	0.757	S	S	*	*			cis	-158.6	-171.9	7.7	-85	-37.4	0	0	0	108.3
965	Y	29.8	Very low	27	Very low	204 Å²	204	146 Å²	146	80%	0.8	75%	0.751	S	S	*	*			trans	79.8	83.2	154.8	-64.5	-67.7	0	0	0	121.5
966	D	25.6	Very low	27.1	Very low	140 Å²	140	145.4 Å²	145.4	75%	0.749	75%	0.745	S	S	*	*				30	133.5	105.8	-77.9	-21.1	0	0	0	123
967	N	25.8	Very low	27.1	Very low	132 Å²	132	144.5 Å²	144.5	71%	0.706	75%	0.75	S	S	*	*			trans	81.1	153.5	136.4	-76.9	-42.8	0	0	0	122.5
968	H	28.3	Very low	27.2	Very low	181 Å²	181	147 Å²	147	84%	0.838	75%	0.752	S	S	*	*			trans	74.5	140.7	178.2	-61.5	-76.1	0	0	0	116.6
969	S	25.2	Very low	27.2	Very low	95 Å²	95	147.2 Å²	147.2	66%	0.664	75%	0.753	S	S	*	*			cis	-167	157	-14.7	-174	0	0	0	0	110.7
970	C	24.1	Very low	27.3	Very low	94 Å²	94	147.5 Å²	147.5	64%	0.635	75%	0.754	S	S	*	*			trans	55.6	121.5	151	-90.3	0	0	0	0	122.7
971	K	25.6	Very low	27.3	Very low	198 Å²	198	150.3 Å²	150.3	86%	0.861	76%	0.763	S	S	*	*				40.7	99.4	118.2	-60.2	176.3	-178.4	173	0	117.8
972	S	27	Very low	27.1	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	75%	0.754	S	S	*	*				-177.6	113.3	120.4	-174.4	0	0	0	0	109.9
973	F	27.9	Very low	27.1	Very low	175 Å²	175	150.4 Å²	150.4	77%	0.768	76%	0.762	S	S	*	*			trans	-168.2	49.6	144.5	-127.3	-93.6	0	0	0	112.2	M976	F973-M976 HydrophobicContact CE1-CE 3.61Å; F973-M976 HydrophobicContact CZ-CE 3.99Å
974	H	26.8	Very low	27.4	Very low	176 Å²	176	152.4 Å²	152.4	82%	0.815	77%	0.771	S	S	*	*			trans	-106	72.6	171	-167.6	-47.4	0	0	0	108.8
975	N	26.9	Very low	27.3	Very low	141 Å²	141	152.9 Å²	152.9	75%	0.754	78%	0.778	S	S	*	*			trans	-178.8	91.8	164	-96.2	-14.5	0	0	0	111.6
976	M	28.1	Very low	27.1	Very low	152 Å²	152	150.2 Å²	150.2	75%	0.749	78%	0.778	S	S	*	*			trans	-154.6	35.1	153.7	-128.9	-170.8	-58.1	0	0	113.2	F973	F973-M976 HydrophobicContact CE1-CE 3.61Å; F973-M976 HydrophobicContact CZ-CE 3.99Å
977	N	27.7	Very low	27.3	Very low	169 Å²	169	153.2 Å²	153.2	90%	0.904	79%	0.787	S	S	*	*	S	Bend	trans	-105.2	11.2	178.5	-119.7	6.5	0	0	0	112.9
978	Q	27.2	Very low	27.2	Very low	185 Å²	185	157.7 Å²	157.7	86%	0.864	80%	0.796	S	S	*	*	S	Bend	trans	-156.7	58.2	-168.5	-149.6	137.5	26.7	0	0	114.8
979	T	28.2	Very low	27.5	Very low	122 Å²	122	154.1 Å²	154.1	75%	0.748	79%	0.789	S	S	*	*			trans	-141.4	143.5	165.5	-28.7	0	0	0	0	110.1
980	I	31.6	Very low	27.7	Very low	149 Å²	149	156.5 Å²	156.5	76%	0.764	79%	0.792	S	S	*	*			trans	77	68.8	178.4	-43.4	175.3	0	0	0	113.6	D982	I980-D982 WeakPolarHBondContact CG2-O 3.3Å
981	H	27.1	Very low	27.8	Very low	174 Å²	174	157.1 Å²	157.1	81%	0.806	79%	0.79	S	S	*	*			trans	-80	-20.4	163.1	173	-89.3	0	0	0	112.6
982	D	26.4	Very low	28.1	Very low	110 Å²	110	152.1 Å²	152.1	59%	0.588	78%	0.777	S	S	*	*			trans	-120	157.8	-170.7	-56.7	-58.8	0	0	0	112.4	I980	I980-D982 WeakPolarHBondContact CG2-O 3.3Å
983	L	27.4	Very low	28.1	Very low	168 Å²	168	156.2 Å²	156.2	88%	0.88	78%	0.777	S	S	*	*			trans	86.7	68.4	175.9	-50.7	170.8	0	0	0	118.3
984	K	31.8	Very low	28.5	Very low	213 Å²	213	152.2 Å²	152.2	93%	0.926	77%	0.767	S	S	*	*				-176.6	96	108.4	-101.4	175.1	178.7	177.1	0	113.1
985	T	25.7	Very low	28.8	Very low	122 Å²	122	149.7 Å²	149.7	75%	0.748	76%	0.756	S	S	*	*			trans	-73.2	168.2	157.8	44.1	0	0	0	0	111.1
986	N	25.1	Very low	29.2	Very low	149 Å²	149	148 Å²	148	80%	0.797	75%	0.746	S	S	*	*			trans	77.8	85	168.3	-52.9	-22.5	0	0	0	118.4
987	Q	28.4	Very low	29.5	Very low	202 Å²	202	144.7 Å²	144.7	94%	0.944	74%	0.738	S	S	*	*				-176.5	127.1	114.5	-100.9	171.4	-17.6	0	0	112.9
988	Y	24.6	Very low	29.7	Very low	226 Å²	226	141.5 Å²	141.5	89%	0.886	72%	0.72	S	S	*	*			trans	-84.4	173.9	162.1	-74.7	-89.2	0	0	0	109.9
989	P	34.4	Very low	30	Very low	107 Å²	107	137.3 Å²	137.3	70%	0.695	70%	0.704	S	S	*	*			cis	-132.7	-164.1	-16	26.1	-1.5	0	0	0	112.9
990	I	28.7	Very low	30.4	Very low	144 Å²	144	139.9 Å²	139.9	74%	0.738	70%	0.701	S	S	*	*			trans	130.7	121.8	144.8	-64.8	158.2	0	0	0	112.8
991	N	27.3	Very low	30.5	Very low	108 Å²	108	134.8 Å²	134.8	58%	0.578	68%	0.678	S	S	*	*			trans	-81.7	131.2	-170.7	-163.8	-25.5	0	0	0	111.5	Y993 T994	N991-Y993 PolarHBondContact O-N 2.89Å; N991-T994 PolarHBondContact O-OG1 3.32Å
992	P	31.2	Very low	30.9	Very low	93 Å²	93	130.9 Å²	130.9	60%	0.604	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-15	-171.9	-27.6	35	0	0	0	117.2	T994	P992-T994 PolarHBondContact O-N 3.49Å
993	Y	28	Very low	31.2	Very low	196 Å²	196	131.1 Å²	131.1	77%	0.769	66%	0.664	S	S	*	*	H	α-helix	trans	-71.6	-23.4	-173.4	-79.7	-89.5	0	0	0	115.1	N991	N991-Y993 PolarHBondContact O-N 2.89Å
994	T	36.4	Very low	31.4	Very low	91 Å²	91	126.4 Å²	126.4	56%	0.558	65%	0.645	S	S	*	*	H	α-helix	trans	-83	-29.6	-179	17.5	0	0	0	0	114.1	N991 P992 S997	N991-T994 PolarHBondContact O-OG1 3.32Å; P992-T994 PolarHBondContact O-N 3.49Å; T994-S997 PolarHBondContact O-N 2.98Å
995	Q	32.8	Very low	31.6	Very low	123 Å²	123	123.2 Å²	123.2	58%	0.575	63%	0.631	S	S	*	*	H	α-helix	trans	-65.6	-39	177.6	-89.2	-78.3	-1.9	0	0	112.7	S997 L998 N999	Q995-S997 VanDerWaalsContact C-N 3.32Å; Q995-S997 PolarHBondContact O-N 3.32Å; Q995-L998 PolarHBondContact O-N 3.02Å; Q995-N999 PolarHBondContact O-N 3Å; Q995-N999 PolarHBondContact O-ND2 3.42Å
996	I	34.7	Very low	31.9	Very low	105 Å²	105	121 Å²	121	54%	0.538	62%	0.621	S	S	.	*	H	α-helix	trans	-67.7	-34.3	-178.6	-61.3	173.6	0	0	0	111.4	Y1000	I996-Y1000 HydrophobicContact CG2-CD2 4.26Å; I996-Y1000 HydrophobicContact CG2-CE2 4.44Å; I996-Y1000 PolarHBondContact O-N 3.18Å
997	S	33.9	Very low	32.3	Very low	83 Å²	83	121.5 Å²	121.5	58%	0.58	62%	0.62	S	S	*	*	H	α-helix	trans	-62.4	-46.2	176	168.4	0	0	0	0	112.6	T994 Q995 S1001	T994-S997 PolarHBondContact O-N 2.98Å; Q995-S997 VanDerWaalsContact C-N 3.32Å; Q995-S997 PolarHBondContact O-N 3.32Å; S997-S1001 PolarHBondContact O-N 3.48Å
998	L	33.7	Very low	32.5	Very low	102 Å²	102	118.7 Å²	118.7	53%	0.534	61%	0.611	S	S	.	*	H	α-helix	trans	-67.1	-41.5	-179.2	-80.8	158.9	0	0	0	112.4	Q995 Y1000 S1001 N1002	Q995-L998 PolarHBondContact O-N 3.02Å; L998-Y1000 PolarHBondContact O-N 3.01Å; L998-S1001 PolarHBondContact O-N 3.43Å; L998-S1001 VanDerWaalsContact O-N 3.15Å; L998-S1001 PolarHBondContact O-OG 3.44Å; L998-N1002 PolarHBondContact O-N 2.94Å; L998-N1002 VanDerWaalsContact O-N 3.14Å
999	N	33.8	Very low	32.6	Very low	97 Å²	97	112 Å²	112	52%	0.519	60%	0.598	S	S	.	*	H	α-helix	trans	-66.6	-35.8	-179.7	-75.3	-30.8	0	0	0	113.4	Q995 S1001 N1002 L1003	Q995-N999 PolarHBondContact O-N 3Å; Q995-N999 PolarHBondContact O-ND2 3.42Å; N999-S1001 VanDerWaalsContact C-N 3.34Å; N999-S1001 PolarHBondContact O-N 3.3Å; N999-N1002 PolarHBondContact O-N 3.31Å; N999-L1003 PolarHBondContact O-N 2.96Å; N999-L1003 VanDerWaalsContact O-N 3.13Å
1000	Y	34.5	Very low	32.4	Very low	176 Å²	176	114.1 Å²	114.1	69%	0.69	60%	0.602	S	S	*	*	H	α-helix	trans	-66.3	-34.6	171.9	-96.4	-86	0	0	0	112.9	I996 L998 S1004	I996-Y1000 HydrophobicContact CG2-CD2 4.26Å; I996-Y1000 HydrophobicContact CG2-CE2 4.44Å; I996-Y1000 PolarHBondContact O-N 3.18Å; L998-Y1000 PolarHBondContact O-N 3.01Å; Y1000-S1004 PolarHBondContact O-N 3.21Å
1001	S	34.3	Very low	32.3	Very low	42 Å²	42	113.4 Å²	113.4	29%	0.294	60%	0.604	S	S	.	*	H	α-helix	trans	-66.5	-39.4	176.8	83.2	0	0	0	0	112.3	S997 L998 N999 S1004 K1005	S997-S1001 PolarHBondContact O-N 3.48Å; L998-S1001 PolarHBondContact O-N 3.43Å; L998-S1001 VanDerWaalsContact O-N 3.15Å; L998-S1001 PolarHBondContact O-OG 3.44Å; N999-S1001 VanDerWaalsContact C-N 3.34Å; N999-S1001 PolarHBondContact O-N 3.3Å; S1001-S1004 PolarHBondContact O-OG 3.31Å; S1001-K1005 PolarHBondContact O-N 3.31Å
1002	N	36.2	Very low	32.4	Very low	91 Å²	91	115.6 Å²	115.6	49%	0.487	61%	0.614	S	S	.	*	H	α-helix	trans	-74	-37.7	-179.4	-71.2	-23.8	0	0	0	112.7	L998 N999 S1004 K1005 S1006	L998-N1002 PolarHBondContact O-N 2.94Å; L998-N1002 VanDerWaalsContact O-N 3.14Å; N999-N1002 PolarHBondContact O-N 3.31Å; N1002-S1004 VanDerWaalsContact C-N 3.32Å; N1002-S1004 PolarHBondContact O-N 3.15Å; N1002-K1005 PolarHBondContact O-N 3.5Å; N1002-S1006 PolarHBondContact O-N 3.47Å; N1002-S1006 VanDerWaalsContact O-N 3.08Å
1003	L	31.9	Very low	32.3	Very low	116 Å²	116	116.8 Å²	116.8	61%	0.607	62%	0.622	S	S	*	*	H	α-helix	trans	-65.1	-36	177.1	-150.1	75.4	0	0	0	112.1	N999 K1005 S1006 M1007	N999-L1003 PolarHBondContact O-N 2.96Å; N999-L1003 VanDerWaalsContact O-N 3.13Å; L1003-K1005 VanDerWaalsContact C-N 3.35Å; L1003-S1006 PolarHBondContact O-N 3.37Å; L1003-M1007 PolarHBondContact O-N 3.08Å
1004	S	32.8	Very low	32.1	Very low	68 Å²	68	114.9 Å²	114.9	48%	0.476	63%	0.625	S	S	.	*	H	α-helix	trans	-71.7	-24.3	175.7	76.2	0	0	0	0	114.3	Y1000 S1001 N1002 N1008	Y1000-S1004 PolarHBondContact O-N 3.21Å; S1001-S1004 PolarHBondContact O-OG 3.31Å; N1002-S1004 VanDerWaalsContact C-N 3.32Å; N1002-S1004 PolarHBondContact O-N 3.15Å; S1004-N1008 PolarHBondContact O-ND2 3.14Å
1005	K	34.5	Very low	31.8	Very low	147 Å²	147	122.1 Å²	122.1	64%	0.639	64%	0.642	S	S	*	*	H	α-helix	trans	-78.9	-37.1	173.6	-73.4	175.8	178.6	175.5	0	111.8	S1001 N1002 L1003 N1008	S1001-K1005 PolarHBondContact O-N 3.31Å; N1002-K1005 PolarHBondContact O-N 3.5Å; L1003-K1005 VanDerWaalsContact C-N 3.35Å; K1005-N1008 PolarHBondContact O-N 3.32Å
1006	S	32.8	Very low	31.4	Very low	75 Å²	75	126.5 Å²	126.5	52%	0.524	66%	0.655	S	S	.	*	H	α-helix	trans	-65.5	-36.6	178	178.2	0	0	0	0	113.7	N1002 L1003 N1008 S1009	N1002-S1006 PolarHBondContact O-N 3.47Å; N1002-S1006 VanDerWaalsContact O-N 3.08Å; L1003-S1006 PolarHBondContact O-N 3.37Å; S1006-N1008 PolarHBondContact O-N 2.73Å; S1006-S1009 PolarHBondContact O-OG 3.13Å
1007	M	32.9	Very low	31.2	Very low	160 Å²	160	127.1 Å²	127.1	79%	0.788	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-5.7	179.3	-71.1	-173.4	71.3	0	0	115	L1003	L1003-M1007 PolarHBondContact O-N 3.08Å
1008	N	32.2	Very low	30.8	Very low	142 Å²	142	128 Å²	128	76%	0.759	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	6.3	-179.4	-75.6	-41.9	0	0	0	113.8	S1004 K1005 S1006	S1004-N1008 PolarHBondContact O-ND2 3.14Å; K1005-N1008 PolarHBondContact O-N 3.32Å; S1006-N1008 PolarHBondContact O-N 2.73Å
1009	S	28.1	Very low	30.4	Very low	86 Å²	86	128.2 Å²	128.2	60%	0.601	69%	0.685	S	S	*	*			trans	-128.2	50.1	-172.1	66.1	0	0	0	0	114.6	S1006	S1006-S1009 PolarHBondContact O-OG 3.13Å
1010	I	29	Very low	30.1	Very low	151 Å²	151	131.8 Å²	131.8	77%	0.774	70%	0.703	S	S	*	*			trans	-133.5	107.1	167.4	-57.6	-177.6	0	0	0	109.9
1011	T	27.6	Very low	29.7	Very low	129 Å²	129	132 Å²	132	79%	0.791	71%	0.708	S	S	*	*			trans	-130.5	96.8	-170.1	-54.3	0	0	0	0	111
1012	I	28.9	Very low	29.2	Very low	155 Å²	155	136.2 Å²	136.2	80%	0.795	73%	0.732	S	S	*	*			trans	-151.5	156.3	170.7	2.2	177.8	0	0	0	110.8
1013	P	28.6	Very low	28.5	Very low	117 Å²	117	136.7 Å²	136.7	76%	0.76	74%	0.741	S	S	*	*				-123.3	163.2	-96.3	38.3	-24.9	0	0	0	115
1014	N	24.6	Very low	28.1	Very low	157 Å²	157	138 Å²	138	84%	0.84	75%	0.748	S	S	*	*			trans	-71.1	141.7	168.7	-83.2	-38.4	0	0	0	111.7
1015	R	29.2	Very low	27.8	Very low	243 Å²	243	140.6 Å²	140.6	92%	0.917	75%	0.753	S	S	*	*			trans	-139.8	130.7	150.3	-159.6	173.4	-84.2	-152.3	-1.4	110.8
1016	Y	26.3	Very low	27.3	Very low	215 Å²	215	142.2 Å²	142.2	84%	0.843	76%	0.755	S	S	*	*			trans	-63.8	159.3	172.4	-74.6	-105.5	0	0	0	109.5
1017	S	28.8	Very low	27.1	Very low	117 Å²	117	147 Å²	147	82%	0.818	77%	0.768	S	S	*	*				-168	172.3	67.2	-167.4	0	0	0	0	113.7
1018	S	26	Very low	26.8	Very low	103 Å²	103	145.8 Å²	145.8	72%	0.72	76%	0.761	S	S	*	*			trans	-81.9	154.8	-170.2	48	0	0	0	0	116.6
1019	S	25.9	Very low	26.5	Very low	106 Å²	106	147.3 Å²	147.3	74%	0.741	76%	0.764	S	S	*	*			trans	65.5	110.6	139.7	-176.1	0	0	0	0	120.1
1020	L	28	Very low	26.5	Very low	171 Å²	171	150 Å²	150	90%	0.895	77%	0.77	S	S	*	*				-155.8	160	117	-111.4	161.3	0	0	0	112
1021	K	24.5	Very low	26.4	Very low	181 Å²	181	149.2 Å²	149.2	79%	0.787	77%	0.767	S	S	*	*			trans	-95.5	168.2	-178.6	-70.7	172.6	176.5	169.2	0	110.9
1022	T	23.8	Very low	26.3	Very low	130 Å²	130	148 Å²	148	80%	0.798	76%	0.759	S	S	*	*			trans	85.2	146.1	148.3	2.5	0	0	0	0	119
1023	C	23	Very low	26.1	Very low	102 Å²	102	146.8 Å²	146.8	69%	0.689	76%	0.762	S	S	*	*			trans	69.5	112.3	170.8	-67.1	0	0	0	0	116.9
1024	L	23.7	Very low	26.1	Very low	144 Å²	144	147.1 Å²	147.1	75%	0.754	76%	0.757	S	S	*	*				83.9	142.6	93.5	-71.7	171.8	0	0	0	110.7
1025	Q	25.9	Very low	26.1	Very low	122 Å²	122	144.2 Å²	144.2	57%	0.57	74%	0.741	S	S	*	*			cis	-177.3	139.7	-10.3	166.1	166.8	-103.7	0	0	108.8
1026	R	22.7	Very low	26.1	Very low	181 Å²	181	143 Å²	143	68%	0.683	74%	0.738	S	S	*	*			trans	58.9	138.2	171.4	-65.2	168.7	-137.1	164.9	3.4	114.4
1027	Q	28.9	Very low	26.2	Very low	174 Å²	174	135.9 Å²	135.9	81%	0.813	73%	0.73	S	S	*	*				-139.9	147	54	-82.3	160.8	-56.3	0	0	109.6
1028	E	27	Very low	26.1	Very low	135 Å²	135	135.1 Å²	135.1	63%	0.631	71%	0.712	S	S	*	*				66.4	124.3	60	-70	157.5	172.8	0	0	110.3
1029	E	25.5	Very low	26.4	Very low	174 Å²	174	136.5 Å²	136.5	81%	0.813	71%	0.71	S	S	*	*			cis	-136.3	172.8	-1.7	-77.6	138.8	146	0	0	108.2
1030	I	28.4	Very low	26.7	Very low	142 Å²	142	138.7 Å²	138.7	73%	0.728	71%	0.712	S	S	*	*				-177.9	131.8	73.8	-82.8	-178	0	0	0	109
1031	N	26.4	Very low	26.8	Very low	136 Å²	136	135.7 Å²	135.7	73%	0.727	69%	0.693	S	S	*	*			trans	55.8	120.1	148.7	-58.3	-10.4	0	0	0	125.3
1032	T	27.2	Very low	27.1	Very low	102 Å²	102	133.6 Å²	133.6	63%	0.626	69%	0.686	S	S	*	*			trans	69.8	144	131	59.9	0	0	0	0	123.3	L1034	T1032-L1034 PolarHBondContact O-N 3.44Å
1033	P	24.1	Very low	27.6	Very low	130 Å²	130	135 Å²	135	84%	0.844	68%	0.684	S	S	*	*			trans	-84.5	97.3	165.7	34	-29.5	0	0	0	110
1034	L	27.7	Very low	28.1	Very low	124 Å²	124	137 Å²	137	65%	0.649	68%	0.683	S	S	*	*			trans	-92.3	112.3	176.2	-84.8	162.6	0	0	0	112.5	W312 T1032	W312-L1034 HydrophobicContact CH2-CD2 4.48Å; T1032-L1034 PolarHBondContact O-N 3.44Å
1035	D	25.4	Very low	28.5	Very low	96 Å²	96	136 Å²	136	51%	0.513	67%	0.674	S	S	.	*			trans	-3.8	131	146.2	-157.3	26.6	0	0	0	117.4	W312	W312-D1035 HydrophobicContact CZ2-CB 4.13Å; W312-D1035 PolarHBondContact NE1-OD2 2.88Å
1036	Y	28.5	Very low	28.9	Very low	218 Å²	218	137.9 Å²	137.9	86%	0.855	68%	0.676	S	S	*	*			trans	-110.3	53	177	-116.7	-81.1	0	0	0	112.7	F1038	Y1036-F1038 VanDerWaalsContact C-N 3.29Å; Y1036-F1038 HydrophobicContact CD1-CB 4.39Å; Y1036-F1038 HydrophobicContact CE1-CB 4.47Å; Y1036-F1038 PolarHBondContact O-N 3.48Å
1037	G	28.2	Very low	29.4	Very low	65 Å²	65	137 Å²	137	67%	0.67	68%	0.677	S	S	*	*			trans	-88.6	48.1	162.1	0	0	0	0	0	112.7
1038	F	28.1	Very low	29.5	Very low	101 Å²	101	133.3 Å²	133.3	44%	0.443	67%	0.67	S	S	.	*			trans	-119.7	80.9	-166.9	-135.8	-91.6	0	0	0	112.8	Y1036 E1041	Y1036-F1038 VanDerWaalsContact C-N 3.29Å; Y1036-F1038 HydrophobicContact CD1-CB 4.39Å; Y1036-F1038 HydrophobicContact CE1-CB 4.47Å; Y1036-F1038 PolarHBondContact O-N 3.48Å; F1038-E1041 HydrophobicContact CE1-CB 3.78Å; F1038-E1041 HydrophobicContact CE2-CB 4.37Å; F1038-E1041 WeakPolarHBondContact CE2-OE2 3.37Å; F1038-E1041 HydrophobicContact CZ-CB 3.67Å; F1038-E1041 HydrophobicContact CZ-CG 4.47Å; F1038-E1041 WeakPolarHBondContact CZ-OE2 3.49Å
1039	I	31.5	Very low	29.6	Very low	132 Å²	132	133.6 Å²	133.6	68%	0.677	68%	0.675	S	S	*	*	S	Bend	trans	-135.4	8	173.4	-65.6	-171.4	0	0	0	111.9
1040	I	32.6	Very low	30	Very low	153 Å²	153	131.4 Å²	131.4	79%	0.785	67%	0.668	S	S	*	*	S	Bend	trans	-123.1	-12.7	-176.4	-64.2	-179.2	0	0	0	113.7
1041	E	30.1	Very low	30.1	Very low	108 Å²	108	131.8 Å²	131.8	51%	0.505	67%	0.672	S	S	.	*	S	Bend	trans	-98.1	-7.7	-178	-76.7	174.9	130.6	0	0	115.6	F1038 E1043 Q1044 E1045	F1038-E1041 HydrophobicContact CE1-CB 3.78Å; F1038-E1041 HydrophobicContact CE2-CB 4.37Å; F1038-E1041 WeakPolarHBondContact CE2-OE2 3.37Å; F1038-E1041 HydrophobicContact CZ-CB 3.67Å; F1038-E1041 HydrophobicContact CZ-CG 4.47Å; F1038-E1041 WeakPolarHBondContact CZ-OE2 3.49Å; E1041-E1043 PolarHBondContact O-N 3.43Å; E1041-Q1044 PolarHBondContact O-N 3.3Å; E1041-E1045 PolarHBondContact O-N 3.42Å
1042	E	31.1	Very low	30.4	Very low	136 Å²	136	130.3 Å²	130.3	64%	0.636	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-1.2	-179.3	-146.4	-168.5	142.6	0	0	114.5	R1046	E1042-R1046 PolarHBondContact O-NE 3.49Å; E1042-R1046 IonicContact OE1-NH2 3.31Å; E1042-R1046 PolarHBondContact OE1-NH2 3.12Å
1043	E	33.5	Very low	30.6	Very low	161 Å²	161	132 Å²	132	75%	0.752	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-8.2	179.7	-159.8	162.9	-157.5	0	0	112.7	E1041	E1041-E1043 PolarHBondContact O-N 3.43Å
1044	Q	34	Very low	30.9	Very low	142 Å²	142	134.3 Å²	134.3	66%	0.664	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-38.9	180	-143.7	161.5	-12.4	0	0	111.9	E1041 R1046 K1047 C1048	E1041-Q1044 PolarHBondContact O-N 3.3Å; Q1044-R1046 PolarHBondContact O-N 3.48Å; Q1044-K1047 PolarHBondContact O-N 3.44Å; Q1044-C1048 PolarHBondContact O-N 3.47Å
1045	E	31.5	Very low	31	Very low	124 Å²	124	135.5 Å²	135.5	58%	0.579	69%	0.688	S	S	*	*	H	α-helix	trans	-61.6	-31.5	165.6	-76.5	-167.9	132.4	0	0	111.9	E1041 K1047 C1048 L1049	E1041-E1045 PolarHBondContact O-N 3.42Å; E1045-K1047 PolarHBondContact O-N 3.49Å; E1045-C1048 PolarHBondContact O-N 3.3Å; E1045-L1049 WeakPolarHBondContact O-CB 3.41Å; E1045-L1049 PolarHBondContact O-N 3.13Å
1046	R	33.7	Very low	31.2	Very low	162 Å²	162	136.6 Å²	136.6	61%	0.611	70%	0.699	S	S	*	*	H	α-helix	trans	-70	-9.8	175.9	-152.7	-179.4	-64.5	-126.6	-0.5	113.7	E1042 Q1044	E1042-R1046 PolarHBondContact O-NE 3.49Å; E1042-R1046 IonicContact OE1-NH2 3.31Å; E1042-R1046 PolarHBondContact OE1-NH2 3.12Å; Q1044-R1046 PolarHBondContact O-N 3.48Å
1047	K	34.2	Very low	31.2	Very low	161 Å²	161	132.3 Å²	132.3	70%	0.7	69%	0.691	S	S	*	*	H	α-helix	trans	-104.9	-16.2	170.7	-76.9	-176.5	172.9	179.6	0	113.9	Q1044 E1045	Q1044-K1047 PolarHBondContact O-N 3.44Å; E1045-K1047 PolarHBondContact O-N 3.49Å
1048	C	30.7	Very low	31.3	Very low	97 Å²	97	137 Å²	137	66%	0.655	71%	0.713	S	S	*	*	H	α-helix	trans	-94.5	-13.3	171.5	-67.6	0	0	0	0	113.8	Q1044 E1045 L1050	Q1044-C1048 PolarHBondContact O-N 3.47Å; E1045-C1048 PolarHBondContact O-N 3.3Å; C1048-L1050 VanDerWaalsContact C-N 3.3Å; C1048-L1050 PolarHBondContact O-N 2.96Å
1049	L	30.5	Very low	31.4	Very low	141 Å²	141	138.8 Å²	138.8	74%	0.738	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	7.4	174.8	-84.4	164.1	0	0	0	114.9	E1045	E1045-L1049 WeakPolarHBondContact O-CB 3.41Å; E1045-L1049 PolarHBondContact O-N 3.13Å
1050	L	32.2	Very low	31.4	Very low	129 Å²	129	139.1 Å²	139.1	68%	0.675	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-7.8	177	-91.4	158.4	0	0	0	114.3	C1048	C1048-L1050 VanDerWaalsContact C-N 3.3Å; C1048-L1050 PolarHBondContact O-N 2.96Å
1051	D	31.4	Very low	31.4	Very low	149 Å²	149	138.3 Å²	138.3	80%	0.797	73%	0.726	S	S	*	*	S	Bend	trans	-114.3	17.5	-171.2	-88.7	-32.3	0	0	0	115
1052	S	31.8	Very low	31.5	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	74%	0.739	S	S	*	*	S	Bend	trans	-139.3	18.6	-173.9	-160.3	0	0	0	0	117.7
1053	T	31.7	Very low	31.5	Very low	136 Å²	136	140.4 Å²	140.4	83%	0.834	75%	0.745	S	S	*	*			trans	-122.6	53.4	168.5	56.1	0	0	0	0	112.1
1054	H	30.7	Very low	31.4	Very low	180 Å²	180	139 Å²	139	83%	0.833	75%	0.745	S	S	*	*			trans	-122.1	62.1	174.8	-136.3	-68.3	0	0	0	111
1055	N	30.4	Very low	31.2	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	75%	0.751	S	S	*	*	S	Bend	trans	-170.9	144.5	151.6	-102.7	-34.2	0	0	0	114.5
1056	T	30.1	Very low	31.1	Very low	119 Å²	119	139.9 Å²	139.9	73%	0.73	76%	0.764	S	S	*	*			trans	58.8	89.5	157.5	58.2	0	0	0	0	120.1
1057	N	28	Very low	30.9	Very low	129 Å²	129	138.1 Å²	138.1	69%	0.69	78%	0.777	S	S	*	*				-87.7	149.7	114.9	-63.1	-22.5	0	0	0	106.2
1058	S	29.5	Very low	30.6	Very low	162 Å²	162	136 Å²	136	100%	1.133	78%	0.784	S	S	*	*			cis	26.9	0	4.9	-152.9	0	0	0	0	120.1

Retrieved 1,058 of 1,058 residues in 1200.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).