G4V8N9_SCHMA Loading...

Putative voltage-gated potassium channel

AlphaFold DB , UniProt , Accession G4V8N9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 815 aa.

						>G4V8N9_SCHMA|G4V8N9
MAEYLFSQLGTFDLITFTLEFENKEILIIRLITLILTVKMLYTTSLMKVIPQSPKNIESDKFIFSSTPEILHETNRSRDFFGLIKRRTTHEKSIYSRHPLYHHAPHCHHQQHHRRYHSHIRKECPYLCITHKPSTSKSQVTIHKSISKQLSLPVDYTDEQKSFYSSSGLLQTNSILDDDIESGLNIHDDDLHSYVSMPKCNITSERPKSYLSGSSSSLTSCLRCLNSDHTVSSHTKAIDEINYDSEPQCSHSSVISNTSKLKYFDDTDASNLFDEVQKDTLKDRLLYFPTISNQLLLTNPTRRPFNSNHNNSDEIEKYDTTSVIDAKFSLPKKELKFAVPEFLMPIIDRRTSSQIVNLKQISVSTLNIENKLLKRRKTIKERFKQLHSDYDGSKFWNKLNKNFKVSEVQNLSSTRSRSSMAISMDYTHNKDSVSRSSNTSCDDCRRITINVSGLKFETWLTVLERHPTTLLGDYNKRKPFYDEYRKEYFFDRHRPSFEAIFNYYQYGGRLKRPATVSDDIFLTELEFFQIESEALDVYKKNEGYVPDIIVLPENLIKRKLWMLFEYPETSILAFTFSMASFIFTVISIILFCIETLPVYAQTHCEPGAKPNFRDPFFIIETLCTFWFTIEIFIRFISCPSQKIFIKDIKNLIDLAAIVPYYITLFNVLITFSCEGAKNSASLAFLRVIRLIRVFKLTKHSSGLQVLVLTFKESIEGLSLFLVAFIVCILVFSSTIYYVEIDRKGSQIESIPDAFWWAVITMCTVGYGDKVPKGPLGKVVGSVCAVAGVLTLAIPVPIITENFNKFYAHKTGRGRR
					

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(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	37.4	Very low	42.1	Very low	192 Å²	192	127 Å²	127	95%	0.946	69%	0.686	S	S	*	*				0	-50.2	0	-87	-154	-72.3	0	0	113.2	E3 Y4 L5	M1-E3 PolarHBondContact O-N 3.26Å; M1-Y4 WeakPolarHBondContact O-CB 3.06Å; M1-Y4 PolarHBondContact O-N 2.91Å; M1-Y4 VanDerWaalsContact O-N 3.07Å; M1-L5 PolarHBondContact O-N 3.46Å
2	A	34.8	Very low	41.9	Very low	75 Å²	75	127.6 Å²	127.6	62%	0.62	68%	0.678	S	S	*	*	H	α-helix	trans	-54.5	-48.8	179.9	0	0	0	0	0	113.1	Y4 L5 F6	A2-Y4 VanDerWaalsContact C-N 3.31Å; A2-Y4 PolarHBondContact O-N 3.07Å; A2-L5 PolarHBondContact O-N 3.09Å; A2-F6 PolarHBondContact O-N 3.1Å
3	E	45	Very low	41.9	Very low	166 Å²	166	128.6 Å²	128.6	78%	0.776	68%	0.684	S	S	*	*	H	α-helix	trans	-62.5	-35.5	175.4	-61	161.9	129.3	0	0	112.8	M1 F6 S7	M1-E3 PolarHBondContact O-N 3.26Å; E3-F6 PolarHBondContact O-N 3.08Å; E3-S7 WeakPolarHBondContact O-CB 3.29Å; E3-S7 PolarHBondContact O-N 3.21Å
4	Y	48.5	Very low	41.8	Very low	161 Å²	161	130.3 Å²	130.3	63%	0.631	69%	0.692	S	S	*	*	H	α-helix	trans	-69.1	-36.1	178	-169.6	-96.4	0	0	0	111.8	M1 A2 S7 Q8	M1-Y4 WeakPolarHBondContact O-CB 3.06Å; M1-Y4 PolarHBondContact O-N 2.91Å; M1-Y4 VanDerWaalsContact O-N 3.07Å; A2-Y4 VanDerWaalsContact C-N 3.31Å; A2-Y4 PolarHBondContact O-N 3.07Å; Y4-S7 PolarHBondContact O-N 2.04Å; Y4-Q8 HydrophobicContact CD1-CG 4.24Å; Y4-Q8 HydrophobicContact CE1-CG 4.03Å; Y4-Q8 WeakPolarHBondContact O-CB 3.38Å; Y4-Q8 WeakPolarHBondContact O-CG 3.38Å; Y4-Q8 PolarHBondContact O-N 3.16Å; Y4-Q8 VanDerWaalsContact O-N 3.08Å
5	L	45	Very low	41.9	Very low	111 Å²	111	127.5 Å²	127.5	58%	0.581	68%	0.676	S	S	*	*	H	α-helix	trans	-70	-40.3	171.9	-81	161.1	0	0	0	111.8	M1 A2 S7 Q8 L9	M1-L5 PolarHBondContact O-N 3.46Å; A2-L5 PolarHBondContact O-N 3.09Å; L5-S7 VanDerWaalsContact C-N 3.3Å; L5-S7 PolarHBondContact O-N 3.11Å; L5-Q8 PolarHBondContact O-N 3.45Å; L5-Q8 VanDerWaalsContact O-N 3.16Å; L5-L9 WeakPolarHBondContact O-CG 3.3Å; L5-L9 PolarHBondContact O-N 2.97Å; L5-L9 VanDerWaalsContact O-N 3.14Å
6	F	46.9	Very low	42	Very low	173 Å²	173	125.6 Å²	125.6	76%	0.759	67%	0.671	S	S	*	*	H	α-helix	trans	-59.5	-40.4	171	-108.7	-90.6	0	0	0	112.1	A2 E3 Q8	A2-F6 PolarHBondContact O-N 3.1Å; E3-F6 PolarHBondContact O-N 3.08Å; F6-Q8 VanDerWaalsContact C-N 3.3Å; F6-Q8 PolarHBondContact O-N 3.21Å
7	S	44.8	Very low	41.8	Very low	91 Å²	91	129.6 Å²	129.6	64%	0.636	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-12.5	176.7	-174.7	0	0	0	0	114.5	E3 Y4 L5	E3-S7 WeakPolarHBondContact O-CB 3.29Å; E3-S7 PolarHBondContact O-N 3.21Å; Y4-S7 PolarHBondContact O-N 2.04Å; L5-S7 VanDerWaalsContact C-N 3.3Å; L5-S7 PolarHBondContact O-N 3.11Å
8	Q	44.1	Very low	41.8	Very low	128 Å²	128	126.3 Å²	126.3	60%	0.598	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-11.4	177.7	-74	-75	-53.7	0	0	112.8	Y4 L5 F6 G10	Y4-Q8 HydrophobicContact CD1-CG 4.24Å; Y4-Q8 HydrophobicContact CE1-CG 4.03Å; Y4-Q8 WeakPolarHBondContact O-CB 3.38Å; Y4-Q8 WeakPolarHBondContact O-CG 3.38Å; Y4-Q8 PolarHBondContact O-N 3.16Å; Y4-Q8 VanDerWaalsContact O-N 3.08Å; L5-Q8 PolarHBondContact O-N 3.45Å; L5-Q8 VanDerWaalsContact O-N 3.16Å; F6-Q8 VanDerWaalsContact C-N 3.3Å; F6-Q8 PolarHBondContact O-N 3.21Å; Q8-G10 PolarHBondContact O-N 3.01Å
9	L	39.7	Very low	41.8	Very low	118 Å²	118	126.6 Å²	126.6	62%	0.618	67%	0.669	S	S	*	*			trans	-78.7	34.2	170.5	-76.1	163.1	0	0	0	112.6	L5 T11	L5-L9 WeakPolarHBondContact O-CG 3.3Å; L5-L9 PolarHBondContact O-N 2.97Å; L5-L9 VanDerWaalsContact O-N 3.14Å; L9-T11 PolarHBondContact O-N 3.13Å
10	G	35.8	Very low	41.9	Very low	64 Å²	64	129.5 Å²	129.5	66%	0.66	68%	0.678	S	S	*	*			trans	-76.3	25.8	-176.3	0	0	0	0	0	115.5	Q8 F12	Q8-G10 PolarHBondContact O-N 3.01Å; G10-F12 PolarHBondContact O-N 2.93Å
11	T	41.6	Very low	42.2	Very low	118 Å²	118	131.3 Å²	131.3	72%	0.724	68%	0.681	S	S	*	*			trans	-98.8	68	178	50.5	0	0	0	0	110.2	L9	L9-T11 PolarHBondContact O-N 3.13Å
12	F	39.4	Very low	42.9	Very low	134 Å²	134	131.5 Å²	131.5	59%	0.588	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-0.8	-165.8	-129.2	-89	0	0	0	115.2	G10 L14 I15	G10-F12 PolarHBondContact O-N 2.93Å; F12-L14 VanDerWaalsContact C-N 3.35Å; F12-L14 PolarHBondContact O-N 3.47Å; F12-I15 HydrophobicContact CD1-CB 4.38Å; F12-I15 HydrophobicContact CD1-CD1 4.18Å; F12-I15 HydrophobicContact CE1-CB 4.37Å; F12-I15 HydrophobicContact CE1-CD1 3.83Å; F12-I15 HydrophobicContact CE1-CG2 4.36Å; F12-I15 HydrophobicContact CE2-CD1 4.41Å; F12-I15 HydrophobicContact CZ-CD1 3.96Å; F12-I15 PolarHBondContact O-N 3.27Å
13	D	41.7	Very low	43.9	Very low	141 Å²	141	133 Å²	133	75%	0.754	68%	0.677	S	S	*	*	H	α-helix	trans	-73.4	-19.1	-171.2	-59	-54.2	0	0	0	114.9
14	L	40.5	Very low	44.5	Very low	152 Å²	152	133.6 Å²	133.6	80%	0.796	68%	0.677	S	S	*	*	H	α-helix	trans	-81.2	-15	179.7	-148.4	78.5	0	0	0	113.6	F12	F12-L14 VanDerWaalsContact C-N 3.35Å; F12-L14 PolarHBondContact O-N 3.47Å
15	I	43.7	Very low	45	Very low	89 Å²	89	130.9 Å²	130.9	46%	0.456	67%	0.67	S	S	.	*	H	α-helix	trans	-84.9	-41.3	-178.2	-65.6	173.8	0	0	0	110.1	F12 F17 T18	F12-I15 HydrophobicContact CD1-CB 4.38Å; F12-I15 HydrophobicContact CD1-CD1 4.18Å; F12-I15 HydrophobicContact CE1-CB 4.37Å; F12-I15 HydrophobicContact CE1-CD1 3.83Å; F12-I15 HydrophobicContact CE1-CG2 4.36Å; F12-I15 HydrophobicContact CE2-CD1 4.41Å; F12-I15 HydrophobicContact CZ-CD1 3.96Å; F12-I15 PolarHBondContact O-N 3.27Å; I15-F17 VanDerWaalsContact C-N 3.26Å; I15-F17 PolarHBondContact O-N 2.82Å; I15-T18 PolarHBondContact O-N 3.19Å; I15-T18 PolarHBondContact O-OG1 3.39Å
16	T	42.8	Very low	45.9	Very low	97 Å²	97	129.3 Å²	129.3	60%	0.595	66%	0.662	S	S	*	*	H	α-helix	trans	-58.6	-34.8	-179.4	-42.2	0	0	0	0	112.7	T18	T16-T18 PolarHBondContact O-N 3.36Å; T16-T18 VanDerWaalsContact O-N 3.09Å
17	F	39.8	Very low	46.6	Very low	194 Å²	194	126.8 Å²	126.8	85%	0.851	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	13.8	-179.9	-146.4	-94.5	0	0	0	114.6	I15	I15-F17 VanDerWaalsContact C-N 3.26Å; I15-F17 PolarHBondContact O-N 2.82Å
18	T	41.5	Very low	47.7	Very low	69 Å²	69	127.5 Å²	127.5	42%	0.423	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-125.7	7.5	179.9	63.8	0	0	0	0	114.7	I15 T16	I15-T18 PolarHBondContact O-N 3.19Å; I15-T18 PolarHBondContact O-OG1 3.39Å; T16-T18 PolarHBondContact O-N 3.36Å; T16-T18 VanDerWaalsContact O-N 3.09Å
19	L	40.5	Very low	48.9	Very low	132 Å²	132	124.6 Å²	124.6	69%	0.691	64%	0.639	S	S	*	*			trans	-97	15.8	-174.7	-68.7	172	0	0	0	114.7
20	E	45.6	Very low	49.7	Very low	184 Å²	184	126.3 Å²	126.3	86%	0.86	64%	0.637	S	S	*	*			trans	-104.7	31.8	-178.2	-155.9	165.3	-136.7	0	0	112.9
21	F	46.5	Very low	51.4	Low	169 Å²	169	128 Å²	128	74%	0.741	63%	0.63	S	S	*	*			trans	-131.3	118.6	177.8	-73	-84.2	0	0	0	111.3	N23	F21-N23 PolarHBondContact O-N 3.42Å; F21-N23 VanDerWaalsContact O-N 3.1Å
22	E	52.8	Low	52.8	Low	196 Å²	196	126.6 Å²	126.6	92%	0.916	62%	0.618	S	S	*	*			trans	-66	-13	-173.9	-64.1	-177.8	105.3	0	0	115.2	K24	E22-K24 PolarHBondContact O-N 2.93Å; E22-K24 VanDerWaalsContact O-N 3.1Å
23	N	56.9	Low	54.2	Low	106 Å²	106	123.1 Å²	123.1	57%	0.567	61%	0.608	S	S	*	*			trans	-83	92.7	-167.3	-112	-37.9	0	0	0	113.5	F21 E25 I26	F21-N23 PolarHBondContact O-N 3.42Å; F21-N23 VanDerWaalsContact O-N 3.1Å; N23-E25 PolarHBondContact O-N 2.98Å; N23-E25 VanDerWaalsContact O-N 3.09Å; N23-I26 HydrophobicContact CB-CD1 3.87Å; N23-I26 HydrophobicContact CB-CG1 4.19Å; N23-I26 PolarHBondContact O-N 3.26Å; N23-I26 VanDerWaalsContact O-N 3.1Å
24	K	56.2	Low	55.7	Low	179 Å²	179	121.2 Å²	121.2	78%	0.778	60%	0.597	S	S	*	*	H	α-helix	trans	-52	-30	179.3	-67	176.3	-179	171.8	0	114.5	E22 L27	E22-K24 PolarHBondContact O-N 2.93Å; E22-K24 VanDerWaalsContact O-N 3.1Å; K24-L27 VanDerWaalsContact O-CB 3.29Å; K24-L27 WeakPolarHBondContact O-CB 3.09Å; K24-L27 PolarHBondContact O-N 3.31Å
25	E	60	Low	57.3	Low	103 Å²	103	118.7 Å²	118.7	48%	0.481	58%	0.583	S	S	.	*	H	α-helix	trans	-67.8	-36.1	-179.7	-58.3	-168.1	164.5	0	0	112.8	N23 L27 I28 I29	N23-E25 PolarHBondContact O-N 2.98Å; N23-E25 VanDerWaalsContact O-N 3.09Å; E25-L27 PolarHBondContact O-N 2.82Å; E25-I28 PolarHBondContact O-N 3.48Å; E25-I29 PolarHBondContact O-N 3.21Å
26	I	62.5	Low	58.7	Low	78 Å²	78	117.3 Å²	117.3	40%	0.4	58%	0.576	S	S	.	*	H	α-helix	trans	-64.3	-32.8	177.9	-62.7	175.2	0	0	0	110.5	N23 I28 R30	N23-I26 HydrophobicContact CB-CD1 3.87Å; N23-I26 HydrophobicContact CB-CG1 4.19Å; N23-I26 PolarHBondContact O-N 3.26Å; N23-I26 VanDerWaalsContact O-N 3.1Å; I26-I28 PolarHBondContact O-N 3.41Å; I26-R30 HydrophobicContact CG2-CG 4.31Å; I26-R30 WeakPolarHBondContact O-CB 3.37Å; I26-R30 WeakPolarHBondContact O-CG 3.35Å; I26-R30 PolarHBondContact O-N 2.78Å
27	L	62.7	Low	60	Low	120 Å²	120	115.9 Å²	115.9	63%	0.628	57%	0.568	S	S	*	*	H	α-helix	trans	-60.9	-43.2	176.4	-164.4	78.1	0	0	0	111.5	K24 E25 R30 L31	K24-L27 VanDerWaalsContact O-CB 3.29Å; K24-L27 WeakPolarHBondContact O-CB 3.09Å; K24-L27 PolarHBondContact O-N 3.31Å; E25-L27 PolarHBondContact O-N 2.82Å; L27-R30 PolarHBondContact O-N 3.46Å; L27-L31 VanDerWaalsContact O-CB 3.27Å; L27-L31 WeakPolarHBondContact O-CB 3.49Å; L27-L31 PolarHBondContact O-N 3.07Å
28	I	68.4	Low	61.5	Low	106 Å²	106	110.6 Å²	110.6	54%	0.544	55%	0.551	S	S	.	*	H	α-helix	trans	-67.1	-46.4	-178.3	-60.7	174.9	0	0	0	110.6	E25 I26 R30 L31 I32	E25-I28 PolarHBondContact O-N 3.48Å; I26-I28 PolarHBondContact O-N 3.41Å; I28-R30 VanDerWaalsContact C-N 3.34Å; I28-R30 PolarHBondContact O-N 3.12Å; I28-L31 PolarHBondContact O-N 3.08Å; I28-I32 HydrophobicContact CG2-CD1 3.92Å; I28-I32 WeakPolarHBondContact O-CG1 3.5Å; I28-I32 PolarHBondContact O-N 2.99Å
29	I	67.6	Low	62.7	Low	67 Å²	67	114.2 Å²	114.2	34%	0.344	56%	0.561	S	S	.	*	H	α-helix	trans	-62.2	-43.1	178.4	-60.5	173	0	0	0	110.5	E25 T33 L596	E25-I29 PolarHBondContact O-N 3.21Å; I29-T33 WeakPolarHBondContact O-CB 3.26Å; I29-T33 PolarHBondContact O-N 2.79Å; I29-T33 PolarHBondContact O-OG1 2.99Å; I29-L596 HydrophobicContact CD1-CD1 4.05Å
30	R	57.7	Low	63.7	Low	154 Å²	154	110.4 Å²	110.4	58%	0.581	54%	0.54	S	S	*	.	H	α-helix	trans	-66.3	-38.7	175.7	-73.9	-175.7	175.7	-165.9	-0.4	112.5	I26 L27 I28 T33 L34	I26-R30 HydrophobicContact CG2-CG 4.31Å; I26-R30 WeakPolarHBondContact O-CB 3.37Å; I26-R30 WeakPolarHBondContact O-CG 3.35Å; I26-R30 PolarHBondContact O-N 2.78Å; L27-R30 PolarHBondContact O-N 3.46Å; I28-R30 VanDerWaalsContact C-N 3.34Å; I28-R30 PolarHBondContact O-N 3.12Å; R30-T33 PolarHBondContact O-N 3.18Å; R30-L34 VanDerWaalsContact O-CB 3.31Å; R30-L34 WeakPolarHBondContact O-CB 3.27Å; R30-L34 PolarHBondContact O-N 2.85Å
31	L	71	Confident	64.7	Low	99 Å²	99	107 Å²	107	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-65.1	-45	177.1	-171.6	71.1	0	0	0	111.8	L27 I28 T33 L34 I35	L27-L31 VanDerWaalsContact O-CB 3.27Å; L27-L31 WeakPolarHBondContact O-CB 3.49Å; L27-L31 PolarHBondContact O-N 3.07Å; I28-L31 PolarHBondContact O-N 3.08Å; L31-T33 VanDerWaalsContact C-N 3.34Å; L31-T33 PolarHBondContact O-N 2.96Å; L31-L34 PolarHBondContact O-N 2.91Å; L31-I35 HydrophobicContact CG-CD1 4.06Å; L31-I35 VanDerWaalsContact O-CG1 3.28Å; L31-I35 WeakPolarHBondContact O-CG1 3.38Å; L31-I35 PolarHBondContact O-N 2.78Å
32	I	70.2	Confident	65.5	Low	90 Å²	90	106.6 Å²	106.6	46%	0.462	52%	0.522	S	S	.	.	H	α-helix	trans	-61.9	-44.1	175	-67.7	168.9	0	0	0	110.3	I28 L34 I35 L36	I28-I32 HydrophobicContact CG2-CD1 3.92Å; I28-I32 WeakPolarHBondContact O-CG1 3.5Å; I28-I32 PolarHBondContact O-N 2.99Å; I32-L34 VanDerWaalsContact C-N 3.34Å; I32-L34 PolarHBondContact O-N 3.28Å; I32-I35 PolarHBondContact O-N 3.27Å; I32-L36 HydrophobicContact CG2-CD1 3.96Å; I32-L36 HydrophobicContact CG2-CG 4.48Å; I32-L36 WeakPolarHBondContact O-CB 3.45Å; I32-L36 VanDerWaalsContact O-CG 3.31Å; I32-L36 WeakPolarHBondContact O-CG 3.39Å; I32-L36 PolarHBondContact O-N 3.45Å
33	T	70	Confident	65.7	Low	61 Å²	61	100.3 Å²	100.3	37%	0.374	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-39.8	176.8	-55.2	0	0	0	0	111.8	I29 R30 L31 L36 T37	I29-T33 WeakPolarHBondContact O-CB 3.26Å; I29-T33 PolarHBondContact O-N 2.79Å; I29-T33 PolarHBondContact O-OG1 2.99Å; R30-T33 PolarHBondContact O-N 3.18Å; L31-T33 VanDerWaalsContact C-N 3.34Å; L31-T33 PolarHBondContact O-N 2.96Å; T33-L36 PolarHBondContact O-N 3.46Å; T33-T37 WeakPolarHBondContact O-CB 3.34Å; T33-T37 WeakPolarHBondContact O-CG2 3.44Å; T33-T37 PolarHBondContact O-N 2.83Å; T33-T37 PolarHBondContact O-OG1 3.17Å
34	L	72.6	Confident	65.6	Low	101 Å²	101	97.7 Å²	97.7	53%	0.529	49%	0.485	S	S	.	.	H	α-helix	trans	-65.4	-45.5	175.6	-175.1	66.7	0	0	0	111.5	R30 L31 I32 L36 T37 V38	R30-L34 VanDerWaalsContact O-CB 3.31Å; R30-L34 WeakPolarHBondContact O-CB 3.27Å; R30-L34 PolarHBondContact O-N 2.85Å; L31-L34 PolarHBondContact O-N 2.91Å; I32-L34 VanDerWaalsContact C-N 3.34Å; I32-L34 PolarHBondContact O-N 3.28Å; L34-L36 VanDerWaalsContact C-N 3.32Å; L34-L36 PolarHBondContact O-N 3.37Å; L34-T37 WeakPolarHBondContact CA-OG1 3.48Å; L34-T37 PolarHBondContact O-N 3.1Å; L34-T37 PolarHBondContact O-OG1 2.87Å; L34-T37 VanDerWaalsContact O-OG1 3.07Å; L34-V38 HydrophobicContact CD1-CG2 4.3Å; L34-V38 HydrophobicContact CG-CG2 4.44Å; L34-V38 WeakPolarHBondContact O-CB 3.47Å; L34-V38 VanDerWaalsContact O-CG2 3.27Å; L34-V38 WeakPolarHBondContact O-CG2 3.43Å; L34-V38 PolarHBondContact O-N 3.37Å
35	I	74.3	Confident	65.5	Low	99 Å²	99	92.3 Å²	92.3	51%	0.508	47%	0.47	S	S	.	.	H	α-helix	trans	-61.1	-42	176.5	-69.4	164.6	0	0	0	110.7	L31 I32 K39	L31-I35 HydrophobicContact CG-CD1 4.06Å; L31-I35 VanDerWaalsContact O-CG1 3.28Å; L31-I35 WeakPolarHBondContact O-CG1 3.38Å; L31-I35 PolarHBondContact O-N 2.78Å; I32-I35 PolarHBondContact O-N 3.27Å; I35-K39 WeakPolarHBondContact O-CB 3.33Å; I35-K39 PolarHBondContact O-N 3.2Å
36	L	72.1	Confident	65	Low	60 Å²	60	92.1 Å²	92.1	31%	0.314	47%	0.472	S	S	.	.	H	α-helix	trans	-67.5	-42.9	177.2	-71.5	172.2	0	0	0	112.6	I32 T33 L34 K39 M40 V585 I589	I32-L36 HydrophobicContact CG2-CD1 3.96Å; I32-L36 HydrophobicContact CG2-CG 4.48Å; I32-L36 WeakPolarHBondContact O-CB 3.45Å; I32-L36 VanDerWaalsContact O-CG 3.31Å; I32-L36 WeakPolarHBondContact O-CG 3.39Å; I32-L36 PolarHBondContact O-N 3.45Å; T33-L36 PolarHBondContact O-N 3.46Å; L34-L36 VanDerWaalsContact C-N 3.32Å; L34-L36 PolarHBondContact O-N 3.37Å; L36-K39 PolarHBondContact O-N 3Å; L36-M40 WeakPolarHBondContact O-CB 3.36Å; L36-M40 WeakPolarHBondContact O-CG 3.5Å; L36-M40 PolarHBondContact O-N 3.17Å; L36-V585 HydrophobicContact CD1-CG1 4.29Å; L36-I589 HydrophobicContact CD1-CD1 4.17Å
37	T	70.2	Confident	64.1	Low	67 Å²	67	94.2 Å²	94.2	41%	0.411	48%	0.481	S	S	.	.	H	α-helix	trans	-69.8	-40.1	178.2	49.2	0	0	0	0	112.6	T33 L34 K39 M40 L41	T33-T37 WeakPolarHBondContact O-CB 3.34Å; T33-T37 WeakPolarHBondContact O-CG2 3.44Å; T33-T37 PolarHBondContact O-N 2.83Å; T33-T37 PolarHBondContact O-OG1 3.17Å; L34-T37 WeakPolarHBondContact CA-OG1 3.48Å; L34-T37 PolarHBondContact O-N 3.1Å; L34-T37 PolarHBondContact O-OG1 2.87Å; L34-T37 VanDerWaalsContact O-OG1 3.07Å; T37-K39 VanDerWaalsContact C-N 3.34Å; T37-K39 PolarHBondContact O-N 3.46Å; T37-M40 WeakPolarHBondContact O-CB 3.44Å; T37-M40 PolarHBondContact O-N 2.63Å; T37-L41 WeakPolarHBondContact O-CB 3.27Å; T37-L41 WeakPolarHBondContact O-CG 3.31Å; T37-L41 PolarHBondContact O-N 3.48Å
38	V	71.4	Confident	63.2	Low	83 Å²	83	97.3 Å²	97.3	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-43.7	171.1	169.9	0	0	0	0	110.7	L34 M40 L41 Y42	L34-V38 HydrophobicContact CD1-CG2 4.3Å; L34-V38 HydrophobicContact CG-CG2 4.44Å; L34-V38 WeakPolarHBondContact O-CB 3.47Å; L34-V38 VanDerWaalsContact O-CG2 3.27Å; L34-V38 WeakPolarHBondContact O-CG2 3.43Å; L34-V38 PolarHBondContact O-N 3.37Å; V38-M40 PolarHBondContact O-N 3.17Å; V38-L41 PolarHBondContact O-N 3.38Å; V38-Y42 VanDerWaalsContact O-CB 3.3Å; V38-Y42 WeakPolarHBondContact O-CB 3.26Å; V38-Y42 PolarHBondContact O-N 3.07Å
39	K	67.5	Low	61.8	Low	144 Å²	144	96.8 Å²	96.8	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-65.9	-36.1	177.3	-163.4	170.2	-173.9	174.7	0	112.4	I35 L36 T37 T43	I35-K39 WeakPolarHBondContact O-CB 3.33Å; I35-K39 PolarHBondContact O-N 3.2Å; L36-K39 PolarHBondContact O-N 3Å; T37-K39 VanDerWaalsContact C-N 3.34Å; T37-K39 PolarHBondContact O-N 3.46Å; K39-T43 WeakPolarHBondContact O-CG2 3.31Å; K39-T43 PolarHBondContact O-N 3.37Å; K39-T43 PolarHBondContact O-OG1 3.11Å
40	M	61.8	Low	60.5	Low	52 Å²	52	98.8 Å²	98.8	26%	0.256	50%	0.502	S	S	.	.	H	α-helix	trans	-65.6	-45.4	172.2	-85.1	-72.2	-82.3	0	0	113.1	L36 T37 V38 Y42 T43 T44 M578 F581 I582	L36-M40 WeakPolarHBondContact O-CB 3.36Å; L36-M40 WeakPolarHBondContact O-CG 3.5Å; L36-M40 PolarHBondContact O-N 3.17Å; T37-M40 WeakPolarHBondContact O-CB 3.44Å; T37-M40 PolarHBondContact O-N 2.63Å; V38-M40 PolarHBondContact O-N 3.17Å; M40-Y42 VanDerWaalsContact C-N 3.31Å; M40-Y42 PolarHBondContact O-N 3.06Å; M40-T43 PolarHBondContact O-N 3.22Å; M40-T43 PolarHBondContact O-OG1 3.45Å; M40-T43 VanDerWaalsContact O-OG1 3.12Å; M40-T44 WeakPolarHBondContact O-CB 3.42Å; M40-T44 PolarHBondContact O-N 2.81Å; M40-T44 PolarHBondContact O-OG1 2.83Å; M40-M578 HydrophobicContact CE-SD 4.04Å; M40-F581 HydrophobicContact CE-CD1 4.25Å; M40-F581 HydrophobicContact CE-CE1 4.12Å; M40-F581 HydrophobicContact CG-CE1 4.33Å; M40-F581 HydrophobicContact SD-CD1 3.93Å; M40-F581 HydrophobicContact SD-CE1 3.29Å; M40-F581 WeakPolarHBondContact SD-CE1 3.17Å; M40-F581 HydrophobicContact SD-CZ 4Å; M40-I582 HydrophobicContact CE-CG1 4.27Å
41	L	66.3	Low	59.5	Low	114 Å²	114	96.5 Å²	96.5	60%	0.597	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-39.4	175.6	-73.1	166.8	0	0	0	110.8	T37 V38 T44 S45	T37-L41 WeakPolarHBondContact O-CB 3.27Å; T37-L41 WeakPolarHBondContact O-CG 3.31Å; T37-L41 PolarHBondContact O-N 3.48Å; V38-L41 PolarHBondContact O-N 3.38Å; L41-T44 PolarHBondContact O-OG1 3.36Å; L41-S45 WeakPolarHBondContact O-CB 3.19Å; L41-S45 PolarHBondContact O-N 3.24Å; L41-S45 PolarHBondContact O-OG 3.21Å
42	Y	63.3	Low	57.7	Low	159 Å²	159	100.1 Å²	100.1	62%	0.624	52%	0.521	S	S	*	.	H	α-helix	trans	-67.6	-42.7	177.6	-164.5	-111.1	0	0	0	112.5	V38 M40 S45 L46	V38-Y42 VanDerWaalsContact O-CB 3.3Å; V38-Y42 WeakPolarHBondContact O-CB 3.26Å; V38-Y42 PolarHBondContact O-N 3.07Å; M40-Y42 VanDerWaalsContact C-N 3.31Å; M40-Y42 PolarHBondContact O-N 3.06Å; Y42-S45 PolarHBondContact O-N 2.74Å; Y42-L46 HydrophobicContact CD1-CD1 3.71Å; Y42-L46 HydrophobicContact CE1-CD1 3.4Å; Y42-L46 HydrophobicContact CE1-CG 4.44Å; Y42-L46 HydrophobicContact CG-CD1 4.45Å; Y42-L46 WeakPolarHBondContact O-CB 3.38Å; Y42-L46 PolarHBondContact O-N 3.17Å
43	T	56.2	Low	56	Low	65 Å²	65	100.6 Å²	100.6	40%	0.399	53%	0.532	S	S	.	.	H	α-helix	trans	-71	-41.8	177.2	51	0	0	0	0	113	K39 M40 S45 L46 M47	K39-T43 WeakPolarHBondContact O-CG2 3.31Å; K39-T43 PolarHBondContact O-N 3.37Å; K39-T43 PolarHBondContact O-OG1 3.11Å; M40-T43 PolarHBondContact O-N 3.22Å; M40-T43 PolarHBondContact O-OG1 3.45Å; M40-T43 VanDerWaalsContact O-OG1 3.12Å; T43-S45 VanDerWaalsContact C-N 3.3Å; T43-S45 PolarHBondContact O-N 3.01Å; T43-L46 PolarHBondContact O-N 2.72Å; T43-M47 PolarHBondContact O-N 3.39Å
44	T	55.9	Low	54.5	Low	51 Å²	51	102.9 Å²	102.9	31%	0.313	55%	0.548	S	S	.	.	H	α-helix	trans	-68	-28.8	174.5	50	0	0	0	0	113	M40 L41 M578	M40-T44 WeakPolarHBondContact O-CB 3.42Å; M40-T44 PolarHBondContact O-N 2.81Å; M40-T44 PolarHBondContact O-OG1 2.83Å; L41-T44 PolarHBondContact O-OG1 3.36Å; T44-M578 HydrophobicContact CG2-CE 4.05Å
45	S	53.4	Low	52.7	Low	66 Å²	66	107.2 Å²	107.2	46%	0.462	56%	0.562	S	S	.	*	H	α-helix	trans	-70.5	-48.4	169.9	-61.2	0	0	0	0	111.4	L41 Y42 T43 M47 K48 V49	L41-S45 WeakPolarHBondContact O-CB 3.19Å; L41-S45 PolarHBondContact O-N 3.24Å; L41-S45 PolarHBondContact O-OG 3.21Å; Y42-S45 PolarHBondContact O-N 2.74Å; T43-S45 VanDerWaalsContact C-N 3.3Å; T43-S45 PolarHBondContact O-N 3.01Å; S45-M47 PolarHBondContact O-N 3.4Å; S45-K48 CarbonylContact O-C 3.56Å; S45-K48 WeakPolarHBondContact O-CA 3.45Å; S45-K48 PolarHBondContact O-N 2.96Å; S45-V49 WeakPolarHBondContact O-CG2 3.25Å; S45-V49 PolarHBondContact O-N 3.37Å
46	L	49.4	Very low	50.7	Low	98 Å²	98	108.8 Å²	108.8	51%	0.513	57%	0.572	S	S	.	*	H	α-helix	trans	-60.1	-40.6	178.5	-88	166.4	0	0	0	113	Y42 T43 K48 V49	Y42-L46 HydrophobicContact CD1-CD1 3.71Å; Y42-L46 HydrophobicContact CE1-CD1 3.4Å; Y42-L46 HydrophobicContact CE1-CG 4.44Å; Y42-L46 HydrophobicContact CG-CD1 4.45Å; Y42-L46 WeakPolarHBondContact O-CB 3.38Å; Y42-L46 PolarHBondContact O-N 3.17Å; T43-L46 PolarHBondContact O-N 2.72Å; L46-K48 PolarHBondContact O-N 3Å; L46-V49 PolarHBondContact O-N 2.85Å
47	M	44.4	Very low	48.9	Very low	123 Å²	123	113.8 Å²	113.8	61%	0.606	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-10.4	174.1	-77.4	-172.7	123.7	0	0	114.2	T43 S45 F574	T43-M47 PolarHBondContact O-N 3.39Å; S45-M47 PolarHBondContact O-N 3.4Å; M47-F574 HydrophobicContact SD-CE2 4.26Å
48	K	43.9	Very low	47.1	Very low	184 Å²	184	119.3 Å²	119.3	80%	0.8	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-7.2	172.3	-75.6	-175.8	174	-179.2	0	114.1	S45 L46 I50	S45-K48 CarbonylContact O-C 3.56Å; S45-K48 WeakPolarHBondContact O-CA 3.45Å; S45-K48 PolarHBondContact O-N 2.96Å; L46-K48 PolarHBondContact O-N 3Å; K48-I50 PolarHBondContact O-N 3.39Å
49	V	39.2	Very low	45.2	Very low	95 Å²	95	121.4 Å²	121.4	58%	0.576	64%	0.637	S	S	*	*			trans	-87.1	88.8	173.4	177	0	0	0	0	109.4	S45 L46	S45-V49 WeakPolarHBondContact O-CG2 3.25Å; S45-V49 PolarHBondContact O-N 3.37Å; L46-V49 PolarHBondContact O-N 2.85Å
50	I	39.6	Very low	43.4	Very low	110 Å²	110	120.8 Å²	120.8	56%	0.564	64%	0.641	S	S	*	*			trans	-44.5	134.1	155.3	-62	169.2	0	0	0	107.7	K48 Q52	K48-I50 PolarHBondContact O-N 3.39Å; I50-Q52 PolarHBondContact O-N 3.15Å
51	P	37.1	Very low	41.9	Very low	105 Å²	105	125.9 Å²	125.9	68%	0.682	66%	0.661	S	S	*	*			trans	-66.5	93.4	-172.4	26.9	-35.8	0	0	0	111.2	S53	P51-S53 PolarHBondContact O-N 2.79Å
52	Q	33.8	Very low	40.2	Very low	176 Å²	176	130.9 Å²	130.9	82%	0.822	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-56.2	129.9	170.1	-69.2	-165.6	1	0	0	108.7	I50	I50-Q52 PolarHBondContact O-N 3.15Å
53	S	32.8	Very low	38.7	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-57.6	132.7	-179.8	48	0	0	0	0	110.1	P51 K55	P51-S53 PolarHBondContact O-N 2.79Å; S53-K55 PolarHBondContact O-N 2.78Å; S53-K55 VanDerWaalsContact O-N 3.12Å
54	P	39.6	Very low	37.3	Very low	108 Å²	108	137.3 Å²	137.3	70%	0.701	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-60.4	121.9	171	25.9	-32.3	0	0	0	107.9
55	K	35.5	Very low	36.1	Very low	192 Å²	192	140.5 Å²	140.5	84%	0.835	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-62.5	148	171.3	-70.4	-177.6	177.6	179.5	0	108.9	S53 I57	S53-K55 PolarHBondContact O-N 2.78Å; S53-K55 VanDerWaalsContact O-N 3.12Å; K55-I57 PolarHBondContact O-N 3.15Å
56	N	31	Very low	35	Very low	132 Å²	132	142 Å²	142	71%	0.706	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-48.3	129.3	-177.9	-54.8	-8.5	0	0	0	111.4
57	I	34.4	Very low	34.1	Very low	166 Å²	166	143.6 Å²	143.6	85%	0.851	76%	0.759	S	S	*	*			trans	-110.7	135.5	151.7	-65.4	176.4	0	0	0	104.8	K55 S59	K55-I57 PolarHBondContact O-N 3.15Å; I57-S59 PolarHBondContact O-N 3.37Å
58	E	33.3	Very low	33.6	Very low	182 Å²	182	143.5 Å²	143.5	85%	0.85	77%	0.767	S	S	*	*			trans	-71.6	123.7	-173.4	-72.1	160.5	124.9	0	0	110.8	D60	E58-D60 PolarHBondContact O-N 3.35Å
59	S	30.4	Very low	32.8	Very low	128 Å²	128	143.6 Å²	143.6	90%	0.895	77%	0.77	S	S	*	*			trans	-85.3	84.2	174.6	57.8	0	0	0	0	109.4	I57	I57-S59 PolarHBondContact O-N 3.37Å
60	D	31.3	Very low	32.7	Very low	131 Å²	131	146.9 Å²	146.9	70%	0.701	78%	0.783	S	S	*	*			trans	-104.8	125.1	173.3	-154.3	21.2	0	0	0	110.2	E58	E58-D60 PolarHBondContact O-N 3.35Å
61	K	30.1	Very low	32.2	Very low	159 Å²	159	148.7 Å²	148.7	69%	0.691	79%	0.793	S	S	*	*			trans	57.7	99.1	174.8	-56.2	167.7	-168.9	169.1	0	117.3
62	F	30.4	Very low	31.9	Very low	219 Å²	219	151.2 Å²	151.2	96%	0.961	80%	0.796	S	S	*	*				-143.3	124.7	106.8	-104.9	-76.1	0	0	0	109
63	I	31.1	Very low	31.9	Very low	147 Å²	147	150.4 Å²	150.4	75%	0.754	79%	0.792	S	S	*	*			trans	-115.3	143.3	-174.7	-74	174.9	0	0	0	108.7
64	F	27.1	Very low	31.9	Very low	212 Å²	212	150.9 Å²	150.9	93%	0.93	79%	0.791	S	S	*	*			trans	-60.1	129.9	170.4	-91.3	-108.4	0	0	0	111.5
65	S	30.2	Very low	31.5	Very low	117 Å²	117	152.9 Å²	152.9	82%	0.818	80%	0.795	S	S	*	*			trans	-145.6	109.8	156.9	60.3	0	0	0	0	110.6
66	S	29.6	Very low	31.3	Very low	98 Å²	98	155.4 Å²	155.4	69%	0.685	80%	0.8	S	S	*	*			trans	-91.3	171.3	168.7	49.3	0	0	0	0	111.2
67	T	31.1	Very low	31.2	Very low	131 Å²	131	154.3 Å²	154.3	80%	0.804	80%	0.803	S	S	*	*			trans	76.7	155.6	172.6	79.1	0	0	0	0	117
68	P	33.9	Very low	31.1	Very low	121 Å²	121	157.1 Å²	157.1	79%	0.786	80%	0.802	S	S	*	*			cis	-125.5	-174.9	-19.4	28.9	-7.7	0	0	0	113.5
69	E	28.2	Very low	31.3	Very low	186 Å²	186	155.4 Å²	155.4	87%	0.869	80%	0.799	S	S	*	*			trans	-73.1	139.2	178.8	-54.1	155.8	111.2	0	0	113.7
70	I	36	Very low	31.1	Very low	165 Å²	165	158.2 Å²	158.2	85%	0.846	80%	0.795	S	S	*	*			trans	-143.8	97.2	147.1	-55.9	-175.3	0	0	0	111
71	L	29.1	Very low	31	Very low	147 Å²	147	161.4 Å²	161.4	77%	0.77	80%	0.803	S	S	*	*			trans	29.3	123.1	131.3	-141.6	73.6	0	0	0	122.7
72	H	31.2	Very low	31.1	Very low	159 Å²	159	157.3 Å²	157.3	74%	0.736	81%	0.806	S	S	*	*			trans	87.2	153.1	137.9	-109.6	-103.9	0	0	0	125.3
73	E	34.3	Very low	31.3	Very low	158 Å²	158	155 Å²	155	74%	0.738	80%	0.803	S	S	*	*			trans	73.7	71.9	162	-58.2	-158.4	147.2	0	0	122.4
74	T	32.4	Very low	31.3	Very low	111 Å²	111	156 Å²	156	68%	0.681	81%	0.809	S	S	*	*				46.8	137.8	114	61.1	0	0	0	0	123.4
75	N	30.5	Very low	31.7	Very low	149 Å²	149	154.4 Å²	154.4	80%	0.797	80%	0.801	S	S	*	*			trans	66	95	142.1	-68	-28.6	0	0	0	120.2
76	R	31.8	Very low	31.6	Very low	246 Å²	246	159.7 Å²	159.7	93%	0.928	80%	0.803	S	S	*	*				-167.2	141.7	96.4	-110.7	175.1	176.5	157	0.8	113.9
77	S	29.6	Very low	31.7	Very low	109 Å²	109	166.8 Å²	166.8	76%	0.762	82%	0.815	S	S	*	*			trans	-79.3	139.1	161	48.3	0	0	0	0	110.6
78	R	31.2	Very low	31.7	Very low	224 Å²	224	166.1 Å²	166.1	85%	0.845	81%	0.81	S	S	*	*			trans	-173.6	152.8	130.2	-110.6	-175.9	175.5	126.1	3.1	115.4
79	D	37.2	Very low	31.5	Very low	146 Å²	146	166 Å²	166	78%	0.781	81%	0.808	S	S	*	*			trans	75.9	145.3	151.8	-53.9	-21.6	0	0	0	121.2
80	F	27.5	Very low	31.5	Very low	187 Å²	187	164.9 Å²	164.9	82%	0.82	80%	0.802	S	S	*	*			trans	-128.9	153.9	-156	-145.8	-136.9	0	0	0	108.1
81	F	28.7	Very low	31.3	Very low	198 Å²	198	165.1 Å²	165.1	87%	0.868	80%	0.8	S	S	*	*			trans	67.4	130.6	171.8	-85.7	-109.9	0	0	0	119.2
82	G	32	Very low	31.1	Very low	73 Å²	73	167 Å²	167	75%	0.753	80%	0.802	S	S	*	*			trans	-167.9	80.3	175.9	0	0	0	0	0	115.9
83	L	33.9	Very low	30.9	Very low	172 Å²	172	164.6 Å²	164.6	90%	0.901	80%	0.803	S	S	*	*			trans	59.1	102.9	152.9	-66.3	166.3	0	0	0	121
84	I	31.9	Very low	30.7	Very low	168 Å²	168	165.2 Å²	165.2	86%	0.862	81%	0.81	S	S	*	*			trans	-71.6	124.2	149.7	-62.6	165.8	0	0	0	109.6
85	K	35.7	Very low	30.4	Very low	177 Å²	177	170.2 Å²	170.2	77%	0.77	82%	0.817	S	S	*	*			trans	-162.7	119.1	151.4	-123.1	167.5	-173.6	170.9	0	116.5
86	R	28.2	Very low	30.2	Very low	228 Å²	228	167.5 Å²	167.5	86%	0.86	81%	0.81	S	S	*	*			trans	19.9	123.9	143.2	-56.6	176.4	-179	178	-1.9	118.8
87	R	31.2	Very low	30	Very low	248 Å²	248	167.6 Å²	167.6	94%	0.936	81%	0.811	S	S	*	*				-160.7	168.2	99.4	-118	175.6	176.9	150.9	-1.6	112.9
88	T	31.1	Very low	29.9	Very low	116 Å²	116	170.7 Å²	170.7	71%	0.712	81%	0.813	S	S	*	*			trans	-127.4	172.4	-170.6	54.3	0	0	0	0	111.3
89	T	29.2	Very low	30.1	Very low	118 Å²	118	165.3 Å²	165.3	72%	0.724	81%	0.806	S	S	*	*			trans	72.1	141.4	149.7	44.9	0	0	0	0	120
90	H	28.7	Very low	29.8	Very low	163 Å²	163	164.6 Å²	164.6	76%	0.755	80%	0.802	S	S	*	*			trans	68	146.4	178.8	-65.3	-94.8	0	0	0	115.9
91	E	31.5	Very low	30	Very low	170 Å²	170	163.5 Å²	163.5	79%	0.794	79%	0.794	S	S	*	*			cis	-142.1	178	8.3	-157	123.1	-114.4	0	0	113.2
92	K	26	Very low	30.3	Very low	187 Å²	187	162.7 Å²	162.7	81%	0.813	79%	0.792	S	S	*	*			trans	-95	150.9	177.8	-72	178.1	177.6	174.4	0	112.3
93	S	25.8	Very low	30.3	Very low	109 Å²	109	166.4 Å²	166.4	76%	0.762	79%	0.789	S	S	*	*			trans	58.1	131.2	154.2	60.2	0	0	0	0	119.7
94	I	30.6	Very low	30.3	Very low	171 Å²	171	162 Å²	162	88%	0.877	78%	0.778	S	S	*	*				-167.9	164.3	124.4	-101	156.7	0	0	0	110.1
95	Y	26.5	Very low	30.5	Very low	215 Å²	215	159.8 Å²	159.8	84%	0.843	78%	0.775	S	S	*	*			trans	-69.6	148	-171.4	-98.9	-114.6	0	0	0	115.8
96	S	25.3	Very low	30.4	Very low	93 Å²	93	159.5 Å²	159.5	65%	0.65	78%	0.776	S	S	*	*			trans	21.5	130.3	146.6	65.3	0	0	0	0	121.2
97	R	28.9	Very low	30.6	Very low	248 Å²	248	155.2 Å²	155.2	94%	0.936	78%	0.779	S	S	*	*			trans	-162.9	135.6	131.2	-105.8	155.6	-160.9	-150.3	3.9	112.3
98	H	26.6	Very low	30.4	Very low	174 Å²	174	150.1 Å²	150.1	81%	0.806	77%	0.766	S	S	*	*			trans	-85.9	150.6	163.9	-114.6	-79.1	0	0	0	109.7
99	P	35.9	Very low	30.6	Very low	110 Å²	110	152.7 Å²	152.7	71%	0.714	77%	0.769	S	S	*	*			trans	-97.3	140.3	149.9	7.6	11.9	0	0	0	111
100	L	30.6	Very low	30.7	Very low	131 Å²	131	153.2 Å²	153.2	69%	0.686	76%	0.764	S	S	*	*			trans	-94.3	-175.5	153.5	-57.8	103.7	0	0	0	107.2
101	Y	31.2	Very low	30.7	Very low	165 Å²	165	153 Å²	153	65%	0.647	76%	0.763	S	S	*	*			cis	-156.5	159.3	18.2	-107.5	-71.1	0	0	0	108.5	H103	Y101-H103 AromaticContact CE1-NE2 3.79Å
102	H	34.8	Very low	30.7	Very low	180 Å²	180	152.4 Å²	152.4	83%	0.833	76%	0.76	S	S	*	*				-176.8	148.4	107.9	-104.1	-83.3	0	0	0	114.6
103	H	32.7	Very low	31	Very low	151 Å²	151	151.4 Å²	151.4	70%	0.699	76%	0.758	S	S	*	*			trans	-69.9	171	-178.5	-78	-80.5	0	0	0	114.7	Y101	Y101-H103 AromaticContact CE1-NE2 3.79Å
104	A	33.7	Very low	31	Very low	80 Å²	80	157.1 Å²	157.1	66%	0.661	76%	0.762	S	S	*	*			cis	-179.9	-157.2	-14.9	0	0	0	0	0	107.7
105	P	36.9	Very low	30.8	Very low	122 Å²	122	158.9 Å²	158.9	79%	0.792	76%	0.758	S	S	*	*			cis	-129.8	179	-27.8	26.8	-3.5	0	0	0	115.7
106	H	32.1	Very low	30.9	Very low	170 Å²	170	157.6 Å²	157.6	79%	0.787	75%	0.753	S	S	*	*			trans	-39.1	147.2	171.7	-66.1	-103.5	0	0	0	119.3
107	C	32.4	Very low	31.2	Very low	138 Å²	138	160.6 Å²	160.6	93%	0.932	76%	0.757	S	S	*	*				-135	158.3	126.4	-165.4	0	0	0	0	108.9
108	H	28.5	Very low	31.1	Very low	142 Å²	142	152.4 Å²	152.4	66%	0.657	74%	0.737	S	S	*	*			trans	-165.8	118.3	-148.2	163.1	30.2	0	0	0	114.1
109	H	34.6	Very low	31.2	Very low	169 Å²	169	152 Å²	152	78%	0.782	74%	0.735	S	S	*	*			trans	-154	155	160.5	-118	55.3	0	0	0	118.1
110	Q	31.6	Very low	31	Very low	130 Å²	130	154.2 Å²	154.2	61%	0.607	74%	0.74	S	S	*	*			trans	-54.6	141.5	-173.8	-75.5	161.6	-30.5	0	0	116.7
111	Q	28.4	Very low	30.8	Very low	157 Å²	157	158.7 Å²	158.7	73%	0.734	75%	0.747	S	S	*	*				55.8	118.1	88.4	-57	176.5	-48	0	0	115.8
112	H	31.7	Very low	30.7	Very low	159 Å²	159	159 Å²	159	74%	0.736	75%	0.752	S	S	*	*				-174.5	161.6	108.7	-111.1	-94.4	0	0	0	114.3
113	H	32.6	Very low	30.5	Very low	166 Å²	166	157.8 Å²	157.8	77%	0.769	75%	0.746	S	S	*	*			trans	55.7	119.8	162.3	-78.7	-68.9	0	0	0	124.6
114	R	25.6	Very low	30.2	Very low	228 Å²	228	156.4 Å²	156.4	86%	0.86	75%	0.753	S	S	*	*			trans	-81.4	149.5	149.9	-45	167.3	-178.4	169.2	-1.4	110.1
115	R	26.9	Very low	30.3	Very low	208 Å²	208	158 Å²	158	79%	0.785	76%	0.756	S	S	*	*				158.4	148	121.4	-95.5	175.5	165.2	169.8	-2.2	114.7
116	Y	28.8	Very low	29.9	Very low	189 Å²	189	162.7 Å²	162.7	74%	0.741	76%	0.76	S	S	*	*			trans	59.6	150.8	155	-68.2	-56.5	0	0	0	118
117	H	30	Very low	29.8	Very low	156 Å²	156	162.4 Å²	162.4	72%	0.722	76%	0.763	S	S	*	*			cis	-156.8	177.1	-30.6	-152.3	-117.9	0	0	0	109
118	S	26.7	Very low	29.6	Very low	75 Å²	75	160.8 Å²	160.8	52%	0.524	75%	0.752	S	S	.	*			trans	-22.5	137.7	165.6	57.4	0	0	0	0	116.8
119	H	29.5	Very low	29.8	Very low	167 Å²	167	161.7 Å²	161.7	77%	0.773	76%	0.76	S	S	*	*				-175.8	167.3	78.6	-118.5	-81.1	0	0	0	114.9
120	I	31.9	Very low	29.7	Very low	156 Å²	156	159.1 Å²	159.1	80%	0.8	76%	0.757	S	S	*	*			trans	80.2	134.1	154.6	-69.6	159.1	0	0	0	119.1
121	R	25.3	Very low	29.7	Very low	225 Å²	225	161.8 Å²	161.8	85%	0.849	77%	0.769	S	S	*	*			trans	-69.3	154.7	178.3	-52.7	160.7	174	165	-5.6	112.1
122	K	29.2	Very low	29.9	Very low	172 Å²	172	163.6 Å²	163.6	75%	0.748	77%	0.774	S	S	*	*				-176	145.6	112	-102.5	165.4	161.6	-100.5	0	114.5
123	E	31.6	Very low	29.9	Very low	153 Å²	153	162.1 Å²	162.1	72%	0.715	78%	0.779	S	S	*	*			trans	65.2	167.8	152.3	-73.5	139	-132.7	0	0	120.2
124	C	26.1	Very low	30	Very low	123 Å²	123	160.1 Å²	160.1	83%	0.831	78%	0.783	S	S	*	*			trans	-117.4	-162.4	-159.9	-56.8	0	0	0	0	109.5
125	P	35.7	Very low	30.3	Very low	113 Å²	113	156.1 Å²	156.1	73%	0.734	78%	0.784	S	S	*	*			cis	-139.4	-165.2	-2.2	40.1	-18	0	0	0	115.7
126	Y	28.7	Very low	30.6	Very low	220 Å²	220	152.1 Å²	152.1	86%	0.863	79%	0.788	S	S	*	*			trans	-37.2	152.3	170.2	-61.1	-94.5	0	0	0	117.1
127	L	30.5	Very low	30.6	Very low	164 Å²	164	153.1 Å²	153.1	86%	0.859	80%	0.796	S	S	*	*			trans	-126.1	112.8	159.6	-163.2	78.7	0	0	0	110.8
128	C	27	Very low	30.6	Very low	105 Å²	105	151.5 Å²	151.5	71%	0.709	80%	0.803	S	S	*	*			trans	-90.9	141.4	163.9	-67.7	0	0	0	0	109.4	T130	C128-T130 PolarHBondContact O-N 2.87Å
129	I	34	Very low	30.7	Very low	160 Å²	160	156.8 Å²	156.8	82%	0.821	82%	0.819	S	S	*	*			trans	-88.5	106.4	172.6	-60	177.8	0	0	0	108.5
130	T	31.1	Very low	30.7	Very low	116 Å²	116	155.8 Å²	155.8	71%	0.712	82%	0.824	S	S	*	*			trans	-110.4	129	168.4	50.1	0	0	0	0	109.7	C128	C128-T130 PolarHBondContact O-N 2.87Å
131	H	33.1	Very low	30.4	Very low	186 Å²	186	154 Å²	154	86%	0.861	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-66.1	133.6	174	-98.5	-105.7	0	0	0	110.8
132	K	31.5	Very low	30.6	Very low	194 Å²	194	151.5 Å²	151.5	84%	0.843	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-93.6	134.8	164	-78.9	-176.6	174.3	179.3	0	110
133	P	31.8	Very low	30.4	Very low	129 Å²	129	151.3 Å²	151.3	84%	0.838	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-79.8	152.1	155.8	33.9	-31.7	0	0	0	110.3
134	S	35.9	Very low	30.3	Very low	123 Å²	123	153 Å²	153	86%	0.86	83%	0.829	S	S	*	*			trans	-129.3	148.9	167.7	55.2	0	0	0	0	110.2
135	T	31.2	Very low	30.2	Very low	144 Å²	144	151.6 Å²	151.6	88%	0.883	82%	0.821	S	S	*	*			trans	-99.2	142.1	-162.8	53.8	0	0	0	0	113.8
136	S	32.9	Very low	29.8	Very low	124 Å²	124	153.5 Å²	153.5	87%	0.867	82%	0.824	S	S	*	*			trans	-137.9	153.5	146.6	63	0	0	0	0	109.7
137	K	29.4	Very low	29.7	Very low	210 Å²	210	147.7 Å²	147.7	91%	0.913	82%	0.815	S	S	*	*			trans	-109	137.9	-173	-60	174.2	-178.4	175.3	0	111.1
138	S	30.7	Very low	29.5	Very low	123 Å²	123	149.3 Å²	149.3	86%	0.86	82%	0.815	S	S	*	*			trans	-156.2	149.9	134.7	53.1	0	0	0	0	109.6
139	Q	27.4	Very low	29.6	Very low	186 Å²	186	153 Å²	153	87%	0.869	82%	0.822	S	S	*	*			trans	-94.3	152.5	176.4	-63.4	157	-77.3	0	0	109.3
140	V	30.3	Very low	29.3	Very low	145 Å²	145	153.6 Å²	153.6	88%	0.879	83%	0.826	S	S	*	*				-165.4	142.8	112.4	141.7	0	0	0	0	109.6
141	T	25.8	Very low	29.2	Very low	120 Å²	120	153.6 Å²	153.6	74%	0.736	83%	0.831	S	S	*	*			trans	-85.6	148.4	-177.4	-38.7	0	0	0	0	111.1
142	I	29.4	Very low	29.1	Very low	171 Å²	171	152.9 Å²	152.9	88%	0.877	83%	0.832	S	S	*	*				-175.8	157	126.5	-94.6	155	0	0	0	110.8
143	H	24.9	Very low	29.2	Very low	169 Å²	169	148.9 Å²	148.9	78%	0.782	83%	0.826	S	S	*	*			trans	-108.1	170.3	-166.5	-142.6	-98.3	0	0	0	111.5
144	K	28.1	Very low	29.1	Very low	187 Å²	187	148.5 Å²	148.5	81%	0.813	82%	0.821	S	S	*	*			trans	79.9	150.6	175.4	-55.2	177.5	-180	179.1	0	114.9
145	S	25.5	Very low	28.6	Very low	95 Å²	95	148.8 Å²	148.8	66%	0.664	81%	0.813	S	S	*	*			cis	-173.2	162.8	-16.2	-99.1	0	0	0	0	111.9
146	I	27	Very low	28.5	Very low	153 Å²	153	153.1 Å²	153.1	79%	0.785	82%	0.815	S	S	*	*			trans	80.2	142.4	144.6	-75.7	159.5	0	0	0	120.9
147	S	26.5	Very low	28.4	Very low	98 Å²	98	152.9 Å²	152.9	69%	0.685	81%	0.808	S	S	*	*			trans	64	111.8	157.4	64	0	0	0	0	124.1
148	K	25.6	Very low	28.2	Very low	197 Å²	197	150.6 Å²	150.6	86%	0.857	81%	0.806	S	S	*	*				35.4	123.4	119.3	-63.5	-175.5	174.8	-175.5	0	121.1
149	Q	30.1	Very low	28.1	Very low	184 Å²	184	152.8 Å²	152.8	86%	0.86	80%	0.803	S	S	*	*				147.4	117.8	128.8	-83.4	179.9	-23.3	0	0	107.8
150	L	26.2	Very low	28.1	Very low	171 Å²	171	152.7 Å²	152.7	90%	0.895	80%	0.802	S	S	*	*			cis	89.4	84.1	44.6	-166.4	133.9	0	0	0	112.8
151	S	30.5	Very low	27.9	Very low	117 Å²	117	155.7 Å²	155.7	82%	0.818	80%	0.804	S	S	*	*			trans	-158.8	124.1	159.3	45.4	0	0	0	0	111.4
152	L	30.5	Very low	27.9	Very low	170 Å²	170	155 Å²	155	89%	0.89	80%	0.804	S	S	*	*			trans	-90.1	-174.8	158.3	-78.2	168.5	0	0	0	107.6
153	P	32.8	Very low	27.8	Very low	110 Å²	110	156 Å²	156	71%	0.714	80%	0.802	S	S	*	*			cis	-143.4	-154.5	15.6	29.3	-0.6	0	0	0	114.6
154	V	30.5	Very low	28	Very low	121 Å²	121	156.4 Å²	156.4	73%	0.733	80%	0.798	S	S	*	*			trans	75.9	133.9	159.6	179.8	0	0	0	0	115.4
155	D	26.3	Very low	27.9	Very low	129 Å²	129	152.6 Å²	152.6	69%	0.69	80%	0.795	S	S	*	*			cis	-151.4	156.4	-10.5	-117.1	-7.2	0	0	0	109.6
156	Y	29.4	Very low	28.1	Very low	235 Å²	235	154 Å²	154	92%	0.922	81%	0.805	S	S	*	*			trans	-152.1	116.8	154.7	-120	-84.1	0	0	0	108.8
157	T	30.4	Very low	28.3	Very low	119 Å²	119	151.8 Å²	151.8	73%	0.73	80%	0.803	S	S	*	*			trans	-80.5	125.1	-168.3	49.7	0	0	0	0	113.2	E159	T157-E159 PolarHBondContact O-N 3.44Å
158	D	25.5	Very low	28.3	Very low	163 Å²	163	151.1 Å²	151.1	87%	0.872	81%	0.812	S	S	*	*			trans	-67.6	114.1	167.3	-88.5	-54	0	0	0	111.7
159	E	26.7	Very low	28.4	Very low	168 Å²	168	148.9 Å²	148.9	79%	0.785	81%	0.808	S	S	*	*			trans	-128.9	151.9	153.6	-75.4	-156.2	136.2	0	0	110.5	T157	T157-E159 PolarHBondContact O-N 3.44Å
160	Q	27.4	Very low	28.3	Very low	184 Å²	184	148.8 Å²	148.8	86%	0.86	81%	0.812	S	S	*	*	S	Bend	trans	70	51.4	175.4	-48.2	-172.7	12.9	0	0	117.4
161	K	25.9	Very low	28.4	Very low	209 Å²	209	147.6 Å²	147.6	91%	0.909	80%	0.802	S	S	*	*			trans	-154.8	48.4	159.4	-113	150.3	-163.3	166.5	0	117.7
162	S	25.9	Very low	28.4	Very low	106 Å²	106	148.6 Å²	148.6	74%	0.741	80%	0.804	S	S	*	*			trans	-120.8	145.1	154	60.4	0	0	0	0	108.3
163	F	27.2	Very low	28.4	Very low	191 Å²	191	147.7 Å²	147.7	84%	0.838	80%	0.8	S	S	*	*	S	Bend	cis	-116.2	144	11.6	-88.3	-132.2	0	0	0	112
164	Y	29.4	Very low	28.3	Very low	177 Å²	177	147.6 Å²	147.6	69%	0.694	80%	0.802	S	S	*	*	S	Bend	trans	175	85.8	143.4	-98.6	-64.2	0	0	0	110.1	E800	Y164-E800 WeakPolarHBondContact CE2-OE1 3.29Å; Y164-E800 WeakPolarHBondContact CE2-OE2 3.4Å; Y164-E800 PolarHBondContact OH-OE2 2.8Å
165	S	26.9	Very low	28.3	Very low	108 Å²	108	149 Å²	149	76%	0.755	80%	0.803	S	S	*	*			trans	165.8	76.4	153.1	179.5	0	0	0	0	112.2
166	S	29.2	Very low	28.5	Very low	125 Å²	125	149 Å²	149	87%	0.874	80%	0.803	S	S	*	*			trans	-132.6	82.9	159.5	-65.3	0	0	0	0	107.7
167	S	30.8	Very low	28.5	Very low	106 Å²	106	144.4 Å²	144.4	74%	0.741	79%	0.794	S	S	*	*				82.9	77.1	82.9	-68.7	0	0	0	0	112.4	L169	S167-L169 PolarHBondContact O-N 3.24Å
168	G	26.3	Very low	28.6	Very low	84 Å²	84	146.5 Å²	146.5	87%	0.866	80%	0.801	S	S	*	*			trans	-77.8	96.7	160.9	0	0	0	0	0	110.6
169	L	29.6	Very low	28.7	Very low	150 Å²	150	146.1 Å²	146.1	79%	0.785	80%	0.799	S	S	*	*			trans	-156.7	78	164.4	-119.8	172	0	0	0	112	S167 Q171	S167-L169 PolarHBondContact O-N 3.24Å; L169-Q171 VanDerWaalsContact C-N 3.32Å; L169-Q171 PolarHBondContact O-N 3.3Å
170	L	27.3	Very low	29.1	Very low	181 Å²	181	146.1 Å²	146.1	95%	0.948	80%	0.803	S	S	*	*			trans	-86.8	67.8	170.8	-115	171.9	0	0	0	110.1
171	Q	28.2	Very low	29.1	Very low	147 Å²	147	145.7 Å²	145.7	69%	0.687	80%	0.801	S	S	*	*			trans	-161.6	73.5	171.2	-133.8	174.6	-4.1	0	0	116	L169	L169-Q171 VanDerWaalsContact C-N 3.32Å; L169-Q171 PolarHBondContact O-N 3.3Å
172	T	31.1	Very low	29.3	Very low	138 Å²	138	141.9 Å²	141.9	85%	0.847	80%	0.8	S	S	*	*			trans	-143.3	110.9	155.5	42.9	0	0	0	0	110
173	N	30.5	Very low	29.6	Very low	151 Å²	151	140 Å²	140	81%	0.807	80%	0.798	S	S	*	*			trans	-86.9	152.3	158	-73.5	-14.3	0	0	0	108.2
174	S	30.5	Very low	29.7	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	80%	0.798	S	S	*	*			trans	61.4	143	156.7	48.8	0	0	0	0	117.5
175	I	29.7	Very low	29.6	Very low	149 Å²	149	136.4 Å²	136.4	76%	0.764	80%	0.798	S	S	*	*			cis	-156	156.5	3.9	-121.6	162.2	0	0	0	108.3
176	L	30.8	Very low	29.8	Very low	130 Å²	130	137.3 Å²	137.3	68%	0.681	79%	0.794	S	S	*	*			trans	24.6	123.1	165	-76.8	76.5	0	0	0	118.9
177	D	28.3	Very low	30	Very low	138 Å²	138	138.5 Å²	138.5	74%	0.738	79%	0.785	S	S	*	*				64.5	121.9	72.7	-58.4	-47.3	0	0	0	113
178	D	32.6	Very low	30.1	Very low	164 Å²	164	139 Å²	139	88%	0.877	78%	0.78	S	S	*	*			trans	-175.5	97.2	135.5	-95.5	-15.2	0	0	0	109.6
179	D	29.2	Very low	30.4	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	77%	0.774	S	S	*	*			trans	-81.1	174.9	153.1	-98	-47.2	0	0	0	109.1
180	I	33.7	Very low	30.5	Very low	169 Å²	169	141.4 Å²	141.4	87%	0.867	77%	0.773	S	S	*	*			trans	96.7	129.8	170.1	-54.2	172.1	0	0	0	115.7
181	E	28.8	Very low	30.7	Very low	175 Å²	175	139.8 Å²	139.8	82%	0.818	77%	0.765	S	S	*	*			trans	-75.2	163.5	-174.9	-58.8	170.1	94.6	0	0	114.8
182	S	30.3	Very low	30.7	Very low	128 Å²	128	141.7 Å²	141.7	90%	0.895	77%	0.773	S	S	*	*			trans	82.8	137.2	146.6	81.4	0	0	0	0	119.1
183	G	30.8	Very low	30.6	Very low	68 Å²	68	140.3 Å²	140.3	70%	0.701	77%	0.769	S	S	*	*			trans	123.1	89.2	161.3	0	0	0	0	0	116.1
184	L	29.6	Very low	30.4	Very low	159 Å²	159	143.3 Å²	143.3	83%	0.832	77%	0.771	S	S	*	*			trans	42.9	101.2	138	-64	161.6	0	0	0	117.5
185	N	28.2	Very low	30.4	Very low	132 Å²	132	145 Å²	145	71%	0.706	78%	0.776	S	S	*	*				95.9	140.6	77.9	-104	1.3	0	0	0	114.4
186	I	30.9	Very low	30.4	Very low	128 Å²	128	142.3 Å²	142.3	66%	0.656	77%	0.77	S	S	*	*			trans	81.5	110.4	142.6	-74.1	167.1	0	0	0	118.8
187	H	32.5	Very low	30.4	Very low	150 Å²	150	145.1 Å²	145.1	69%	0.694	78%	0.783	S	S	*	*			trans	56.4	146.5	139.4	-59.8	-42.2	0	0	0	121.4
188	D	32.4	Very low	30.5	Very low	117 Å²	117	143.7 Å²	143.7	63%	0.626	78%	0.781	S	S	*	*			cis	-165.4	173.9	-15.8	-106.3	-3.9	0	0	0	109.1
189	D	32.8	Very low	30.1	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	78%	0.782	S	S	*	*			trans	58.5	100.8	144.9	-66.7	-2.9	0	0	0	121.3
190	D	32.8	Very low	30.1	Very low	143 Å²	143	144.2 Å²	144.2	77%	0.765	78%	0.782	S	S	*	*				121.4	149.3	101.4	-124.5	-10.8	0	0	0	122.1
191	L	31.6	Very low	29.7	Very low	148 Å²	148	143.2 Å²	143.2	78%	0.775	78%	0.778	S	S	*	*			trans	69.5	115.5	158.4	-107.9	67.7	0	0	0	123.2
192	H	27.4	Very low	29.9	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.866	78%	0.779	S	S	*	*			trans	-60.2	147.8	159	-67.9	-99.3	0	0	0	113.4
193	S	28.3	Very low	29.8	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	77%	0.773	S	S	*	*				-169.1	139.8	122.7	32.9	0	0	0	0	115.4
194	Y	26.2	Very low	29.9	Very low	214 Å²	214	144 Å²	144	84%	0.839	77%	0.772	S	S	*	*			trans	10.3	126.5	157.2	-63.8	-90.9	0	0	0	121.6
195	V	31.3	Very low	30	Very low	143 Å²	143	144 Å²	144	87%	0.867	77%	0.769	S	S	*	*			trans	-129.8	99.3	135.5	-177.6	0	0	0	0	109.9
196	S	29	Very low	30.1	Very low	92 Å²	92	148.8 Å²	148.8	64%	0.643	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-78.2	144.1	155.8	45	0	0	0	0	108.9	P198	S196-P198 VanDerWaalsContact O-CD 3.29Å; S196-P198 WeakPolarHBondContact O-CD 3.42Å
197	M	31.6	Very low	30.3	Very low	190 Å²	190	147.6 Å²	147.6	94%	0.936	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-83	117.8	174.2	-82.2	-167.7	167.8	0	0	111.1
198	P	30.7	Very low	30.4	Very low	108 Å²	108	149.6 Å²	149.6	70%	0.701	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-100.3	155.1	177.5	37.4	-29	0	0	0	112.2	S196	S196-P198 VanDerWaalsContact O-CD 3.29Å; S196-P198 WeakPolarHBondContact O-CD 3.42Å
199	K	24.9	Very low	30.3	Very low	208 Å²	208	147.7 Å²	147.7	90%	0.904	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-75.1	134.5	152.1	-69.2	175.5	178.1	175	0	108
200	C	28.8	Very low	30.4	Very low	121 Å²	121	150.6 Å²	150.6	82%	0.818	78%	0.781	S	S	*	*			trans	-142.1	130	156.4	-111	0	0	0	0	110.8
201	N	25.5	Very low	30.5	Very low	147 Å²	147	150.9 Å²	150.9	79%	0.786	78%	0.782	S	S	*	*			trans	-76.8	155.5	154.7	-67.8	-33.1	0	0	0	108
202	I	32.7	Very low	30.4	Very low	163 Å²	163	148.9 Å²	148.9	84%	0.836	78%	0.781	S	S	*	*				170.8	140.6	119.7	-86.6	157.3	0	0	0	109.7
203	T	28.7	Very low	30.8	Very low	126 Å²	126	143 Å²	143	77%	0.773	77%	0.77	S	S	*	*			trans	-57.7	144.6	-178.6	48.9	0	0	0	0	116
204	S	31.1	Very low	31	Very low	98 Å²	98	143.5 Å²	143.5	69%	0.685	77%	0.774	S	S	*	*				-161.7	176.3	102.9	-140.9	0	0	0	0	114
205	E	32	Very low	31.4	Very low	161 Å²	161	138.1 Å²	138.1	75%	0.752	77%	0.768	S	S	*	*			trans	-33.2	139.1	-171.9	-65	122.3	147.5	0	0	118.9
206	R	30.4	Very low	31.6	Very low	232 Å²	232	136.2 Å²	136.2	88%	0.875	76%	0.761	S	S	*	*				69.5	145.7	53	-81.5	-167.8	172.2	-169.3	1	115.1
207	P	36.3	Very low	31.8	Very low	103 Å²	103	136.5 Å²	136.5	67%	0.669	76%	0.762	S	S	*	*			cis	-141.4	-157	-47.6	39.1	-18.7	0	0	0	111.4
208	K	33	Very low	31.9	Very low	192 Å²	192	135.2 Å²	135.2	84%	0.835	76%	0.758	S	S	*	*			trans	104.1	146.9	164.3	-62	169.1	-176.8	173.5	0	116
209	S	31.7	Very low	32.1	Very low	76 Å²	76	135.3 Å²	135.3	53%	0.531	76%	0.757	S	S	.	*			cis	-175.8	159.2	-30.7	47.1	0	0	0	0	111.2
210	Y	34	Very low	32.6	Very low	202 Å²	202	130.3 Å²	130.3	79%	0.792	75%	0.749	S	S	*	*			trans	108.2	126.4	150.3	-62.6	-53.7	0	0	0	121.4
211	L	34.9	Very low	32.8	Very low	149 Å²	149	129.7 Å²	129.7	78%	0.78	74%	0.744	S	S	*	*			trans	60.1	160.2	141.2	-85.4	70.1	0	0	0	120.6
212	S	30.3	Very low	33.2	Very low	106 Å²	106	129 Å²	129	74%	0.741	74%	0.74	S	S	*	*			cis	-179.1	140.9	-43	53	0	0	0	0	110.8
213	G	35	Very low	33.1	Very low	63 Å²	63	131.6 Å²	131.6	65%	0.649	74%	0.739	S	S	*	*			trans	154.4	121.8	166.8	0	0	0	0	0	110.3
214	S	32.9	Very low	33.1	Very low	120 Å²	120	130.3 Å²	130.3	84%	0.839	73%	0.734	S	S	*	*				69.1	125.1	63.8	75.1	0	0	0	0	112.5
215	S	34.4	Very low	33.1	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	74%	0.738	S	S	*	*			cis	-161.4	171	12.3	57.3	0	0	0	0	113
216	S	34.9	Very low	33.1	Very low	103 Å²	103	131.6 Å²	131.6	72%	0.72	74%	0.738	S	S	*	*			trans	61.2	148.3	148	51	0	0	0	0	120.5
217	S	33.5	Very low	33.2	Very low	97 Å²	97	125.5 Å²	125.5	68%	0.678	73%	0.731	S	S	*	*			cis	-172.9	-178.1	-15.7	51.2	0	0	0	0	109.2
218	L	34.9	Very low	32.7	Very low	163 Å²	163	127.4 Å²	127.4	85%	0.853	74%	0.735	S	S	*	*			trans	75.8	145.6	167.5	-54.2	163.5	0	0	0	117.6
219	T	35.1	Very low	32.8	Very low	110 Å²	110	127.4 Å²	127.4	68%	0.675	74%	0.738	S	S	*	*			cis	-157.7	153.7	-41.6	-34.1	0	0	0	0	109
220	S	34.7	Very low	32.6	Very low	104 Å²	104	129.5 Å²	129.5	73%	0.727	75%	0.748	S	S	*	*			trans	62.5	147.2	153.5	52.8	0	0	0	0	119.6
221	C	32.8	Very low	32.5	Very low	107 Å²	107	126 Å²	126	72%	0.723	75%	0.747	S	S	*	*			cis	-155	151.6	-3.9	-121	0	0	0	0	112.5
222	L	33.5	Very low	32.4	Very low	132 Å²	132	124 Å²	124	69%	0.691	75%	0.745	S	S	*	*			trans	37.9	123.3	147.1	-60	170.3	0	0	0	120.1
223	R	30.9	Very low	32.5	Very low	219 Å²	219	123.1 Å²	123.1	83%	0.826	74%	0.74	S	S	*	*				63.6	142.3	67.1	-67.5	-165.5	-166.4	165.6	2.2	114.1
224	C	29.7	Very low	32.6	Very low	99 Å²	99	127.5 Å²	127.5	67%	0.669	74%	0.743	S	S	*	*			cis	-173.8	157.2	-11.7	-109.7	0	0	0	0	111.5
225	L	30.9	Very low	32.7	Very low	144 Å²	144	126.7 Å²	126.7	75%	0.754	73%	0.733	S	S	*	*			trans	68.2	149.6	141.4	-70.9	166.9	0	0	0	122.6
226	N	31.7	Very low	32.8	Very low	141 Å²	141	131.3 Å²	131.3	75%	0.754	74%	0.74	S	S	*	*			trans	71.6	147.1	153.7	-65.1	0.4	0	0	0	118.6
227	S	31.9	Very low	32.8	Very low	105 Å²	105	129.8 Å²	129.8	73%	0.734	73%	0.734	S	S	*	*			cis	-157.6	173.8	-8	42	0	0	0	0	111.3
228	D	25.9	Very low	32.9	Very low	143 Å²	143	132.4 Å²	132.4	77%	0.765	74%	0.739	S	S	*	*			trans	-58	158.1	-177.2	-48.1	-98.5	0	0	0	115.8
229	H	35.5	Very low	32.9	Very low	192 Å²	192	131.2 Å²	131.2	89%	0.889	73%	0.733	S	S	*	*				-157.7	148.5	127.3	-107.5	-68.2	0	0	0	113.1
230	T	27.1	Very low	32.8	Very low	120 Å²	120	133 Å²	133	74%	0.736	73%	0.734	S	S	*	*			trans	-88	164.5	-174.5	48.9	0	0	0	0	113.9
231	V	32.8	Very low	32.9	Very low	128 Å²	128	133.7 Å²	133.7	78%	0.776	73%	0.728	S	S	*	*				165.7	132.6	126.4	153.3	0	0	0	0	113
232	S	31.4	Very low	32.9	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	73%	0.726	S	S	*	*			trans	28.7	143	141.3	-155.4	0	0	0	0	121
233	S	33.9	Very low	32.9	Very low	89 Å²	89	137.2 Å²	137.2	62%	0.622	73%	0.728	S	S	*	*			cis	-167.7	173.1	-2.5	37.3	0	0	0	0	107.2
234	H	35.4	Very low	32.7	Very low	155 Å²	155	132.9 Å²	132.9	72%	0.718	72%	0.721	S	S	*	*			cis	-170.3	147	47.8	-131.2	-78.9	0	0	0	111.2
235	T	36.8	Very low	32.9	Very low	103 Å²	103	133.5 Å²	133.5	63%	0.632	73%	0.726	S	S	*	*			trans	16.5	140	148.7	52.4	0	0	0	0	120.6
236	K	35.1	Very low	32.7	Very low	197 Å²	197	135.9 Å²	135.9	86%	0.857	73%	0.734	S	S	*	*			cis	-171.5	165.6	19.3	-102.5	159	177.8	-175	0	106.1
237	A	35.9	Very low	32.9	Very low	72 Å²	72	134.2 Å²	134.2	60%	0.595	73%	0.731	S	S	*	*			cis	-174.3	150.8	-20.4	0	0	0	0	0	108.8
238	I	35.2	Very low	32.7	Very low	152 Å²	152	138.6 Å²	138.6	78%	0.779	74%	0.739	S	S	*	*				50.9	130.5	128.4	-59.9	170.8	0	0	0	118.8
239	D	34.8	Very low	32.6	Very low	138 Å²	138	137.2 Å²	137.2	74%	0.738	74%	0.74	S	S	*	*			cis	-176.7	-158.6	-22.4	-120.8	-64.3	0	0	0	107
240	E	33.6	Very low	32.2	Very low	148 Å²	148	132.4 Å²	132.4	69%	0.692	73%	0.728	S	S	*	*			cis	-158.2	149.9	5.6	-136.9	-172.2	102.4	0	0	110.7
241	I	35.6	Very low	32.3	Very low	117 Å²	117	135.1 Å²	135.1	60%	0.6	73%	0.732	S	S	*	*			trans	42.8	110.5	131.7	-76.2	-179.9	0	0	0	120.9
242	N	33.1	Very low	32	Very low	126 Å²	126	134 Å²	134	67%	0.674	73%	0.729	S	S	*	*				95.1	159.3	92.9	-70.8	-2.1	0	0	0	114.1
243	Y	32.8	Very low	31.9	Very low	188 Å²	188	134.1 Å²	134.1	74%	0.737	73%	0.73	S	S	*	*			cis	-154	155	-12.4	-131.2	-133.5	0	0	0	109.6
244	D	28.3	Very low	31.6	Very low	128 Å²	128	136.2 Å²	136.2	68%	0.684	74%	0.739	S	S	*	*			trans	31.7	163.6	143.8	-68.1	3.2	0	0	0	125.8
245	S	32.5	Very low	31.3	Very low	111 Å²	111	136 Å²	136	78%	0.776	74%	0.741	S	S	*	*			trans	95.7	79.6	153.7	69.5	0	0	0	0	120.8
246	E	28.6	Very low	30.9	Very low	195 Å²	195	135.4 Å²	135.4	91%	0.911	74%	0.742	S	S	*	*				64.1	158.5	128.2	-71.1	-151.9	124.9	0	0	122.7
247	P	34.2	Very low	30.5	Very low	106 Å²	106	133.8 Å²	133.8	69%	0.688	74%	0.742	S	S	*	*			trans	-109.7	161.5	-165.3	40.5	-32.1	0	0	0	114.3
248	Q	29.1	Very low	30.2	Very low	196 Å²	196	136.7 Å²	136.7	92%	0.916	75%	0.753	S	S	*	*			trans	-157.7	169.2	134.9	-120.7	167.6	74.5	0	0	114.2
249	C	22.9	Very low	29.7	Very low	115 Å²	115	133.9 Å²	133.9	78%	0.777	75%	0.747	S	S	*	*			trans	-74.9	152.4	-170.2	-55.5	0	0	0	0	113.5
250	S	27.6	Very low	29.3	Very low	90 Å²	90	136.1 Å²	136.1	63%	0.629	75%	0.75	S	S	*	*				139.8	143.8	105.6	69.9	0	0	0	0	114
251	H	28.4	Very low	28.9	Very low	178 Å²	178	136 Å²	136	82%	0.824	75%	0.753	S	S	*	*			trans	58.8	152.2	162.6	-61.3	-66.9	0	0	0	118.3
252	S	27.2	Very low	28.4	Very low	104 Å²	104	140 Å²	140	73%	0.727	77%	0.767	S	S	*	*			cis	-167.7	112.5	-23.1	49.5	0	0	0	0	111.4
253	S	29.8	Very low	28	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	76%	0.76	S	S	*	*			trans	-166.7	123.3	152.7	50.9	0	0	0	0	109
254	V	27.1	Very low	27.9	Very low	134 Å²	134	141.6 Å²	141.6	81%	0.812	77%	0.769	S	S	*	*				39.5	111.1	92.5	-151.6	0	0	0	0	110.4
255	I	28.8	Very low	27.8	Very low	149 Å²	149	140.6 Å²	140.6	76%	0.764	76%	0.763	S	S	*	*				-147.9	138.8	62.3	-76.7	164.9	0	0	0	112.7
256	S	29.2	Very low	27.8	Very low	92 Å²	92	143.5 Å²	143.5	64%	0.643	77%	0.77	S	S	*	*			trans	34.5	122.3	161.7	70.1	0	0	0	0	122.5
257	N	24.9	Very low	27.7	Very low	162 Å²	162	139.7 Å²	139.7	87%	0.866	76%	0.76	S	S	*	*			trans	-62.4	135.1	147.2	-73.1	-45.8	0	0	0	111.1
258	T	29.7	Very low	27.3	Very low	133 Å²	133	142 Å²	142	82%	0.816	77%	0.767	S	S	*	*			trans	-124.3	81.1	160.1	54.2	0	0	0	0	110.9
259	S	26.4	Very low	27.3	Very low	93 Å²	93	136.8 Å²	136.8	65%	0.65	76%	0.758	S	S	*	*			trans	-77.7	157.6	164.9	70.9	0	0	0	0	111.3
260	K	26	Very low	27.4	Very low	186 Å²	186	135.9 Å²	135.9	81%	0.809	75%	0.753	S	S	*	*	S	Bend	trans	72.5	148.7	162.4	-64	175.5	177.8	179.1	0	118.4
261	L	23.6	Very low	27.3	Very low	144 Å²	144	138.9 Å²	138.9	75%	0.754	76%	0.761	S	S	*	*			trans	12.7	135.6	152.3	-66.6	85.6	0	0	0	118.9
262	K	27	Very low	27.3	Very low	203 Å²	203	138.8 Å²	138.8	88%	0.883	77%	0.766	S	S	*	*				-159.4	158.2	104.4	-113.6	173.1	-177.8	-177.4	0	115.7
263	Y	24.7	Very low	27.2	Very low	138 Å²	138	142.7 Å²	142.7	54%	0.541	77%	0.77	S	S	.	*			trans	-57.7	159.8	165.9	-79.4	-125.5	0	0	0	111.3
264	F	29.3	Very low	27	Very low	209 Å²	209	144.3 Å²	144.3	92%	0.917	77%	0.77	S	S	*	*			trans	-124.3	124.8	132	-115.7	-91.6	0	0	0	108.2
265	D	26.8	Very low	27	Very low	107 Å²	107	146 Å²	146	57%	0.572	77%	0.77	S	S	*	*			trans	-74.4	145.3	162.3	-67.9	-68.8	0	0	0	108.8
266	D	32.3	Very low	27	Very low	171 Å²	171	144.7 Å²	144.7	91%	0.914	77%	0.768	S	S	*	*			trans	-127.9	106	145.1	-99.2	-39.6	0	0	0	106.1
267	T	27.2	Very low	26.9	Very low	115 Å²	115	148.4 Å²	148.4	71%	0.706	78%	0.776	S	S	*	*			trans	-98.9	112.7	179.9	-56.6	0	0	0	0	109
268	D	26.2	Very low	27.1	Very low	154 Å²	154	147.7 Å²	147.7	82%	0.824	77%	0.765	S	S	*	*			trans	-171.3	169.3	147.5	-108.7	-29.4	0	0	0	112.8
269	A	29.3	Very low	27	Very low	88 Å²	88	146.4 Å²	146.4	73%	0.727	75%	0.753	S	S	*	*			trans	52.5	71.3	-179.9	0	0	0	0	0	114.1
270	S	24	Very low	27.6	Very low	96 Å²	96	148.2 Å²	148.2	67%	0.671	76%	0.76	S	S	*	*				37.7	127.7	64.4	72.3	0	0	0	0	115.3
271	N	26.5	Very low	27.8	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	74%	0.739	S	S	*	*			trans	69.9	80.5	171.4	-52.5	-40.8	0	0	0	119.2
272	L	26.4	Very low	28.2	Very low	176 Å²	176	142.3 Å²	142.3	92%	0.921	73%	0.731	S	S	*	*				-154	126.9	113.2	-145.9	68.8	0	0	0	112.4
273	F	26.3	Very low	28.6	Very low	186 Å²	186	138.5 Å²	138.5	82%	0.816	72%	0.721	S	S	*	*			trans	-84.3	169.1	167.4	-111.7	-109.2	0	0	0	110.4
274	D	25.9	Very low	29.1	Very low	142 Å²	142	142 Å²	142	76%	0.759	73%	0.733	S	S	*	*			trans	60.2	90.9	160.4	-55.6	-30.1	0	0	0	119.6
275	E	27.5	Very low	29.2	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.794	72%	0.717	S	S	*	*				-148.8	128.3	116.3	-142.2	-175.9	-149.7	0	0	111.9	K278	E275-K278 IonicContact OE2-NZ 3.56Å; E275-K278 PolarHBondContact OE2-NZ 2.82Å; E275-K278 VanDerWaalsContact OE2-NZ 3.07Å
276	V	26.9	Very low	29.5	Very low	122 Å²	122	139.2 Å²	139.2	74%	0.739	73%	0.726	S	S	*	*			trans	-86.3	152.7	179.3	163.4	0	0	0	0	110.8
277	Q	28.6	Very low	29.4	Very low	170 Å²	170	138.5 Å²	138.5	79%	0.794	71%	0.712	S	S	*	*			trans	62.9	107.2	175.7	-74.4	173.4	-9.7	0	0	117.3
278	K	28.6	Very low	29.6	Very low	146 Å²	146	141 Å²	141	64%	0.635	71%	0.713	S	S	*	*			trans	-164.7	-19.5	148.7	-108.1	146	-149.1	133.8	0	118.6	E275 T280	E275-K278 IonicContact OE2-NZ 3.56Å; E275-K278 PolarHBondContact OE2-NZ 2.82Å; E275-K278 VanDerWaalsContact OE2-NZ 3.07Å; K278-T280 PolarHBondContact O-N 2.81Å
279	D	28.5	Very low	30.1	Very low	107 Å²	107	138.5 Å²	138.5	57%	0.572	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	60.7	-168.7	-65	-62.6	0	0	0	115.1	K282	D279-K282 WeakPolarHBondContact OD1-CD 3.43Å; D279-K282 WeakPolarHBondContact OD1-CE 3.36Å; D279-K282 IonicContact OD1-NZ 3.55Å; D279-K282 PolarHBondContact OD1-NZ 2.76Å
280	T	37.6	Very low	30.2	Very low	131 Å²	131	140.1 Å²	140.1	80%	0.804	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.1	15	163.3	44.9	0	0	0	0	112.8	K278	K278-T280 PolarHBondContact O-N 2.81Å
281	L	30.7	Very low	30.4	Very low	68 Å²	68	141.7 Å²	141.7	36%	0.356	71%	0.706	S	S	.	*	S	Bend	trans	-129.1	-13.1	-173.9	-128.6	160.5	0	0	0	114.3	L285 F342	L281-L285 HydrophobicContact CD2-CD1 3.69Å; L281-L285 HydrophobicContact CD2-CG 4.05Å; L281-L285 WeakPolarHBondContact O-CG 3.13Å; L281-F342 HydrophobicContact CD1-CE2 4.46Å; L281-F342 HydrophobicContact CD2-CE2 4.4Å; L281-F342 HydrophobicContact CD2-CZ 4.17Å; L281-F342 HydrophobicContact CG-CE2 4.48Å
282	K	32.4	Very low	30.5	Very low	137 Å²	137	139.5 Å²	139.5	60%	0.596	70%	0.703	S	S	*	*	S	Bend	trans	-70.1	-51.4	178.3	-80.4	177.3	-176	147.2	0	112.3	D279 R284 L285	D279-K282 WeakPolarHBondContact OD1-CD 3.43Å; D279-K282 WeakPolarHBondContact OD1-CE 3.36Å; D279-K282 IonicContact OD1-NZ 3.55Å; D279-K282 PolarHBondContact OD1-NZ 2.76Å; K282-R284 PolarHBondContact O-N 2.63Å; K282-L285 PolarHBondContact O-N 3.23Å
283	D	34.4	Very low	30.7	Very low	124 Å²	124	137.6 Å²	137.6	66%	0.663	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-7.2	-171.7	-52.3	-70.3	0	0	0	114.2
284	R	34.8	Very low	30.7	Very low	211 Å²	211	138.1 Å²	138.1	80%	0.796	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-1.5	172.8	-61.8	-169.1	-178.7	-155.8	2.7	114.3	K282	K282-R284 PolarHBondContact O-N 2.63Å
285	L	33.2	Very low	30.7	Very low	113 Å²	113	138.3 Å²	138.3	59%	0.592	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-9.1	179.3	-77.4	175.1	0	0	0	114.8	L281 K282 Y287	L281-L285 HydrophobicContact CD2-CD1 3.69Å; L281-L285 HydrophobicContact CD2-CG 4.05Å; L281-L285 WeakPolarHBondContact O-CG 3.13Å; K282-L285 PolarHBondContact O-N 3.23Å; L285-Y287 PolarHBondContact O-N 3.44Å; L285-Y287 VanDerWaalsContact O-N 3.09Å
286	L	31.6	Very low	30.6	Very low	144 Å²	144	136.9 Å²	136.9	75%	0.754	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	6.1	179.2	-99.7	151.9	0	0	0	115.4
287	Y	31.6	Very low	30.6	Very low	156 Å²	156	138.2 Å²	138.2	61%	0.612	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	5.6	-172	-85.9	-87	0	0	0	116.2	L285	L285-Y287 PolarHBondContact O-N 3.44Å; L285-Y287 VanDerWaalsContact O-N 3.09Å
288	F	31	Very low	30.7	Very low	169 Å²	169	136.1 Å²	136.1	74%	0.741	70%	0.696	S	S	*	*			trans	-120.2	102.5	178.9	-75.9	-81.2	0	0	0	114	T290	F288-T290 PolarHBondContact O-N 3.4Å
289	P	35.7	Very low	30.6	Very low	100 Å²	100	136.3 Å²	136.3	65%	0.649	70%	0.704	S	S	*	*			trans	-84.2	79.1	167.7	33.6	-32.1	0	0	0	110.6	I291	P289-I291 PolarHBondContact O-N 3.02Å
290	T	32.3	Very low	30.9	Very low	123 Å²	123	136.8 Å²	136.8	76%	0.755	71%	0.713	S	S	*	*			trans	-69.8	117.7	-179.7	-43.5	0	0	0	0	111.1	F288	F288-T290 PolarHBondContact O-N 3.4Å
291	I	27.1	Very low	30.6	Very low	128 Å²	128	137 Å²	137	66%	0.656	72%	0.715	S	S	*	*			trans	-74.8	127.7	177.6	-62	171	0	0	0	109.6	P289	P289-I291 PolarHBondContact O-N 3.02Å
292	S	29.4	Very low	30.6	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	74%	0.742	S	S	*	*			trans	-147.5	104.5	160.6	-175.9	0	0	0	0	110.8
293	N	30.2	Very low	30.5	Very low	136 Å²	136	150.4 Å²	150.4	73%	0.727	76%	0.757	S	S	*	*			trans	32.4	117.6	156.7	-57.2	-7.8	0	0	0	119.6	L295	N293-L295 PolarHBondContact O-N 3.07Å
294	Q	26.5	Very low	30.2	Very low	197 Å²	197	150 Å²	150	92%	0.921	76%	0.762	S	S	*	*			trans	-59.3	126.2	148.9	-64.1	168.9	-72.3	0	0	109.2
295	L	25.9	Very low	30.1	Very low	145 Å²	145	149.6 Å²	149.6	76%	0.759	77%	0.766	S	S	*	*			trans	-162.9	122.1	153	-108.3	165.9	0	0	0	109.2	N293	N293-L295 PolarHBondContact O-N 3.07Å
296	L	26.3	Very low	30	Very low	141 Å²	141	151 Å²	151	74%	0.738	77%	0.774	S	S	*	*			trans	67.4	121.8	162.6	-55.9	165.6	0	0	0	118.8
297	L	26.3	Very low	30	Very low	150 Å²	150	148.8 Å²	148.8	79%	0.785	77%	0.771	S	S	*	*				42.3	132.3	126.6	-51.7	171.8	0	0	0	118.3
298	T	31.3	Very low	30	Very low	125 Å²	125	148.1 Å²	148.1	77%	0.767	78%	0.777	S	S	*	*				-156	156.8	53.6	41.1	0	0	0	0	114.1
299	N	26.7	Very low	30.1	Very low	150 Å²	150	147.6 Å²	147.6	80%	0.802	78%	0.777	S	S	*	*			trans	-76.1	149.8	156.6	-88.8	-39.7	0	0	0	109.8
300	P	34.5	Very low	29.9	Very low	117 Å²	117	148.7 Å²	148.7	76%	0.76	78%	0.777	S	S	*	*				-147.8	124	113.8	34	-17.1	0	0	0	114.9
301	T	31.4	Very low	29.8	Very low	137 Å²	137	149.8 Å²	149.8	84%	0.84	78%	0.779	S	S	*	*			trans	-105	106.4	161.9	35.7	0	0	0	0	110.6
302	R	30.1	Very low	30	Very low	243 Å²	243	147.9 Å²	147.9	92%	0.917	78%	0.777	S	S	*	*			trans	-71.6	128.9	168.4	-84	179.4	166.6	176.3	-4.7	110.6
303	R	30.3	Very low	30	Very low	242 Å²	242	149.5 Å²	149.5	91%	0.913	78%	0.777	S	S	*	*			trans	-138.1	137.8	136.8	-72.9	-164.2	178.1	-168.1	-0.1	108.7
304	P	29.1	Very low	30.1	Very low	117 Å²	117	151.9 Å²	151.9	76%	0.76	78%	0.784	S	S	*	*			trans	-88.8	150.1	-178.6	35.2	-34	0	0	0	111.8
305	F	31.5	Very low	30.1	Very low	201 Å²	201	149.7 Å²	149.7	88%	0.882	78%	0.777	S	S	*	*			trans	-151.1	167.2	145.6	-113.4	-76.9	0	0	0	110.3
306	N	31.3	Very low	30.3	Very low	142 Å²	142	148.7 Å²	148.7	76%	0.759	77%	0.768	S	S	*	*			trans	-76.4	173.7	-153.6	-79.7	-19.4	0	0	0	118
307	S	32.2	Very low	30.4	Very low	99 Å²	99	148 Å²	148	69%	0.692	76%	0.76	S	S	*	*			trans	86	97.7	143.7	52.4	0	0	0	0	121
308	N	30.6	Very low	30.6	Very low	141 Å²	141	149 Å²	149	75%	0.754	75%	0.754	S	S	*	*				73.9	141.9	121.2	-63.9	9	0	0	0	121.8
309	H	33.9	Very low	30.5	Very low	159 Å²	159	149.6 Å²	149.6	74%	0.736	75%	0.752	S	S	*	*			trans	66.6	148.8	167.2	-62.2	-57	0	0	0	117
310	N	30.2	Very low	30.4	Very low	122 Å²	122	147.7 Å²	147.7	65%	0.652	75%	0.746	S	S	*	*			cis	-179.1	153.1	-35.4	-110.2	14	0	0	0	105.3
311	N	31.6	Very low	30	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	75%	0.749	S	S	*	*			trans	66	159.8	168.2	-52.5	2.3	0	0	0	116.1
312	S	30	Very low	29.9	Very low	89 Å²	89	147.4 Å²	147.4	62%	0.622	75%	0.747	S	S	*	*			cis	-165.5	151.8	-40.4	57.1	0	0	0	0	110.3
313	D	29.7	Very low	29.6	Very low	141 Å²	141	142.2 Å²	142.2	75%	0.754	74%	0.742	S	S	*	*			trans	67	171.6	152.8	-49.3	-36.6	0	0	0	121.9
314	E	31.8	Very low	29.7	Very low	185 Å²	185	138.3 Å²	138.3	86%	0.864	74%	0.738	S	S	*	*			trans	62.7	109.1	177	-54.4	-169	158.7	0	0	116.6
315	I	27.5	Very low	29.5	Very low	151 Å²	151	138.6 Å²	138.6	77%	0.774	73%	0.733	S	S	*	*			cis	82.3	88.7	24.6	-45.8	176.2	0	0	0	116.1
316	E	30.7	Very low	29.5	Very low	124 Å²	124	133.6 Å²	133.6	58%	0.579	73%	0.729	S	S	*	*				-163.3	151.4	123.4	-88.5	-60.7	89.5	0	0	106.6	Y318	E316-Y318 WeakPolarHBondContact OE2-CD2 3.26Å; E316-Y318 VanDerWaalsContact OE2-CE2 3.3Å; E316-Y318 WeakPolarHBondContact OE2-CE2 3.31Å
317	K	27.5	Very low	29.2	Very low	128 Å²	128	135 Å²	135	56%	0.557	73%	0.728	S	S	*	*			cis	104.4	151.2	8	-173.7	166.1	130.6	-80.7	0	114.8
318	Y	30.7	Very low	29.1	Very low	171 Å²	171	140.1 Å²	140.1	67%	0.671	74%	0.738	S	S	*	*			trans	67.9	141.2	-175.1	-61.1	-66.2	0	0	0	117	E316	E316-Y318 WeakPolarHBondContact OE2-CD2 3.26Å; E316-Y318 VanDerWaalsContact OE2-CE2 3.3Å; E316-Y318 WeakPolarHBondContact OE2-CE2 3.31Å
319	D	29.3	Very low	29	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	74%	0.735	S	S	*	*			cis	-151.6	178	-21.6	-148.4	-19.1	0	0	0	111.4
320	T	25.5	Very low	28.7	Very low	110 Å²	110	138.7 Å²	138.7	68%	0.675	74%	0.743	S	S	*	*			trans	-107.3	150.8	-173.9	46.6	0	0	0	0	114.7
321	T	25.6	Very low	28.6	Very low	135 Å²	135	138.3 Å²	138.3	83%	0.828	75%	0.747	S	S	*	*			trans	58.6	116.6	157.5	50.5	0	0	0	0	120
322	S	28.1	Very low	28.4	Very low	114 Å²	114	141 Å²	141	80%	0.797	75%	0.752	S	S	*	*			trans	-140.3	144.3	140.7	63.7	0	0	0	0	110.2
323	V	24.8	Very low	28.2	Very low	134 Å²	134	145.8 Å²	145.8	81%	0.812	76%	0.761	S	S	*	*			trans	-108.1	132.2	-179.9	173.9	0	0	0	0	108.6
324	I	31.9	Very low	28.2	Very low	160 Å²	160	146.8 Å²	146.8	82%	0.821	76%	0.761	S	S	*	*			trans	-127.3	118.2	165.5	-61.3	-177.1	0	0	0	108.5
325	D	24.9	Very low	27.9	Very low	123 Å²	123	146.4 Å²	146.4	66%	0.658	76%	0.764	S	S	*	*			trans	-85.8	137.1	177.8	-157.2	1	0	0	0	109.3
326	A	32.1	Very low	27.9	Very low	95 Å²	95	148 Å²	148	79%	0.785	77%	0.766	S	S	*	*			trans	-139.8	71.7	-179.3	0	0	0	0	0	110.8	F328	A326-F328 PolarHBondContact O-N 3.19Å
327	K	25	Very low	27.8	Very low	172 Å²	172	150.5 Å²	150.5	75%	0.748	78%	0.775	S	S	*	*			trans	-67.7	121	172.5	-72.3	170.9	-177.1	155.9	0	110.7
328	F	30.6	Very low	27.8	Very low	207 Å²	207	148.9 Å²	148.9	91%	0.908	79%	0.785	S	S	*	*			trans	-134.8	137.8	144.7	-114.8	-85.5	0	0	0	110.3	A326	A326-F328 PolarHBondContact O-N 3.19Å
329	S	26.7	Very low	27.7	Very low	98 Å²	98	146.7 Å²	146.7	69%	0.685	79%	0.79	S	S	*	*			trans	-103	149.6	-175.9	49.9	0	0	0	0	111.1
330	L	28.9	Very low	27.9	Very low	171 Å²	171	144.4 Å²	144.4	90%	0.895	78%	0.782	S	S	*	*			trans	-178.6	168.3	148.7	-94.3	158.6	0	0	0	107.8
331	P	27.9	Very low	28.1	Very low	115 Å²	115	146.4 Å²	146.4	75%	0.747	78%	0.784	S	S	*	*				-106.7	167.1	-122.7	39.5	-38.6	0	0	0	117.6
332	K	26.8	Very low	28.8	Very low	201 Å²	201	146.1 Å²	146.1	87%	0.874	77%	0.771	S	S	*	*			trans	-53.2	127.4	175.9	-56.5	166.2	-179.6	172.7	0	113.9
333	K	27.1	Very low	29	Very low	191 Å²	191	146.7 Å²	146.7	83%	0.83	77%	0.765	S	S	*	*			trans	-174.1	164.1	136.2	-104.6	161.8	-176	179.6	0	111.3
334	E	27.8	Very low	29.2	Very low	161 Å²	161	148.4 Å²	148.4	75%	0.752	77%	0.766	S	S	*	*			trans	47.6	77.4	170.2	-52.9	-37.4	103	0	0	119
335	L	26.2	Very low	29.2	Very low	177 Å²	177	146.4 Å²	146.4	93%	0.927	76%	0.763	S	S	*	*			trans	-131.4	86	153.4	-160.5	81.6	0	0	0	110.8
336	K	27.3	Very low	29.6	Very low	185 Å²	185	147.8 Å²	147.8	80%	0.804	77%	0.769	S	S	*	*			trans	-134.6	104.3	172.2	-88.6	-166.5	171.5	-169.1	0	111
337	F	28.9	Very low	29.7	Very low	176 Å²	176	150.8 Å²	150.8	77%	0.772	77%	0.771	S	S	*	*			trans	-141	150.9	163.5	-91	-77.8	0	0	0	111	I571	F337-I571 HydrophobicContact CE1-CD1 3.92Å; F337-I571 HydrophobicContact CE1-CG1 4.2Å; F337-I571 HydrophobicContact CE2-CD1 4.02Å; F337-I571 HydrophobicContact CZ-CD1 3.37Å; F337-I571 HydrophobicContact CZ-CG1 4Å
338	A	27.5	Very low	30	Very low	94 Å²	94	148.1 Å²	148.1	78%	0.777	76%	0.764	S	S	*	*			trans	60.1	61.9	162.4	0	0	0	0	0	118.6
339	V	29.3	Very low	30	Very low	125 Å²	125	147.8 Å²	147.8	76%	0.758	76%	0.757	S	S	*	*			trans	-131.3	117.9	138.6	-177.1	0	0	0	0	107.9
340	P	32.7	Very low	30.4	Very low	88 Å²	88	153.5 Å²	153.5	57%	0.571	76%	0.764	S	S	*	*			trans	-79	124.3	177.1	32.6	-34.5	0	0	0	110.3	F342	P340-F342 HydrophobicContact CB-CD1 3.94Å; P340-F342 HydrophobicContact CB-CE1 4.16Å; P340-F342 HydrophobicContact CG-CD1 4.03Å; P340-F342 HydrophobicContact CG-CE1 3.79Å; P340-F342 PolarHBondContact O-N 3.5Å
341	E	29.8	Very low	30.6	Very low	152 Å²	152	150 Å²	150	71%	0.71	75%	0.75	S	S	*	*	S	Bend	trans	-73.8	17.6	-165.2	-64.4	-178.4	130.8	0	0	115.9	L343	E341-L343 VanDerWaalsContact C-N 3.28Å; E341-L343 PolarHBondContact O-N 2.95Å
342	F	40.5	Very low	30.8	Very low	129 Å²	129	149.1 Å²	149.1	57%	0.566	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	2.3	-174.6	76.4	-89.4	0	0	0	115.6	L281 P340	L281-F342 HydrophobicContact CD1-CE2 4.46Å; L281-F342 HydrophobicContact CD2-CE2 4.4Å; L281-F342 HydrophobicContact CD2-CZ 4.17Å; L281-F342 HydrophobicContact CG-CE2 4.48Å; P340-F342 HydrophobicContact CB-CD1 3.94Å; P340-F342 HydrophobicContact CB-CE1 4.16Å; P340-F342 HydrophobicContact CG-CD1 4.03Å; P340-F342 HydrophobicContact CG-CE1 3.79Å; P340-F342 PolarHBondContact O-N 3.5Å
343	L	33.1	Very low	31	Very low	126 Å²	126	144.5 Å²	144.5	66%	0.66	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	15.7	-176.5	-89.3	165.4	0	0	0	115.1	E341	E341-L343 VanDerWaalsContact C-N 3.28Å; E341-L343 PolarHBondContact O-N 2.95Å
344	M	28.7	Very low	31.3	Very low	170 Å²	170	143.4 Å²	143.4	84%	0.837	74%	0.737	S	S	*	*			trans	-126.7	95	164.1	-74.7	-172.7	167.6	0	0	108.5
345	P	31.6	Very low	31.5	Very low	118 Å²	118	142.3 Å²	142.3	77%	0.766	74%	0.735	S	S	*	*				-149	99.9	85.9	35.1	-15	0	0	0	114.3
346	I	33.6	Very low	31.8	Very low	153 Å²	153	140.1 Å²	140.1	79%	0.785	73%	0.728	S	S	*	*			trans	-132.4	34.7	172.6	-44.8	-178.5	0	0	0	110.5
347	I	33.1	Very low	32	Very low	158 Å²	158	138.2 Å²	138.2	81%	0.81	73%	0.727	S	S	*	*	S	Bend	trans	-132	122	175.9	-60	-177.6	0	0	0	108.7
348	D	32.2	Very low	32	Very low	115 Å²	115	136.3 Å²	136.3	62%	0.615	72%	0.724	S	S	*	*			trans	-57	139.5	180	178	15.7	0	0	0	111.6	R350	D348-R350 PolarHBondContact OD1-N 3.05Å
349	R	30.6	Very low	32.1	Very low	201 Å²	201	141.2 Å²	141.2	76%	0.758	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-87.7	-2	-171	-139.9	173.3	-175.7	-163.6	-2.1	113.6	T351	R349-T351 VanDerWaalsContact C-N 3.3Å; R349-T351 PolarHBondContact O-N 3.1Å
350	R	34.1	Very low	32.3	Very low	217 Å²	217	143.9 Å²	143.9	82%	0.819	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-70.1	-10.9	-178	-83.1	-177.7	165	172.2	-2.2	116.4	D348	D348-R350 PolarHBondContact OD1-N 3.05Å
351	T	34.5	Very low	32.3	Very low	98 Å²	98	146.5 Å²	146.5	60%	0.601	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-99.1	-4.8	-179.5	40.6	0	0	0	0	115	R349 S353 I355	R349-T351 VanDerWaalsContact C-N 3.3Å; R349-T351 PolarHBondContact O-N 3.1Å; T351-S353 PolarHBondContact O-N 3.11Å; T351-I355 WeakPolarHBondContact O-CD1 3.34Å
352	S	30.6	Very low	32.5	Very low	96 Å²	96	143.3 Å²	143.3	67%	0.671	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-4.9	-171.4	-167.1	0	0	0	0	115.7
353	S	31	Very low	32.3	Very low	105 Å²	105	143.8 Å²	143.8	73%	0.734	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-1.2	-174.6	54.7	0	0	0	0	115.2	T351	T351-S353 PolarHBondContact O-N 3.11Å
354	Q	33.8	Very low	32.6	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	74%	0.744	S	S	*	*	S	Bend	trans	-114.3	-4.3	178.8	-65.7	-170.1	-6.4	0	0	114.3	V356	Q354-V356 PolarHBondContact O-N 3.21Å
355	I	31.5	Very low	33.2	Very low	138 Å²	138	137.8 Å²	137.8	71%	0.708	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	46.1	-172.5	-42.8	178.7	0	0	0	111.4	T351	T351-I355 WeakPolarHBondContact O-CD1 3.34Å
356	V	33.6	Very low	33.5	Very low	130 Å²	130	137.7 Å²	137.7	79%	0.788	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	-20.8	171.1	179	0	0	0	0	111.6	Q354	Q354-V356 PolarHBondContact O-N 3.21Å
357	N	30.5	Very low	33.8	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	72%	0.716	S	S	*	*	S	Bend	trans	-122.1	92.3	172.7	-84.3	-41.2	0	0	0	110.4
358	L	30.6	Very low	34.4	Very low	136 Å²	136	133.9 Å²	133.9	71%	0.712	70%	0.704	S	S	*	*			trans	-167.4	81.3	154.1	-107.4	165.4	0	0	0	110.3	I361	L358-I361 HydrophobicContact CD1-CD1 4.19Å; L358-I361 HydrophobicContact CD2-CD1 4.09Å
359	K	29.6	Very low	34.9	Very low	197 Å²	197	134.6 Å²	134.6	86%	0.857	70%	0.703	S	S	*	*			trans	-66.2	146.4	150.9	-75.4	-179.5	176.6	176.9	0	107.3
360	Q	31.5	Very low	35.3	Very low	180 Å²	180	129.6 Å²	129.6	84%	0.841	69%	0.692	S	S	*	*			trans	68.4	114.1	-176.1	-51.5	172.1	-48	0	0	115
361	I	33.3	Very low	35.9	Very low	143 Å²	143	126.8 Å²	126.8	73%	0.733	69%	0.686	S	S	*	*			trans	-157.2	155.6	145.3	-101.7	154	0	0	0	106.8	L358	L358-I361 HydrophobicContact CD1-CD1 4.19Å; L358-I361 HydrophobicContact CD2-CD1 4.09Å
362	S	33.8	Very low	36.5	Very low	86 Å²	86	126.9 Å²	126.9	60%	0.601	68%	0.682	S	S	*	*			trans	-99.4	179.7	-151.7	58.7	0	0	0	0	116.5	S364	S362-S364 PolarHBondContact O-N 3.14Å
363	V	36.8	Very low	37.4	Very low	138 Å²	138	127.4 Å²	127.4	84%	0.836	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	6.4	-162.7	-175.4	0	0	0	0	115.6
364	S	39.5	Very low	38.4	Very low	85 Å²	85	130.2 Å²	130.2	59%	0.594	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-20.6	-174.9	54.6	0	0	0	0	115.3	S362	S362-S364 PolarHBondContact O-N 3.14Å
365	T	41.1	Very low	38.8	Very low	85 Å²	85	131.1 Å²	131.1	52%	0.521	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.1	-29.3	-174.1	33.5	0	0	0	0	115.1	N367 I368	T365-N367 PolarHBondContact O-N 3.41Å; T365-I368 PolarHBondContact O-N 3.45Å; T365-I368 VanDerWaalsContact O-N 3.08Å
366	L	38.4	Very low	39.5	Very low	116 Å²	116	134 Å²	134	61%	0.607	67%	0.674	S	S	*	*	H	α-helix	trans	-59.5	-22	-177.2	-110.6	90.3	0	0	0	114.3	I368 N370	L366-I368 VanDerWaalsContact C-N 3.35Å; L366-N370 PolarHBondContact O-ND2 3.34Å
367	N	40.5	Very low	40.3	Very low	124 Å²	124	134.6 Å²	134.6	66%	0.663	67%	0.666	S	S	*	*	H	α-helix	trans	-81.5	-14	-178.1	-122.3	-27.9	0	0	0	113.3	T365	T365-N367 PolarHBondContact O-N 3.41Å
368	I	45.5	Very low	41.4	Very low	107 Å²	107	131.2 Å²	131.2	55%	0.549	65%	0.651	S	S	.	*	H	α-helix	trans	-84.8	-44.5	179.2	-59.7	179.3	0	0	0	110.5	T365 L366 N370 K371 L372	T365-I368 PolarHBondContact O-N 3.45Å; T365-I368 VanDerWaalsContact O-N 3.08Å; L366-I368 VanDerWaalsContact C-N 3.35Å; I368-N370 VanDerWaalsContact C-N 3.32Å; I368-N370 PolarHBondContact O-N 3.13Å; I368-K371 PolarHBondContact O-N 3.26Å; I368-K371 VanDerWaalsContact O-N 3.15Å; I368-L372 HydrophobicContact CG2-CD1 4.12Å; I368-L372 WeakPolarHBondContact O-CG 3.4Å; I368-L372 PolarHBondContact O-N 3.26Å
369	E	41.2	Very low	42.6	Very low	130 Å²	130	130.3 Å²	130.3	61%	0.607	65%	0.645	S	S	*	*	H	α-helix	trans	-59.6	-42	177	-65.9	-164.4	114.7	0	0	112.1	K371 L372 L373	E369-K371 VanDerWaalsContact C-N 3.33Å; E369-K371 PolarHBondContact O-N 3.44Å; E369-L372 PolarHBondContact O-N 2.9Å; E369-L372 VanDerWaalsContact O-N 3.13Å; E369-L373 PolarHBondContact O-N 2.9Å
370	N	40.3	Very low	43.4	Very low	97 Å²	97	128.7 Å²	128.7	52%	0.519	64%	0.638	S	S	.	*	H	α-helix	trans	-63.8	-34.2	176.7	-80.2	-64.1	0	0	0	113.3	L366 I368 K374	L366-N370 PolarHBondContact O-ND2 3.34Å; I368-N370 VanDerWaalsContact C-N 3.32Å; I368-N370 PolarHBondContact O-N 3.13Å; N370-K374 PolarHBondContact O-N 3.26Å; N370-K374 VanDerWaalsContact O-N 3.13Å
371	K	47.2	Very low	44.3	Very low	158 Å²	158	125.6 Å²	125.6	69%	0.687	62%	0.624	S	S	*	*	H	α-helix	trans	-68.6	-38.7	171.4	-83	-178.4	173.8	177.8	0	112.1	I368 E369 R375	I368-K371 PolarHBondContact O-N 3.26Å; I368-K371 VanDerWaalsContact O-N 3.15Å; E369-K371 VanDerWaalsContact C-N 3.33Å; E369-K371 PolarHBondContact O-N 3.44Å; K371-R375 PolarHBondContact O-N 2.93Å; K371-R375 VanDerWaalsContact O-N 3.14Å
372	L	47	Very low	44.8	Very low	100 Å²	100	127.1 Å²	127.1	52%	0.524	62%	0.62	S	S	.	*	H	α-helix	trans	-69.9	-38.1	176.9	-68.4	170.9	0	0	0	112.3	I368 E369 R375 R376	I368-L372 HydrophobicContact CG2-CD1 4.12Å; I368-L372 WeakPolarHBondContact O-CG 3.4Å; I368-L372 PolarHBondContact O-N 3.26Å; E369-L372 PolarHBondContact O-N 2.9Å; E369-L372 VanDerWaalsContact O-N 3.13Å; L372-R375 PolarHBondContact O-N 3.43Å; L372-R376 PolarHBondContact O-N 2.78Å
373	L	48.7	Very low	45.2	Very low	107 Å²	107	129.5 Å²	129.5	56%	0.56	62%	0.62	S	S	*	*	H	α-helix	trans	-64.4	-41.5	173.7	-104.1	121.2	0	0	0	112.4	E369 R376 K377	E369-L373 PolarHBondContact O-N 2.9Å; L373-R376 PolarHBondContact O-N 3.15Å; L373-K377 PolarHBondContact O-N 3.35Å; L373-K377 VanDerWaalsContact O-N 3.14Å
374	K	51.4	Low	45.5	Very low	164 Å²	164	131 Å²	131	71%	0.713	62%	0.615	S	S	*	*	H	α-helix	trans	-59.2	-50.3	171.9	-87.3	-171.1	172.3	-177	0	111.4	N370 R376 K377 T378	N370-K374 PolarHBondContact O-N 3.26Å; N370-K374 VanDerWaalsContact O-N 3.13Å; K374-R376 VanDerWaalsContact C-N 3.33Å; K374-R376 PolarHBondContact O-N 3.1Å; K374-K377 PolarHBondContact O-N 2.84Å; K374-K377 VanDerWaalsContact O-N 3.13Å; K374-T378 PolarHBondContact O-N 2.92Å; K374-T378 PolarHBondContact O-OG1 3.03Å
375	R	43	Very low	45.7	Very low	187 Å²	187	133.6 Å²	133.6	71%	0.706	62%	0.618	S	S	*	*	H	α-helix	trans	-58.5	-40	176.9	-78.3	-174.7	168.3	-171.3	-4.8	112.9	K371 L372 K377 T378 I379	K371-R375 PolarHBondContact O-N 2.93Å; K371-R375 VanDerWaalsContact O-N 3.14Å; L372-R375 PolarHBondContact O-N 3.43Å; R375-K377 VanDerWaalsContact C-N 3.35Å; R375-K377 PolarHBondContact O-N 2.85Å; R375-T378 PolarHBondContact O-N 3.46Å; R375-I379 WeakPolarHBondContact O-CG1 3.08Å; R375-I379 PolarHBondContact O-N 3.42Å; R375-I379 VanDerWaalsContact O-N 3.11Å
376	R	46.5	Very low	45.7	Very low	199 Å²	199	136.4 Å²	136.4	75%	0.751	63%	0.629	S	S	*	*	H	α-helix	trans	-62.9	-34.5	175.9	-81.2	-177.1	170.5	-178.5	-2	113.4	L372 L373 K374 K380	L372-R376 PolarHBondContact O-N 2.78Å; L373-R376 PolarHBondContact O-N 3.15Å; K374-R376 VanDerWaalsContact C-N 3.33Å; K374-R376 PolarHBondContact O-N 3.1Å; R376-K380 WeakPolarHBondContact O-CB 3.37Å; R376-K380 PolarHBondContact O-N 3.05Å
377	K	50.5	Low	45.9	Very low	141 Å²	141	137.5 Å²	137.5	61%	0.613	63%	0.631	S	S	*	*	H	α-helix	trans	-67.8	-50.2	172.7	-76.4	-167.3	173.8	-171.4	0	111.8	L373 K374 R375 I379 K380 E381	L373-K377 PolarHBondContact O-N 3.35Å; L373-K377 VanDerWaalsContact O-N 3.14Å; K374-K377 PolarHBondContact O-N 2.84Å; K374-K377 VanDerWaalsContact O-N 3.13Å; R375-K377 VanDerWaalsContact C-N 3.35Å; R375-K377 PolarHBondContact O-N 2.85Å; K377-I379 VanDerWaalsContact C-N 3.29Å; K377-I379 PolarHBondContact O-N 3Å; K377-K380 WeakPolarHBondContact O-CA 3.24Å; K377-K380 PolarHBondContact O-N 2.95Å; K377-E381 PolarHBondContact O-N 3.25Å
378	T	52.4	Low	45.9	Very low	76 Å²	76	136 Å²	136	47%	0.466	63%	0.63	S	S	.	*	H	α-helix	trans	-59.8	-37.2	-177.7	-41.2	0	0	0	0	112.9	K374 R375 R382	K374-T378 PolarHBondContact O-N 2.92Å; K374-T378 PolarHBondContact O-OG1 3.03Å; R375-T378 PolarHBondContact O-N 3.46Å; T378-R382 PolarHBondContact O-N 3.41Å
379	I	56.5	Low	45.6	Very low	117 Å²	117	137.7 Å²	137.7	60%	0.6	64%	0.64	S	S	*	*	H	α-helix	trans	-66.1	-42.1	174.4	-67.2	167	0	0	0	110.8	R375 K377 E381 R382 F383	R375-I379 WeakPolarHBondContact O-CG1 3.08Å; R375-I379 PolarHBondContact O-N 3.42Å; R375-I379 VanDerWaalsContact O-N 3.11Å; K377-I379 VanDerWaalsContact C-N 3.29Å; K377-I379 PolarHBondContact O-N 3Å; I379-E381 VanDerWaalsContact C-N 3.31Å; I379-E381 PolarHBondContact O-N 3.03Å; I379-R382 PolarHBondContact O-N 2.72Å; I379-F383 WeakPolarHBondContact O-CB 3.47Å; I379-F383 PolarHBondContact O-N 2.68Å
380	K	45.7	Very low	45.6	Very low	162 Å²	162	142.4 Å²	142.4	70%	0.704	65%	0.654	S	S	*	*	H	α-helix	trans	-69.8	-26.9	-179.8	-156.9	173.3	-172.3	179.7	0	113	R376 K377 K384	R376-K380 WeakPolarHBondContact O-CB 3.37Å; R376-K380 PolarHBondContact O-N 3.05Å; K377-K380 WeakPolarHBondContact O-CA 3.24Å; K377-K380 PolarHBondContact O-N 2.95Å; K380-K384 PolarHBondContact O-N 3.29Å
381	E	51	Low	45.4	Very low	115 Å²	115	142.9 Å²	142.9	54%	0.537	66%	0.657	S	S	.	*	H	α-helix	trans	-77.8	-45	172.6	-75.2	160.9	-176.5	0	0	111.7	K377 I379 F383 K384 Q385	K377-E381 PolarHBondContact O-N 3.25Å; I379-E381 VanDerWaalsContact C-N 3.31Å; I379-E381 PolarHBondContact O-N 3.03Å; E381-F383 VanDerWaalsContact C-N 3.29Å; E381-F383 PolarHBondContact O-N 2.85Å; E381-K384 WeakPolarHBondContact O-CA 3.31Å; E381-K384 WeakPolarHBondContact O-CB 3.45Å; E381-K384 PolarHBondContact O-N 3.41Å; E381-Q385 PolarHBondContact O-N 2.98Å
382	R	44.7	Very low	45	Very low	176 Å²	176	137.2 Å²	137.2	66%	0.664	64%	0.643	S	S	*	*	H	α-helix	trans	-59.2	-38.8	171.9	-80.7	-173.2	168.7	-169	-4.8	112.6	T378 I379 K384 Q385 L386	T378-R382 PolarHBondContact O-N 3.41Å; I379-R382 PolarHBondContact O-N 2.72Å; R382-K384 VanDerWaalsContact C-N 3.26Å; R382-K384 PolarHBondContact O-N 3.07Å; R382-Q385 PolarHBondContact O-N 3.45Å; R382-L386 WeakPolarHBondContact O-CB 3.38Å; R382-L386 PolarHBondContact O-N 2.91Å
383	F	40.9	Very low	44.7	Very low	135 Å²	135	135.5 Å²	135.5	59%	0.592	64%	0.639	S	S	*	*	H	α-helix	trans	-70.1	-21.5	176	-150.6	-86.1	0	0	0	113.1	I379 E381 H387	I379-F383 WeakPolarHBondContact O-CB 3.47Å; I379-F383 PolarHBondContact O-N 2.68Å; E381-F383 VanDerWaalsContact C-N 3.29Å; E381-F383 PolarHBondContact O-N 2.85Å; F383-H387 AromaticContact CD1-CD2 3.99Å; F383-H387 AromaticContact CE1-CD2 3.61Å; F383-H387 AromaticContact CE1-NE2 3.79Å
384	K	43	Very low	44.4	Very low	169 Å²	169	138.4 Å²	138.4	74%	0.735	65%	0.647	S	S	*	*	H	α-helix	trans	-75.6	-41.9	168	-93.4	-167.4	167.3	-163.6	0	112.1	K380 E381 R382 H387	K380-K384 PolarHBondContact O-N 3.29Å; E381-K384 WeakPolarHBondContact O-CA 3.31Å; E381-K384 WeakPolarHBondContact O-CB 3.45Å; E381-K384 PolarHBondContact O-N 3.41Å; R382-K384 VanDerWaalsContact C-N 3.26Å; R382-K384 PolarHBondContact O-N 3.07Å; K384-H387 PolarHBondContact O-N 3.46Å
385	Q	44.6	Very low	43.8	Very low	141 Å²	141	137.4 Å²	137.4	66%	0.659	64%	0.643	S	S	*	*	H	α-helix	trans	-65.3	-44.9	177	-83.4	175.6	-50	0	0	112.1	E381 R382 H387 S388	E381-Q385 PolarHBondContact O-N 2.98Å; R382-Q385 PolarHBondContact O-N 3.45Å; Q385-H387 PolarHBondContact O-N 3.46Å; Q385-S388 WeakPolarHBondContact O-CB 3.13Å; Q385-S388 PolarHBondContact O-N 3.47Å
386	L	40.5	Very low	43.5	Very low	144 Å²	144	136.6 Å²	136.6	75%	0.754	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-10.2	178.4	-84.7	159.8	0	0	0	115.2	R382	R382-L386 WeakPolarHBondContact O-CB 3.38Å; R382-L386 PolarHBondContact O-N 2.91Å
387	H	42.6	Very low	43.2	Very low	139 Å²	139	133.1 Å²	133.1	64%	0.644	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	7.8	174.7	-97.8	-67.2	0	0	0	114	F383 K384 Q385	F383-H387 AromaticContact CD1-CD2 3.99Å; F383-H387 AromaticContact CE1-CD2 3.61Å; F383-H387 AromaticContact CE1-NE2 3.79Å; K384-H387 PolarHBondContact O-N 3.46Å; Q385-H387 PolarHBondContact O-N 3.46Å
388	S	41.1	Very low	42.8	Very low	91 Å²	91	134.8 Å²	134.8	64%	0.636	64%	0.644	S	S	*	*	S	Bend	trans	-87.6	-21.1	-177.6	-164	0	0	0	0	114.7	Q385	Q385-S388 WeakPolarHBondContact O-CB 3.13Å; Q385-S388 PolarHBondContact O-N 3.47Å
389	D	39.7	Very low	42.3	Very low	144 Å²	144	135.8 Å²	135.8	77%	0.77	65%	0.646	S	S	*	*	S	Bend	trans	-111.1	15.1	-160.3	-64.8	-24.4	0	0	0	115.1
390	Y	39.4	Very low	41.5	Very low	228 Å²	228	136.3 Å²	136.3	89%	0.894	65%	0.65	S	S	*	*			trans	-106.6	80.2	-176.7	-128.8	-93.2	0	0	0	113.7	G392	Y390-G392 PolarHBondContact O-N 2.92Å; Y390-G392 VanDerWaalsContact O-N 3.07Å
391	D	38.1	Very low	41.3	Very low	108 Å²	108	137.2 Å²	137.2	58%	0.578	65%	0.654	S	S	*	*			trans	-71.6	93.9	174.1	175.3	14.6	0	0	0	111.9	S393	D391-S393 VanDerWaalsContact CG-OG 3.25Å; D391-S393 PolarHBondContact O-N 2.92Å; D391-S393 VanDerWaalsContact O-N 3.17Å; D391-S393 WeakPolarHBondContact OD1-CB 3.46Å; D391-S393 PolarHBondContact OD1-N 2.94Å; D391-S393 PolarHBondContact OD1-OG 3.5Å; D391-S393 PolarHBondContact OD2-OG 3.31Å
392	G	38.2	Very low	40.8	Very low	39 Å²	39	138.4 Å²	138.4	40%	0.402	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.3	-6.5	178.9	0	0	0	0	0	115.9	Y390 K394 F395	Y390-G392 PolarHBondContact O-N 2.92Å; Y390-G392 VanDerWaalsContact O-N 3.07Å; G392-K394 VanDerWaalsContact C-N 3.33Å; G392-K394 PolarHBondContact O-N 2.97Å; G392-F395 PolarHBondContact O-N 3.26Å
393	S	39.7	Very low	40.2	Very low	63 Å²	63	139.6 Å²	139.6	44%	0.441	67%	0.674	S	S	.	*	H	α-helix	trans	-67.2	-29.5	-173.8	70.9	0	0	0	0	113.9	D391 N397	D391-S393 VanDerWaalsContact CG-OG 3.25Å; D391-S393 PolarHBondContact O-N 2.92Å; D391-S393 VanDerWaalsContact O-N 3.17Å; D391-S393 WeakPolarHBondContact OD1-CB 3.46Å; D391-S393 PolarHBondContact OD1-N 2.94Å; D391-S393 PolarHBondContact OD1-OG 3.5Å; D391-S393 PolarHBondContact OD2-OG 3.31Å; S393-N397 PolarHBondContact O-ND2 3.27Å
394	K	42.2	Very low	39.8	Very low	168 Å²	168	142.8 Å²	142.8	73%	0.73	69%	0.688	S	S	*	*	H	α-helix	trans	-78.7	-25.8	179.6	-76.9	179.3	178.7	169.6	0	114.2	G392	G392-K394 VanDerWaalsContact C-N 3.33Å; G392-K394 PolarHBondContact O-N 2.97Å
395	F	39.7	Very low	39.3	Very low	144 Å²	144	140.5 Å²	140.5	63%	0.632	69%	0.688	S	S	*	*	H	α-helix	trans	-71.6	-50.3	-178.5	-174.8	-106	0	0	0	111.4	G392 N397 K398 L399	G392-F395 PolarHBondContact O-N 3.26Å; F395-N397 PolarHBondContact O-N 3.05Å; F395-K398 PolarHBondContact O-N 3.49Å; F395-L399 HydrophobicContact CD1-CD1 4Å; F395-L399 HydrophobicContact CE1-CD1 3.45Å; F395-L399 VanDerWaalsContact CE1-CD1 3.45Å; F395-L399 HydrophobicContact CZ-CD1 3.82Å; F395-L399 PolarHBondContact O-N 2.95Å
396	W	35.8	Very low	38.7	Very low	170 Å²	170	138.5 Å²	138.5	64%	0.644	69%	0.689	S	S	*	*	H	α-helix	trans	-61.1	-39.8	-178.7	-82.3	97.9	0	0	0	113.7	K398 L399 N400	W396-K398 PolarHBondContact O-N 2.99Å; W396-L399 PolarHBondContact O-N 2.68Å; W396-N400 PolarHBondContact O-N 3.32Å
397	N	41.4	Very low	38.3	Very low	125 Å²	125	140 Å²	140	67%	0.668	69%	0.693	S	S	*	*	H	α-helix	trans	-68	-13.7	177.2	-78.6	-42.9	0	0	0	114.2	S393 F395	S393-N397 PolarHBondContact O-ND2 3.27Å; F395-N397 PolarHBondContact O-N 3.05Å
398	K	42.5	Very low	37.8	Very low	177 Å²	177	138.7 Å²	138.7	77%	0.77	69%	0.694	S	S	*	*	H	α-helix	trans	-90.9	-27.5	173.6	-159.2	173.2	-177.4	-177.3	0	112.7	F395 W396	F395-K398 PolarHBondContact O-N 3.49Å; W396-K398 PolarHBondContact O-N 2.99Å
399	L	41.8	Very low	37.2	Very low	96 Å²	96	142.7 Å²	142.7	50%	0.503	70%	0.703	S	S	.	*	H	α-helix	trans	-78.5	-40.8	174	-79.5	164.4	0	0	0	112.6	F395 W396 K401 N402	F395-L399 HydrophobicContact CD1-CD1 4Å; F395-L399 HydrophobicContact CE1-CD1 3.45Å; F395-L399 VanDerWaalsContact CE1-CD1 3.45Å; F395-L399 HydrophobicContact CZ-CD1 3.82Å; F395-L399 PolarHBondContact O-N 2.95Å; W396-L399 PolarHBondContact O-N 2.68Å; L399-K401 PolarHBondContact O-N 3.14Å; L399-N402 PolarHBondContact O-N 3.48Å
400	N	39.5	Very low	36.8	Very low	129 Å²	129	143.5 Å²	143.5	69%	0.69	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	5.9	-174.3	-102.9	7.2	0	0	0	116.2	W396	W396-N400 PolarHBondContact O-N 3.32Å
401	K	41.3	Very low	36.6	Very low	180 Å²	180	140.1 Å²	140.1	78%	0.783	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-15.2	177.4	-99.5	-171.8	172.5	-173.4	0	115.3	L399	L399-K401 PolarHBondContact O-N 3.14Å
402	N	40.4	Very low	36.1	Very low	141 Å²	141	141.2 Å²	141.2	75%	0.754	72%	0.719	S	S	*	*	S	Bend	trans	-111.6	16.3	-169.2	-69.3	15.3	0	0	0	114.5	L399	L399-N402 PolarHBondContact O-N 3.48Å
403	F	31.6	Very low	35.7	Very low	201 Å²	201	143.8 Å²	143.8	88%	0.882	73%	0.732	S	S	*	*			trans	-124.5	77.8	-179.4	-106.9	-93	0	0	0	113.5
404	K	32.9	Very low	35.4	Very low	201 Å²	201	147.6 Å²	147.6	87%	0.874	75%	0.752	S	S	*	*			trans	-155.2	144.4	162.3	-85.7	-169.5	177.3	-175.1	0	107.4
405	V	32.8	Very low	34.8	Very low	121 Å²	121	151.8 Å²	151.8	73%	0.733	76%	0.764	S	S	*	*			cis	-166.2	153.1	-21.5	109.1	0	0	0	0	106.4
406	S	30.8	Very low	34.5	Very low	100 Å²	100	150 Å²	150	70%	0.699	77%	0.769	S	S	*	*			trans	59.6	165.5	-176.8	28.7	0	0	0	0	114.1
407	E	31.9	Very low	34.2	Very low	176 Å²	176	152.9 Å²	152.9	82%	0.822	78%	0.779	S	S	*	*			cis	-149.8	118.5	14.3	-152.8	156.7	-147.3	0	0	106.3
408	V	32.7	Very low	33.7	Very low	111 Å²	111	151.3 Å²	151.3	67%	0.673	78%	0.779	S	S	*	*				69.6	113.9	70.8	-178.1	0	0	0	0	114.3
409	Q	29.7	Very low	33.1	Very low	174 Å²	174	148.8 Å²	148.8	81%	0.813	78%	0.783	S	S	*	*			trans	56.4	104.9	160.4	-69.4	168.5	-56.3	0	0	119.9
410	N	31.4	Very low	32.6	Very low	161 Å²	161	151 Å²	151	86%	0.861	79%	0.793	S	S	*	*				-161.1	173.3	128.5	-107.5	-44.7	0	0	0	112
411	L	33.5	Very low	32.1	Very low	158 Å²	158	149.5 Å²	149.5	83%	0.827	80%	0.798	S	S	*	*			trans	63.7	67.7	179.7	-67.1	112.5	0	0	0	117.5
412	S	29.5	Very low	31.7	Very low	130 Å²	130	147.3 Å²	147.3	91%	0.909	79%	0.794	S	S	*	*			trans	-94.6	61.3	159.3	60.4	0	0	0	0	112.4
413	S	28.9	Very low	31.2	Very low	94 Å²	94	145 Å²	145	66%	0.657	79%	0.789	S	S	*	*			trans	-160.4	68.1	-177.5	63.3	0	0	0	0	117.3
414	T	33.9	Very low	31.5	Very low	142 Å²	142	141.8 Å²	141.8	87%	0.871	78%	0.778	S	S	*	*			trans	-157.6	110.7	150.2	14.5	0	0	0	0	110.5
415	R	29.5	Very low	31.4	Very low	257 Å²	257	138.5 Å²	138.5	97%	0.97	77%	0.77	S	S	*	*			trans	-131.3	80.9	179.4	-171.9	-170.6	-176.4	-167.1	1.9	110.3
416	S	32	Very low	31.4	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	77%	0.773	S	S	*	*			trans	-134.9	138.7	176.4	49	0	0	0	0	111
417	R	29.4	Very low	31.6	Very low	230 Å²	230	144 Å²	144	87%	0.868	78%	0.779	S	S	*	*			trans	-67.9	142.7	172	-67.1	165.9	164.9	172.8	-9.5	109.8
418	S	32.1	Very low	31.7	Very low	93 Å²	93	143.2 Å²	143.2	65%	0.65	78%	0.775	S	S	*	*			trans	-148.4	103.6	146.3	59.5	0	0	0	0	109.8	M420	S418-M420 VanDerWaalsContact C-N 3.28Å; S418-M420 PolarHBondContact O-N 3.32Å
419	S	29.1	Very low	31.8	Very low	124 Å²	124	145.1 Å²	145.1	87%	0.867	78%	0.781	S	S	*	*			trans	-69.8	88.6	163.1	46.5	0	0	0	0	108.2	A421	S419-A421 PolarHBondContact O-N 3.25Å; S419-A421 VanDerWaalsContact O-N 3.15Å
420	M	30.9	Very low	31.9	Very low	142 Å²	142	144.6 Å²	144.6	70%	0.7	78%	0.776	S	S	*	*			trans	-84.8	91.2	-174.4	-166.1	168	-80.4	0	0	110.4	S418 I422	S418-M420 VanDerWaalsContact C-N 3.28Å; S418-M420 PolarHBondContact O-N 3.32Å; M420-I422 HydrophobicContact CG-CD1 4.49Å; M420-I422 HydrophobicContact CG-CG1 3.81Å; M420-I422 PolarHBondContact O-N 3.38Å; M420-I422 HydrophobicContact SD-CG1 4.34Å
421	A	29	Very low	32.1	Very low	98 Å²	98	144.7 Å²	144.7	81%	0.81	78%	0.777	S	S	*	*			trans	-68.9	115	158.6	0	0	0	0	0	107.6	S419 S423	S419-A421 PolarHBondContact O-N 3.25Å; S419-A421 VanDerWaalsContact O-N 3.15Å; A421-S423 PolarHBondContact O-N 3.31Å
422	I	33.2	Very low	32.3	Very low	133 Å²	133	142.3 Å²	142.3	68%	0.682	77%	0.773	S	S	*	*			trans	-94.1	95.9	178	-59.3	177.2	0	0	0	108.1	M420 M424	M420-I422 HydrophobicContact CG-CD1 4.49Å; M420-I422 HydrophobicContact CG-CG1 3.81Å; M420-I422 PolarHBondContact O-N 3.38Å; M420-I422 HydrophobicContact SD-CG1 4.34Å; I422-M424 HydrophobicContact CG2-CG 4.18Å
423	S	31.4	Very low	32.6	Very low	94 Å²	94	142.9 Å²	142.9	66%	0.657	77%	0.771	S	S	*	*			trans	-71.7	128.1	154.1	48.7	0	0	0	0	108.2	A421 D425	A421-S423 PolarHBondContact O-N 3.31Å; S423-D425 PolarHBondContact O-N 3.32Å
424	M	36.5	Very low	32.9	Very low	133 Å²	133	143.9 Å²	143.9	66%	0.655	78%	0.778	S	S	*	*			trans	-92.2	81.6	174.5	-78.7	-177.9	58.3	0	0	110.1	I422 Y426	I422-M424 HydrophobicContact CG2-CG 4.18Å; M424-Y426 HydrophobicContact CE-CE2 4.12Å; M424-Y426 PolarHBondContact O-N 2.94Å
425	D	31.8	Very low	32.9	Very low	131 Å²	131	148.9 Å²	148.9	70%	0.701	78%	0.781	S	S	*	*			trans	-76	113.5	168.6	-75	-59.2	0	0	0	110.6	S423 T427	S423-D425 PolarHBondContact O-N 3.32Å; D425-T427 PolarHBondContact O-N 2.92Å
426	Y	31.7	Very low	33	Very low	202 Å²	202	142.6 Å²	142.6	79%	0.792	78%	0.776	S	S	*	*			trans	-78	97.6	172.7	-100.1	-92.7	0	0	0	110.1	M424	M424-Y426 HydrophobicContact CE-CE2 4.12Å; M424-Y426 PolarHBondContact O-N 2.94Å
427	T	34.7	Very low	33.3	Very low	134 Å²	134	142.2 Å²	142.2	82%	0.822	77%	0.774	S	S	*	*			trans	-101.7	117	164.9	41.8	0	0	0	0	110.3	D425	D425-T427 PolarHBondContact O-N 2.92Å
428	H	34.9	Very low	33.6	Very low	160 Å²	160	139.2 Å²	139.2	74%	0.741	78%	0.775	S	S	*	*			trans	-88.8	114.1	-173.9	-173.5	-26.4	0	0	0	109.2
429	N	34	Very low	33.7	Very low	152 Å²	152	141.5 Å²	141.5	81%	0.813	79%	0.785	S	S	*	*			trans	-111	136.4	164.7	-154.3	5.4	0	0	0	110.5
430	K	32.2	Very low	34.4	Very low	162 Å²	162	139.8 Å²	139.8	70%	0.704	77%	0.773	S	S	*	*			trans	-99.3	139.9	177.6	-67	170.1	179.9	169.1	0	107.4
431	D	36.5	Very low	35	Very low	164 Å²	164	136.5 Å²	136.5	88%	0.877	76%	0.764	S	S	*	*			trans	-151.6	157.9	142.5	-111.6	-35.8	0	0	0	112.6
432	S	36.3	Very low	36.1	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	76%	0.757	S	S	*	*			trans	-78.8	130.5	-156.8	58.1	0	0	0	0	116.1
433	V	37.5	Very low	37.3	Very low	143 Å²	143	136.8 Å²	136.8	87%	0.867	75%	0.753	S	S	*	*			trans	-139.6	128.6	134.4	-178.1	0	0	0	0	109.1
434	S	33.5	Very low	39	Very low	115 Å²	115	135.6 Å²	135.6	80%	0.804	74%	0.744	S	S	*	*			trans	-86.8	116.4	178.6	44.9	0	0	0	0	112.4
435	R	34.4	Very low	41.4	Very low	246 Å²	246	136.2 Å²	136.2	93%	0.928	74%	0.739	S	S	*	*			trans	-154.1	131	157.3	-115.9	169.5	-173.7	168.7	3	111.5
436	S	32	Very low	44.3	Very low	125 Å²	125	137.1 Å²	137.1	87%	0.874	73%	0.732	S	S	*	*			trans	-91.8	102.9	-170.9	53	0	0	0	0	112.6
437	S	38.1	Very low	47.2	Very low	99 Å²	99	128.1 Å²	128.1	69%	0.692	70%	0.698	S	S	*	*			trans	-160	121.8	164.4	55.2	0	0	0	0	111.2	T439	S437-T439 PolarHBondContact O-N 3.08Å
438	N	35.2	Very low	50.1	Low	167 Å²	167	123 Å²	123	89%	0.893	67%	0.667	S	S	*	*			trans	-26.5	98.1	-179.9	-59.1	-11.8	0	0	0	116.3	S440	N438-S440 PolarHBondContact O-N 2.62Å
439	T	34	Very low	53.1	Low	141 Å²	141	115.5 Å²	115.5	87%	0.865	63%	0.632	S	S	*	*			trans	-85.4	85.4	164.7	51.1	0	0	0	0	110	S437	S437-T439 PolarHBondContact O-N 3.08Å
440	S	44.2	Very low	56.1	Low	88 Å²	88	108.5 Å²	108.5	62%	0.615	59%	0.594	S	S	*	*			trans	-63.7	147.2	160.6	43.3	0	0	0	0	110.2	N438 D442	N438-S440 PolarHBondContact O-N 2.62Å; S440-D442 PolarHBondContact O-N 3.46Å
441	C	45	Very low	59.2	Low	73 Å²	73	100.8 Å²	100.8	49%	0.493	56%	0.561	S	S	.	*			trans	-72.3	86.6	176.6	-177.3	0	0	0	0	111.1	D443 C444	C441-D443 PolarHBondContact O-N 3Å; C441-C444 HydrophobicContact CB-CB 3.73Å; C441-C444 WeakPolarHBondContact CB-SG 3.05Å; C441-C444 VanDerWaalsContact O-CB 3.3Å; C441-C444 WeakPolarHBondContact O-CB 3.16Å; C441-C444 PolarHBondContact O-N 3.21Å; C441-C444 VanDerWaalsContact O-N 3.08Å; C441-C444 WeakPolarHBondContact SG-CB 3.44Å; C441-C444 PolarHBondContact SG-N 3.29Å; C441-C444 CovalentContact SG-SG 2.04Å; C441-C444 PolarHBondContact SG-SG 3.33Å
442	D	52	Low	62	Low	125 Å²	125	94.6 Å²	94.6	67%	0.668	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-64.8	-30.4	172	-84.1	-33.8	0	0	0	112	S440 C444 R445	S440-D442 PolarHBondContact O-N 3.46Å; D442-C444 PolarHBondContact O-N 3.02Å; D442-C444 VanDerWaalsContact O-N 3.1Å; D442-R445 WeakPolarHBondContact O-CB 3.25Å; D442-R445 PolarHBondContact O-N 3.35Å; D442-R445 VanDerWaalsContact O-N 3.09Å
443	D	57.7	Low	64.7	Low	112 Å²	112	92 Å²	92	60%	0.599	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-53.1	-28.2	168.8	-101.8	-18.7	0	0	0	112.9	C441 R445 T461	C441-D443 PolarHBondContact O-N 3Å; D443-R445 VanDerWaalsContact C-N 3.32Å; D443-R445 PolarHBondContact O-N 2.93Å; D443-T461 WeakPolarHBondContact OD1-CG2 3.45Å
444	C	67.7	Low	67.4	Low	69 Å²	69	88.3 Å²	88.3	47%	0.466	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-86.7	7.4	-177.1	-58.4	0	0	0	0	113.3	C441 D442 R446 W459	C441-C444 HydrophobicContact CB-CB 3.73Å; C441-C444 WeakPolarHBondContact CB-SG 3.05Å; C441-C444 VanDerWaalsContact O-CB 3.3Å; C441-C444 WeakPolarHBondContact O-CB 3.16Å; C441-C444 PolarHBondContact O-N 3.21Å; C441-C444 VanDerWaalsContact O-N 3.08Å; C441-C444 WeakPolarHBondContact SG-CB 3.44Å; C441-C444 PolarHBondContact SG-N 3.29Å; C441-C444 CovalentContact SG-SG 2.04Å; C441-C444 PolarHBondContact SG-SG 3.33Å; D442-C444 PolarHBondContact O-N 3.02Å; D442-C444 VanDerWaalsContact O-N 3.1Å; C444-R446 PolarHBondContact O-N 2.99Å; C444-W459 HydrophobicContact CB-CZ3 4.29Å; C444-W459 VanDerWaalsContact O-CZ3 3.26Å; C444-W459 WeakPolarHBondContact O-CZ3 3.36Å
445	R	86.7	Confident	70.4	Confident	145 Å²	145	88.5 Å²	88.5	55%	0.547	48%	0.482	S	S	.	.			trans	-72.2	112.1	-178	-173.6	169	-178.1	169.6	1.8	111.8	D442 D443 L460	D442-R445 WeakPolarHBondContact O-CB 3.25Å; D442-R445 PolarHBondContact O-N 3.35Å; D442-R445 VanDerWaalsContact O-N 3.09Å; D443-R445 VanDerWaalsContact C-N 3.32Å; D443-R445 PolarHBondContact O-N 2.93Å; R445-L460 HydrophobicContact CB-CB 4.34Å; R445-L460 HydrophobicContact CB-CD2 4.5Å; R445-L460 HydrophobicContact CG-CD2 4.46Å; R445-L460 WeakPolarHBondContact O-CB 3.48Å; R445-L460 PolarHBondContact O-N 3.31Å
446	R	92.1	Very high	73.3	Confident	150 Å²	150	78.1 Å²	78.1	57%	0.566	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	153.9	169.4	-66.9	-171.8	-178.1	-175.3	3	112.4	C444 T458 W459	C444-R446 PolarHBondContact O-N 2.99Å; R446-T458 CarbonylContact C-O 3.55Å; R446-T458 WeakPolarHBondContact CA-O 3.37Å; R446-W459 HydrophobicContact CG-CD2 4.16Å; R446-W459 HydrophobicContact CG-CE3 3.55Å; R446-W459 HydrophobicContact CG-CH2 4.32Å; R446-W459 HydrophobicContact CG-CZ3 3.65Å
447	I	93.3	Very high	76.3	Confident	14 Å²	14	77.2 Å²	77.2	7%	0.072	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130.1	173	-73.6	-178.8	0	0	0	109.3	I449 E457 T458 L460 Y488	I447-I449 HydrophobicContact CG2-CG1 4.04Å; I447-E457 WeakPolarHBondContact O-CA 3.46Å; I447-T458 PolarHBondContact N-O 3.19Å; I447-T458 PolarHBondContact O-N 3.42Å; I447-T458 VanDerWaalsContact O-N 3.1Å; I447-L460 HydrophobicContact CD1-CB 4.01Å; I447-L460 HydrophobicContact CD1-CD1 3.55Å; I447-L460 HydrophobicContact CD1-CG 4.25Å; I447-L460 HydrophobicContact CG1-CB 4.42Å; I447-Y488 HydrophobicContact CD1-CE2 4.09Å; I447-Y488 HydrophobicContact CG1-CE2 4.45Å; I447-Y488 HydrophobicContact CG2-CD2 3.54Å; I447-Y488 HydrophobicContact CG2-CE2 3.59Å
448	T	95.7	Very high	79	Confident	27 Å²	27	72.9 Å²	72.9	17%	0.166	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131	171.2	-48.4	0	0	0	0	109.6	K455 F456 E457 E487 Y488	T448-K455 HydrophobicContact CG2-CB 4.35Å; T448-K455 HydrophobicContact CG2-CD 4.03Å; T448-F456 CarbonylContact C-O 3.6Å; T448-F456 WeakPolarHBondContact CA-O 3.26Å; T448-E457 HydrophobicContact CG2-CG 4.1Å; T448-E457 PolarHBondContact OG1-OE1 3.45Å; T448-E487 HydrophobicContact CG2-CB 4.1Å; T448-E487 WeakPolarHBondContact O-CA 3.32Å; T448-Y488 PolarHBondContact O-N 3.38Å
449	I	96.7	Very high	81.8	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.3	175.5	-53.2	174.3	0	0	0	107.8	I447 V451 K455 F456 L463 L471 Y488 F490 F497	I447-I449 HydrophobicContact CG2-CG1 4.04Å; I449-V451 HydrophobicContact CG2-CG2 4.23Å; I449-K455 CarbonylContact O-C 3.58Å; I449-K455 WeakPolarHBondContact O-CA 3.46Å; I449-F456 PolarHBondContact N-O 3.11Å; I449-F456 PolarHBondContact O-N 2.96Å; I449-L463 HydrophobicContact CD1-CD1 4.34Å; I449-L471 HydrophobicContact CD1-CD1 4.15Å; I449-L471 HydrophobicContact CD1-CD2 4.19Å; I449-Y488 CarbonylContact C-O 3.55Å; I449-Y488 WeakPolarHBondContact CA-O 3.28Å; I449-F490 HydrophobicContact CG2-CD2 3.7Å; I449-F490 HydrophobicContact CG2-CE2 3.75Å; I449-F497 HydrophobicContact CB-CZ 4.38Å; I449-F497 HydrophobicContact CD1-CZ 4.08Å; I449-F497 HydrophobicContact CG2-CE1 4.18Å; I449-F497 HydrophobicContact CG2-CE2 4.43Å; I449-F497 HydrophobicContact CG2-CZ 3.73Å
450	N	97.1	Very high	84.6	Confident	6 Å²	6	64.3 Å²	64.3	3%	0.032	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	112	-177.9	-179.4	-4.3	0	0	0	109.9	G453 L454 K455 E487 Y488 F489 F490	N450-G453 WeakPolarHBondContact OD1-CA 3.3Å; N450-G453 PolarHBondContact OD1-N 3.43Å; N450-L454 WeakPolarHBondContact CA-O 3.18Å; N450-K455 HydrophobicContact CB-CG 4.37Å; N450-E487 HydrophobicContact CB-CG 4.08Å; N450-E487 PolarHBondContact ND2-OE1 2.86Å; N450-Y488 PolarHBondContact N-O 3.14Å; N450-F489 HydrophobicContact CB-CD2 4.21Å; N450-F489 WeakPolarHBondContact O-CA 3.37Å; N450-F489 WeakPolarHBondContact O-CD2 3.43Å; N450-F490 PolarHBondContact O-N 3.08Å
451	V	97.1	Very high	86.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	106.8	178.7	-173.3	0	0	0	0	109.3	I449 G453 L454 F456 F490 R492 R494 F497	I449-V451 HydrophobicContact CG2-CG2 4.23Å; V451-G453 PolarHBondContact O-N 2.98Å; V451-L454 PolarHBondContact N-O 3.14Å; V451-L454 WeakPolarHBondContact O-CB 3.26Å; V451-L454 PolarHBondContact O-N 3.17Å; V451-F456 HydrophobicContact CB-CE2 4.49Å; V451-F456 HydrophobicContact CG2-CD2 4.46Å; V451-F456 HydrophobicContact CG2-CE2 4.4Å; V451-F490 CarbonylContact C-O 3.57Å; V451-F490 VanDerWaalsContact CA-O 3.26Å; V451-F490 WeakPolarHBondContact CA-O 3.41Å; V451-F490 HydrophobicContact CG2-CB 4.35Å; V451-R492 HydrophobicContact CG1-CB 4.45Å; V451-R494 HydrophobicContact CG1-CG 4.36Å; V451-R494 WeakPolarHBondContact O-CG 3.38Å; V451-F497 HydrophobicContact CB-CB 4.45Å; V451-F497 HydrophobicContact CB-CG 4.41Å; V451-F497 HydrophobicContact CG1-CB 4.24Å; V451-F497 HydrophobicContact CG2-CB 4.09Å; V451-F497 HydrophobicContact CG2-CD1 3.72Å; V451-F497 HydrophobicContact CG2-CD2 3.72Å; V451-F497 HydrophobicContact CG2-CE1 4.02Å; V451-F497 HydrophobicContact CG2-CE2 4.02Å; V451-F497 HydrophobicContact CG2-CG 3.55Å; V451-F497 HydrophobicContact CG2-CZ 4.17Å
452	S	95	Very high	89.2	Confident	33 Å²	33	59.6 Å²	59.6	23%	0.231	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	38.7	43.7	-175.8	-53.6	0	0	0	0	114.2	F490 D491 R492 R494	S452-F490 PolarHBondContact N-O 3.31Å; S452-D491 WeakPolarHBondContact CB-OD1 3.48Å; S452-D491 VanDerWaalsContact OG-CA 3.32Å; S452-D491 WeakPolarHBondContact OG-CA 3.32Å; S452-D491 PolarHBondContact OG-OD1 3.38Å; S452-R492 PolarHBondContact OG-N 3.3Å; S452-R492 VanDerWaalsContact OG-N 3.08Å; S452-R492 PolarHBondContact OG-O 3.02Å; S452-R494 WeakPolarHBondContact O-CD 3.38Å; S452-R494 PolarHBondContact O-NH1 3.34Å
453	G	93.7	Very high	91.2	Very high	52 Å²	52	53.7 Å²	53.7	54%	0.536	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	-8.2	179	0	0	0	0	0	116.2	N450 V451	N450-G453 WeakPolarHBondContact OD1-CA 3.3Å; N450-G453 PolarHBondContact OD1-N 3.43Å; V451-G453 PolarHBondContact O-N 2.98Å
454	L	95	Very high	92.8	Very high	66 Å²	66	52.7 Å²	52.7	35%	0.346	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118	174	-175.8	59.4	0	0	0	110.1	N450 V451 F456 R494	N450-L454 WeakPolarHBondContact CA-O 3.18Å; V451-L454 PolarHBondContact N-O 3.14Å; V451-L454 WeakPolarHBondContact O-CB 3.26Å; V451-L454 PolarHBondContact O-N 3.17Å; L454-F456 HydrophobicContact CB-CE2 4.14Å; L454-F456 HydrophobicContact CD2-CE2 3.64Å; L454-F456 HydrophobicContact CD2-CZ 3.5Å; L454-F456 VanDerWaalsContact CD2-CZ 3.5Å; L454-F456 HydrophobicContact CG-CD2 4.35Å; L454-F456 HydrophobicContact CG-CE2 3.55Å; L454-F456 HydrophobicContact CG-CZ 3.84Å; L454-R494 HydrophobicContact CD2-CB 4.41Å
455	K	95.4	Very high	94	Very high	120 Å²	120	56.4 Å²	56.4	52%	0.522	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.1	-179.5	-58.8	-161.9	-177.5	-151.5	0	112.1	T448 I449 N450 E487	T448-K455 HydrophobicContact CG2-CB 4.35Å; T448-K455 HydrophobicContact CG2-CD 4.03Å; I449-K455 CarbonylContact O-C 3.58Å; I449-K455 WeakPolarHBondContact O-CA 3.46Å; N450-K455 HydrophobicContact CB-CG 4.37Å; K455-E487 WeakPolarHBondContact CE-OE2 3.39Å; K455-E487 IonicContact NZ-OE2 2.7Å; K455-E487 PolarHBondContact NZ-OE2 2.92Å
456	F	96.3	Very high	94.3	Very high	27 Å²	27	50.4 Å²	50.4	12%	0.118	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.7	172.7	-62.1	-98.2	0	0	0	108.3	T448 I449 V451 L454 F497 E498 F501	T448-F456 CarbonylContact C-O 3.6Å; T448-F456 WeakPolarHBondContact CA-O 3.26Å; I449-F456 PolarHBondContact N-O 3.11Å; I449-F456 PolarHBondContact O-N 2.96Å; V451-F456 HydrophobicContact CB-CE2 4.49Å; V451-F456 HydrophobicContact CG2-CD2 4.46Å; V451-F456 HydrophobicContact CG2-CE2 4.4Å; L454-F456 HydrophobicContact CB-CE2 4.14Å; L454-F456 HydrophobicContact CD2-CE2 3.64Å; L454-F456 HydrophobicContact CD2-CZ 3.5Å; L454-F456 VanDerWaalsContact CD2-CZ 3.5Å; L454-F456 HydrophobicContact CG-CD2 4.35Å; L454-F456 HydrophobicContact CG-CE2 3.55Å; L454-F456 HydrophobicContact CG-CZ 3.84Å; F456-F497 HydrophobicContact CB-CE1 4.2Å; F456-F497 HydrophobicContact CD1-CD1 4.18Å; F456-F497 HydrophobicContact CD1-CE1 4.34Å; F456-F497 AromaticContact CD2-CD1 3.51Å; F456-F497 HydrophobicContact CD2-CD1 3.51Å; F456-F497 AromaticContact CD2-CE1 3.7Å; F456-F497 HydrophobicContact CD2-CE1 3.7Å; F456-F497 HydrophobicContact CE1-CD1 4.11Å; F456-F497 HydrophobicContact CE2-CB 4.43Å; F456-F497 AromaticContact CE2-CD1 3.42Å; F456-F497 HydrophobicContact CE2-CD1 3.42Å; F456-F497 VanDerWaalsContact CE2-CD1 3.42Å; F456-F497 HydrophobicContact CE2-CE1 4.12Å; F456-F497 HydrophobicContact CE2-CG 4.3Å; F456-F497 AromaticContact CG-CD1 3.91Å; F456-F497 HydrophobicContact CG-CD1 3.91Å; F456-F497 AromaticContact CG-CE1 3.83Å; F456-F497 HydrophobicContact CG-CE1 3.83Å; F456-F497 HydrophobicContact CZ-CB 4.47Å; F456-F497 AromaticContact CZ-CD1 3.74Å; F456-F497 HydrophobicContact CZ-CD1 3.74Å; F456-E498 HydrophobicContact CE1-CB 4.47Å; F456-F501 HydrophobicContact CB-CD2 3.9Å; F456-F501 HydrophobicContact CB-CE2 3.73Å; F456-F501 HydrophobicContact CB-CG 4.41Å; F456-F501 HydrophobicContact CB-CZ 4.1Å; F456-F501 HydrophobicContact CD1-CB 4.27Å; F456-F501 AromaticContact CD1-CD1 3.9Å; F456-F501 HydrophobicContact CD1-CD1 3.9Å; F456-F501 HydrophobicContact CD1-CD2 4.23Å; F456-F501 HydrophobicContact CD1-CE1 4.24Å; F456-F501 AromaticContact CD1-CG 3.88Å; F456-F501 HydrophobicContact CD1-CG 3.88Å; F456-F501 HydrophobicContact CG-CD2 4.34Å; F456-F501 HydrophobicContact CG-CG 4.43Å
457	E	95.4	Very high	94.4	Very high	106 Å²	106	47 Å²	47	50%	0.495	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	131.1	177.9	-61.2	-158.7	155.5	0	0	111.4	I447 T448 F501	I447-E457 WeakPolarHBondContact O-CA 3.46Å; T448-E457 HydrophobicContact CG2-CG 4.1Å; T448-E457 PolarHBondContact OG1-OE1 3.45Å; E457-F501 WeakPolarHBondContact O-CZ 3.38Å
458	T	94.1	Very high	94.4	Very high	8 Å²	8	50.2 Å²	50.2	5%	0.049	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	168.7	177	-167.5	0	0	0	0	111.2	R446 I447 L463 F501	R446-T458 CarbonylContact C-O 3.55Å; R446-T458 WeakPolarHBondContact CA-O 3.37Å; I447-T458 PolarHBondContact N-O 3.19Å; I447-T458 PolarHBondContact O-N 3.42Å; I447-T458 VanDerWaalsContact O-N 3.1Å; T458-L463 HydrophobicContact CG2-CD1 4.1Å; T458-L463 HydrophobicContact CG2-CD2 3.95Å; T458-L463 HydrophobicContact CG2-CG 3.85Å; T458-F501 HydrophobicContact CG2-CE2 3.94Å
459	W	93.7	Very high	94.4	Very high	105 Å²	105	48.9 Å²	48.9	40%	0.398	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	141.1	171.1	-48.7	98.8	0	0	0	109.7	C444 R446 T461 V462	C444-W459 HydrophobicContact CB-CZ3 4.29Å; C444-W459 VanDerWaalsContact O-CZ3 3.26Å; C444-W459 WeakPolarHBondContact O-CZ3 3.36Å; R446-W459 HydrophobicContact CG-CD2 4.16Å; R446-W459 HydrophobicContact CG-CE3 3.55Å; R446-W459 HydrophobicContact CG-CH2 4.32Å; R446-W459 HydrophobicContact CG-CZ3 3.65Å; W459-T461 PolarHBondContact O-N 3.02Å; W459-V462 HydrophobicContact CB-CG2 4.2Å; W459-V462 WeakPolarHBondContact O-CB 3.36Å; W459-V462 PolarHBondContact O-N 3.07Å
460	L	92.9	Very high	94.4	Very high	23 Å²	23	49.2 Å²	49.2	12%	0.12	26%	0.255	C	S	.	.	H	α-helix	trans	-54.7	-41.6	177.8	170.1	57.5	0	0	0	111.5	R445 I447 V462 L463 E464 R477	R445-L460 HydrophobicContact CB-CB 4.34Å; R445-L460 HydrophobicContact CB-CD2 4.5Å; R445-L460 HydrophobicContact CG-CD2 4.46Å; R445-L460 WeakPolarHBondContact O-CB 3.48Å; R445-L460 PolarHBondContact O-N 3.31Å; I447-L460 HydrophobicContact CD1-CB 4.01Å; I447-L460 HydrophobicContact CD1-CD1 3.55Å; I447-L460 HydrophobicContact CD1-CG 4.25Å; I447-L460 HydrophobicContact CG1-CB 4.42Å; L460-V462 PolarHBondContact O-N 3.03Å; L460-V462 VanDerWaalsContact O-N 3.13Å; L460-L463 WeakPolarHBondContact O-CB 3.11Å; L460-L463 PolarHBondContact O-N 3.4Å; L460-E464 VanDerWaalsContact CD1-CD 3.49Å; L460-E464 HydrophobicContact CD1-CG 3.76Å; L460-E464 WeakPolarHBondContact CD1-OE1 3.49Å; L460-E464 HydrophobicContact CG-CG 4.2Å; L460-E464 PolarHBondContact O-N 2.91Å; L460-R477 VanDerWaalsContact CD1-NH2 3.33Å
461	T	92.5	Very high	94.3	Very high	44 Å²	44	49 Å²	49	27%	0.27	25%	0.254	S	S	.	.	H	α-helix	trans	-58.2	-22.6	176.5	54.4	0	0	0	0	114.3	D443 W459 R465	D443-T461 WeakPolarHBondContact OD1-CG2 3.45Å; W459-T461 PolarHBondContact O-N 3.02Å; T461-R465 WeakPolarHBondContact O-CG 3.38Å
462	V	93.4	Very high	94.1	Very high	18 Å²	18	49.2 Å²	49.2	11%	0.109	26%	0.256	C	S	.	.	H	α-helix	trans	-79.3	-32.6	175.1	173.4	0	0	0	0	111.4	W459 L460 Q505	W459-V462 HydrophobicContact CB-CG2 4.2Å; W459-V462 WeakPolarHBondContact O-CB 3.36Å; W459-V462 PolarHBondContact O-N 3.07Å; L460-V462 PolarHBondContact O-N 3.03Å; L460-V462 VanDerWaalsContact O-N 3.13Å; V462-Q505 HydrophobicContact CG1-CG 4.44Å
463	L	93.9	Very high	94.1	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-75.9	-40.6	174.2	-59.1	178	0	0	0	111.3	I449 T458 L460 R465 H466 L471 G472 Y504	I449-L463 HydrophobicContact CD1-CD1 4.34Å; T458-L463 HydrophobicContact CG2-CD1 4.1Å; T458-L463 HydrophobicContact CG2-CD2 3.95Å; T458-L463 HydrophobicContact CG2-CG 3.85Å; L460-L463 WeakPolarHBondContact O-CB 3.11Å; L460-L463 PolarHBondContact O-N 3.4Å; L463-R465 PolarHBondContact O-N 3.04Å; L463-R465 VanDerWaalsContact O-N 3.17Å; L463-H466 PolarHBondContact O-N 2.96Å; L463-H466 VanDerWaalsContact O-N 3.08Å; L463-L471 HydrophobicContact CD2-CB 4.19Å; L463-G472 WeakPolarHBondContact O-CA 3.4Å; L463-Y504 HydrophobicContact CD2-CD1 3.9Å; L463-Y504 HydrophobicContact CD2-CD2 4.15Å; L463-Y504 HydrophobicContact CD2-CE1 4.32Å; L463-Y504 HydrophobicContact CD2-CG 3.83Å
464	E	92.4	Very high	94	Very high	91 Å²	91	52.7 Å²	52.7	43%	0.425	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-8.7	-177.1	-68.4	-177.9	155	0	0	114.2	L460 H466 P467 R477	L460-E464 VanDerWaalsContact CD1-CD 3.49Å; L460-E464 HydrophobicContact CD1-CG 3.76Å; L460-E464 WeakPolarHBondContact CD1-OE1 3.49Å; L460-E464 HydrophobicContact CG-CG 4.2Å; L460-E464 PolarHBondContact O-N 2.91Å; E464-H466 PolarHBondContact O-N 2.71Å; E464-P467 WeakPolarHBondContact O-CD 3.42Å; E464-R477 IonicContact OE1-NH2 3.16Å; E464-R477 PolarHBondContact OE1-NH2 2.85Å; E464-R477 VanDerWaalsContact OE1-NH2 3.16Å
465	R	92.2	Very high	94	Very high	147 Å²	147	53.5 Å²	53.5	56%	0.555	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.2	166	-74.9	167.7	-174.8	-164.9	-4.3	113.6	T461 L463 P467	T461-R465 WeakPolarHBondContact O-CG 3.38Å; L463-R465 PolarHBondContact O-N 3.04Å; L463-R465 VanDerWaalsContact O-N 3.17Å; R465-P467 VanDerWaalsContact O-CD 3.31Å; R465-P467 WeakPolarHBondContact O-CD 3.33Å
466	H	93.6	Very high	94	Very high	18 Å²	18	51 Å²	51	8%	0.083	25%	0.245	C	C	.	.	S	Bend	trans	-119.7	63.7	179.7	-66.9	-79	0	0	0	110.1	L463 E464 T468 T469 G472 Y503 Y504 G508 E531	L463-H466 PolarHBondContact O-N 2.96Å; L463-H466 VanDerWaalsContact O-N 3.08Å; E464-H466 PolarHBondContact O-N 2.71Å; H466-T468 PolarHBondContact O-N 3.06Å; H466-T469 HydrophobicContact CB-CG2 3.94Å; H466-T469 PolarHBondContact O-N 3.33Å; H466-T469 PolarHBondContact O-OG1 2.97Å; H466-G472 WeakPolarHBondContact O-CA 3.33Å; H466-Y503 HydrophobicContact CB-CE1 4.39Å; H466-Y503 AromaticContact CE1-CZ 3.95Å; H466-Y503 AromaticContact CG-CE1 3.97Å; H466-Y503 AromaticContact ND1-CZ 3.79Å; H466-Y503 PolarHBondContact ND1-OH 3.33Å; H466-Y504 HydrophobicContact CB-CD1 4.09Å; H466-Y504 HydrophobicContact CB-CE1 3.91Å; H466-Y504 AromaticContact CD2-CD1 3.94Å; H466-G508 PolarHBondContact NE2-N 3.3Å; H466-E531 IonicContact CE1-OE2 2.81Å; H466-E531 IonicContact CG-OE1 2.71Å; H466-E531 IonicContact CG-OE2 3.99Å; H466-E531 IonicContact ND1-OE1 3.17Å; H466-E531 PolarHBondContact ND1-OE1 3.43Å; H466-E531 IonicContact ND1-OE2 3.89Å; H466-E531 PolarHBondContact ND1-OE2 3.45Å
467	P	93.2	Very high	93.9	Very high	80 Å²	80	50 Å²	50	52%	0.519	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-5.5	-166.9	31.3	-38.1	0	0	0	114	E464 R465	E464-P467 WeakPolarHBondContact O-CD 3.42Å; R465-P467 VanDerWaalsContact O-CD 3.31Å; R465-P467 WeakPolarHBondContact O-CD 3.33Å
468	T	93	Very high	93.8	Very high	80 Å²	80	50.8 Å²	50.8	49%	0.491	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-21.2	177.3	66.8	0	0	0	0	113.1	H466 K476 E531	H466-T468 PolarHBondContact O-N 3.06Å; T468-K476 PolarHBondContact O-NZ 3.4Å; T468-E531 WeakPolarHBondContact OG1-CG 3.48Å; T468-E531 PolarHBondContact OG1-OE1 3.37Å
469	T	95.8	Very high	93.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	-82	171.6	-173.7	78.9	0	0	0	0	112.7	H466 L471 G472 D473 Y503 Y504 Q529 E531	H466-T469 HydrophobicContact CB-CG2 3.94Å; H466-T469 PolarHBondContact O-N 3.33Å; H466-T469 PolarHBondContact O-OG1 2.97Å; T469-L471 VanDerWaalsContact C-N 3.29Å; T469-L471 PolarHBondContact O-N 2.99Å; T469-L471 PolarHBondContact OG1-N 2.88Å; T469-G472 PolarHBondContact O-N 3.34Å; T469-G472 PolarHBondContact OG1-N 3.42Å; T469-G472 VanDerWaalsContact OG1-N 3.07Å; T469-D473 PolarHBondContact O-N 3.38Å; T469-D473 VanDerWaalsContact O-N 3.11Å; T469-Y503 HydrophobicContact CG2-CE1 4.4Å; T469-Y504 VanDerWaalsContact CB-OH 3.31Å; T469-Y504 WeakPolarHBondContact CB-OH 3.42Å; T469-Y504 HydrophobicContact CG2-CE1 4.33Å; T469-Y504 WeakPolarHBondContact OG1-CE1 3.33Å; T469-Y504 PolarHBondContact OG1-OH 3.03Å; T469-Q529 WeakPolarHBondContact CA-O 3.42Å; T469-Q529 WeakPolarHBondContact CB-O 3.36Å; T469-Q529 WeakPolarHBondContact CG2-O 3.44Å; T469-E531 HydrophobicContact CG2-CG 4.28Å
470	L	96.2	Very high	93.9	Very high	8 Å²	8	53.4 Å²	53.4	4%	0.042	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-38	176.7	-172.2	153.4	0	0	0	112.2	K476 R477 F480 F490 F527 F528	L470-K476 HydrophobicContact CG-CB 4.31Å; L470-R477 PolarHBondContact O-N 2.98Å; L470-F480 HydrophobicContact CD1-CE2 4.05Å; L470-F480 HydrophobicContact CD1-CZ 4.37Å; L470-F480 HydrophobicContact CD2-CD2 4.21Å; L470-F480 HydrophobicContact CD2-CE2 4.09Å; L470-F480 HydrophobicContact CG-CE2 4.41Å; L470-F490 HydrophobicContact CD2-CE1 3.58Å; L470-F490 HydrophobicContact CD2-CZ 3.61Å; L470-F527 HydrophobicContact CD1-CD1 4.25Å; L470-F527 HydrophobicContact CD1-CE1 3.86Å; L470-F527 HydrophobicContact CD1-CZ 4.1Å; L470-F527 VanDerWaalsContact CD1-O 3.26Å; L470-F527 WeakPolarHBondContact CD1-O 3.34Å; L470-F528 WeakPolarHBondContact CB-O 3.5Å; L470-F528 HydrophobicContact CD2-CD1 4.27Å; L470-F528 PolarHBondContact N-O 3.06Å
471	L	95.5	Very high	94	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-23.3	-178.2	-62	176.7	0	0	0	113.3	I449 L463 T469 R477 F490 F497 Y504 F528	I449-L471 HydrophobicContact CD1-CD1 4.15Å; I449-L471 HydrophobicContact CD1-CD2 4.19Å; L463-L471 HydrophobicContact CD2-CB 4.19Å; T469-L471 VanDerWaalsContact C-N 3.29Å; T469-L471 PolarHBondContact O-N 2.99Å; T469-L471 PolarHBondContact OG1-N 2.88Å; L471-R477 WeakPolarHBondContact O-CD 3.36Å; L471-R477 PolarHBondContact O-NH1 3.18Å; L471-F490 HydrophobicContact CD2-CE2 3.76Å; L471-F490 HydrophobicContact CD2-CZ 3.65Å; L471-F497 HydrophobicContact CD1-CE2 3.92Å; L471-F497 HydrophobicContact CD1-CZ 3.87Å; L471-Y504 HydrophobicContact CB-CE1 4.32Å; L471-Y504 HydrophobicContact CB-CE2 4.43Å; L471-Y504 HydrophobicContact CD1-CE2 3.84Å; L471-F528 HydrophobicContact CD1-CD1 4.21Å; L471-F528 HydrophobicContact CD1-CE1 4.44Å; L471-F528 HydrophobicContact CD2-CD1 4.43Å; L471-F528 HydrophobicContact CD2-CE1 4.38Å; L471-F528 HydrophobicContact CG-CD1 4.08Å; L471-F528 HydrophobicContact CG-CE1 4.45Å
472	G	93.7	Very high	94.1	Very high	4 Å²	4	56.9 Å²	56.9	4%	0.041	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-42.2	175.9	0	0	0	0	0	113.4	L463 H466 T469 Y474 R477	L463-G472 WeakPolarHBondContact O-CA 3.4Å; H466-G472 WeakPolarHBondContact O-CA 3.33Å; T469-G472 PolarHBondContact O-N 3.34Å; T469-G472 PolarHBondContact OG1-N 3.42Å; T469-G472 VanDerWaalsContact OG1-N 3.07Å; G472-Y474 PolarHBondContact O-N 3.34Å; G472-R477 PolarHBondContact O-NH1 2.78Å
473	D	94.3	Very high	94.1	Very high	41 Å²	41	63.7 Å²	63.7	22%	0.219	31%	0.308	C	S	.	.	S	Bend	trans	-76.8	119.6	177.1	-174	-13.8	0	0	0	111.3	T469 N475 K476 R477	T469-D473 PolarHBondContact O-N 3.38Å; T469-D473 VanDerWaalsContact O-N 3.11Å; D473-N475 PolarHBondContact O-N 2.87Å; D473-N475 WeakPolarHBondContact OD1-CB 3.25Å; D473-N475 PolarHBondContact OD1-N 3.37Å; D473-N475 PolarHBondContact OD1-ND2 3.28Å; D473-N475 VanDerWaalsContact OD1-ND2 3.11Å; D473-K476 HydrophobicContact CB-CB 4.06Å; D473-K476 HydrophobicContact CB-CD 3.77Å; D473-K476 HydrophobicContact CB-CG 3.82Å; D473-K476 PolarHBondContact O-N 3.4Å; D473-K476 VanDerWaalsContact OD2-CE 3.27Å; D473-K476 WeakPolarHBondContact OD2-CE 3.23Å; D473-K476 WeakPolarHBondContact OD2-CG 3.32Å; D473-R477 WeakPolarHBondContact O-CG 3.43Å; D473-R477 PolarHBondContact O-N 2.94Å; D473-R477 VanDerWaalsContact O-N 3.12Å
474	Y	92.5	Very high	94	Very high	116 Å²	116	73.8 Å²	73.8	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-53.1	-40.5	174.8	176	-105.7	0	0	0	113	G472 K476 R477 K478	G472-Y474 PolarHBondContact O-N 3.34Å; Y474-K476 VanDerWaalsContact C-N 3.35Å; Y474-K476 PolarHBondContact O-N 3.08Å; Y474-R477 WeakPolarHBondContact O-CG 3.48Å; Y474-K478 HydrophobicContact CE1-CD 4.1Å; Y474-K478 VanDerWaalsContact O-CB 3.27Å; Y474-K478 WeakPolarHBondContact O-CB 3.38Å; Y474-K478 PolarHBondContact O-N 3.37Å
475	N	94.1	Very high	94	Very high	83 Å²	83	76.2 Å²	76.2	44%	0.444	35%	0.353	S	S	.	.	H	α-helix	trans	-71.1	-32.2	-175.6	-57.3	-63.9	0	0	0	112	D473 P479	D473-N475 PolarHBondContact O-N 2.87Å; D473-N475 WeakPolarHBondContact OD1-CB 3.25Å; D473-N475 PolarHBondContact OD1-N 3.37Å; D473-N475 PolarHBondContact OD1-ND2 3.28Å; D473-N475 VanDerWaalsContact OD1-ND2 3.11Å; N475-P479 WeakPolarHBondContact O-CD 3.39Å
476	K	94.4	Very high	94.1	Very high	67 Å²	67	76.5 Å²	76.5	29%	0.291	36%	0.358	S	S	.	.	H	α-helix	trans	-79.1	-35	178.1	-62	179	-168.6	-173.9	0	113	T468 L470 D473 Y474 P479	T468-K476 PolarHBondContact O-NZ 3.4Å; L470-K476 HydrophobicContact CG-CB 4.31Å; D473-K476 HydrophobicContact CB-CB 4.06Å; D473-K476 HydrophobicContact CB-CD 3.77Å; D473-K476 HydrophobicContact CB-CG 3.82Å; D473-K476 PolarHBondContact O-N 3.4Å; D473-K476 VanDerWaalsContact OD2-CE 3.27Å; D473-K476 WeakPolarHBondContact OD2-CE 3.23Å; D473-K476 WeakPolarHBondContact OD2-CG 3.32Å; Y474-K476 VanDerWaalsContact C-N 3.35Å; Y474-K476 PolarHBondContact O-N 3.08Å; K476-P479 WeakPolarHBondContact O-CD 3.49Å
477	R	94.5	Very high	94.2	Very high	6 Å²	6	75.7 Å²	75.7	2%	0.023	35%	0.354	C	S	.	.	H	α-helix	trans	-77.7	-30.1	175.1	66.6	-169.6	176.5	-128.8	-10	113.4	L460 E464 L470 L471 G472 D473 Y474 P479 F480 Y488	L460-R477 VanDerWaalsContact CD1-NH2 3.33Å; E464-R477 IonicContact OE1-NH2 3.16Å; E464-R477 PolarHBondContact OE1-NH2 2.85Å; E464-R477 VanDerWaalsContact OE1-NH2 3.16Å; L470-R477 PolarHBondContact O-N 2.98Å; L471-R477 WeakPolarHBondContact O-CD 3.36Å; L471-R477 PolarHBondContact O-NH1 3.18Å; G472-R477 PolarHBondContact O-NH1 2.78Å; D473-R477 WeakPolarHBondContact O-CG 3.43Å; D473-R477 PolarHBondContact O-N 2.94Å; D473-R477 VanDerWaalsContact O-N 3.12Å; Y474-R477 WeakPolarHBondContact O-CG 3.48Å; R477-P479 VanDerWaalsContact C-CD 3.43Å; R477-F480 WeakPolarHBondContact O-CB 3.48Å; R477-F480 PolarHBondContact O-N 2.79Å; R477-Y488 HydrophobicContact CB-CD1 3.98Å; R477-Y488 HydrophobicContact CB-CE1 3.7Å; R477-Y488 HydrophobicContact CG-CD1 4.38Å; R477-Y488 HydrophobicContact CG-CE1 3.61Å; R477-Y488 VanDerWaalsContact O-CD1 3.26Å; R477-Y488 WeakPolarHBondContact O-CD1 3.13Å; R477-Y488 VanDerWaalsContact O-CE1 3.31Å; R477-Y488 WeakPolarHBondContact O-CE1 3.4Å
478	K	93.2	Very high	94.3	Very high	123 Å²	123	72.7 Å²	72.7	54%	0.535	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-47.8	-42.6	-176.5	-179.9	179.6	178.9	-175.6	0	115.3	Y474 F480 Y481	Y474-K478 HydrophobicContact CE1-CD 4.1Å; Y474-K478 VanDerWaalsContact O-CB 3.27Å; Y474-K478 WeakPolarHBondContact O-CB 3.38Å; Y474-K478 PolarHBondContact O-N 3.37Å; K478-F480 PolarHBondContact O-N 3.34Å; K478-Y481 PolarHBondContact O-N 3.5Å
479	P	94.6	Very high	94.5	Very high	105 Å²	105	72.8 Å²	72.8	68%	0.682	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-64.3	-17.5	178.7	-23.3	35.6	0	0	0	115.1	N475 K476 R477	N475-P479 WeakPolarHBondContact O-CD 3.39Å; K476-P479 WeakPolarHBondContact O-CD 3.49Å; R477-P479 VanDerWaalsContact C-CD 3.43Å
480	F	95.3	Very high	94.6	Very high	63 Å²	63	72.9 Å²	72.9	28%	0.276	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-96	2.5	-178.5	-58.9	-84.3	0	0	0	113.1	L470 R477 K478 Y488 F489 F490 F527	L470-F480 HydrophobicContact CD1-CE2 4.05Å; L470-F480 HydrophobicContact CD1-CZ 4.37Å; L470-F480 HydrophobicContact CD2-CD2 4.21Å; L470-F480 HydrophobicContact CD2-CE2 4.09Å; L470-F480 HydrophobicContact CG-CE2 4.41Å; R477-F480 WeakPolarHBondContact O-CB 3.48Å; R477-F480 PolarHBondContact O-N 2.79Å; K478-F480 PolarHBondContact O-N 3.34Å; F480-Y488 HydrophobicContact CB-CD1 4.41Å; F480-Y488 CarbonylContact O-C 3.51Å; F480-Y488 VanDerWaalsContact O-CA 3.31Å; F480-Y488 WeakPolarHBondContact O-CA 3.4Å; F480-F489 PolarHBondContact O-N 3.13Å; F480-F490 HydrophobicContact CB-CD1 4.49Å; F480-F490 HydrophobicContact CB-CE1 3.88Å; F480-F490 HydrophobicContact CB-CE2 4.4Å; F480-F490 HydrophobicContact CB-CZ 3.83Å; F480-F490 AromaticContact CD1-CD1 3.64Å; F480-F490 HydrophobicContact CD1-CD1 3.64Å; F480-F490 AromaticContact CD1-CE1 3.47Å; F480-F490 HydrophobicContact CD1-CE1 3.47Å; F480-F490 VanDerWaalsContact CD1-CE1 3.47Å; F480-F490 HydrophobicContact CD1-CZ 4.3Å; F480-F490 AromaticContact CD2-CE1 3.64Å; F480-F490 HydrophobicContact CD2-CE1 3.64Å; F480-F490 HydrophobicContact CD2-CZ 4.04Å; F480-F490 AromaticContact CE1-CD1 3.95Å; F480-F490 HydrophobicContact CE1-CD1 3.95Å; F480-F490 AromaticContact CE1-CE1 3.84Å; F480-F490 HydrophobicContact CE1-CE1 3.84Å; F480-F490 HydrophobicContact CE2-CE1 4Å; F480-F490 AromaticContact CG-CD1 4Å; F480-F490 HydrophobicContact CG-CD1 4Å; F480-F490 AromaticContact CG-CE1 3.36Å; F480-F490 HydrophobicContact CG-CE1 3.36Å; F480-F490 AromaticContact CG-CZ 3.79Å; F480-F490 HydrophobicContact CG-CZ 3.79Å; F480-F490 HydrophobicContact CZ-CE1 4.09Å; F480-F527 AromaticContact CE1-CZ 3.92Å; F480-F527 HydrophobicContact CE1-CZ 3.92Å; F480-F527 HydrophobicContact CZ-CE2 4.38Å; F480-F527 AromaticContact CZ-CZ 3.8Å; F480-F527 HydrophobicContact CZ-CZ 3.8Å
481	Y	95.8	Very high	94.6	Very high	94 Å²	94	78.5 Å²	78.5	37%	0.369	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	117.5	-175.1	-173.4	-107.3	0	0	0	112.7	K478 E483 K486 Y488	K478-Y481 PolarHBondContact O-N 3.5Å; Y481-E483 HydrophobicContact CD1-CB 4.43Å; Y481-E483 HydrophobicContact CE1-CB 4.21Å; Y481-E483 PolarHBondContact O-N 2.98Å; Y481-K486 WeakPolarHBondContact OH-CA 3.5Å; Y481-Y488 HydrophobicContact CD2-CD1 4.1Å; Y481-Y488 HydrophobicContact CD2-CD2 4.07Å; Y481-Y488 AromaticContact CD2-CE1 3.86Å; Y481-Y488 HydrophobicContact CD2-CE1 3.86Å; Y481-Y488 AromaticContact CD2-CE2 3.82Å; Y481-Y488 HydrophobicContact CD2-CE2 3.82Å; Y481-Y488 HydrophobicContact CD2-CG 4.22Å; Y481-Y488 AromaticContact CD2-CZ 3.72Å; Y481-Y488 HydrophobicContact CE2-CE2 4.3Å; Y481-Y488 HydrophobicContact CG-CD1 4.5Å; Y481-Y488 HydrophobicContact CG-CE1 4.2Å
482	D	94.7	Very high	94.6	Very high	46 Å²	46	80.6 Å²	80.6	25%	0.246	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	105.8	168.2	-179.7	-24.1	0	0	0	108.9	Y484 R485 K486 E487	D482-Y484 VanDerWaalsContact C-N 3.33Å; D482-Y484 PolarHBondContact O-N 3.14Å; D482-Y484 WeakPolarHBondContact OD1-CA 3.37Å; D482-Y484 WeakPolarHBondContact OD1-CB 3.46Å; D482-Y484 PolarHBondContact OD1-N 3.13Å; D482-R485 HydrophobicContact CB-CB 4.25Å; D482-R485 PolarHBondContact O-N 2.99Å; D482-R485 PolarHBondContact OD1-N 3.44Å; D482-R485 WeakPolarHBondContact OD2-CD 3.38Å; D482-R485 VanDerWaalsContact OD2-CG 3.25Å; D482-R485 WeakPolarHBondContact OD2-CG 3.39Å; D482-R485 IonicContact OD2-NE 2.72Å; D482-K486 VanDerWaalsContact O-CA 3.29Å; D482-K486 WeakPolarHBondContact O-CA 3.39Å; D482-K486 PolarHBondContact O-N 3.18Å; D482-E487 HydrophobicContact CB-CG 4.49Å; D482-E487 PolarHBondContact N-O 3.17Å; D482-E487 PolarHBondContact O-N 3.26Å
483	E	92.8	Very high	94.6	Very high	161 Å²	161	83.5 Å²	83.5	75%	0.752	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-32.8	180	-176.7	171.9	-160.1	0	0	113.2	Y481	Y481-E483 HydrophobicContact CD1-CB 4.43Å; Y481-E483 HydrophobicContact CE1-CB 4.21Å; Y481-E483 PolarHBondContact O-N 2.98Å
484	Y	93	Very high	94.6	Very high	214 Å²	214	86.8 Å²	86.8	84%	0.839	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-37.2	179.8	178.7	-96.8	0	0	0	111.4	D482	D482-Y484 VanDerWaalsContact C-N 3.33Å; D482-Y484 PolarHBondContact O-N 3.14Å; D482-Y484 WeakPolarHBondContact OD1-CA 3.37Å; D482-Y484 WeakPolarHBondContact OD1-CB 3.46Å; D482-Y484 PolarHBondContact OD1-N 3.13Å
485	R	92.4	Very high	94.7	Very high	143 Å²	143	83.8 Å²	83.8	54%	0.54	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-15	178.8	-63.7	-173.7	-174.2	176.2	4.5	114.9	D482 E487	D482-R485 HydrophobicContact CB-CB 4.25Å; D482-R485 PolarHBondContact O-N 2.99Å; D482-R485 PolarHBondContact OD1-N 3.44Å; D482-R485 WeakPolarHBondContact OD2-CD 3.38Å; D482-R485 VanDerWaalsContact OD2-CG 3.25Å; D482-R485 WeakPolarHBondContact OD2-CG 3.39Å; D482-R485 IonicContact OD2-NE 2.72Å; R485-E487 VanDerWaalsContact C-N 3.28Å; R485-E487 HydrophobicContact CB-CG 3.76Å; R485-E487 WeakPolarHBondContact CD-OE1 3.26Å; R485-E487 IonicContact NH1-OE1 2.7Å; R485-E487 PolarHBondContact NH1-OE1 3.36Å; R485-E487 PolarHBondContact O-N 3.35Å
486	K	93.1	Very high	94.8	Very high	153 Å²	153	79.9 Å²	79.9	67%	0.665	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	34	-174.7	-53.3	178.4	-178.1	177.8	0	113.6	Y481 D482	Y481-K486 WeakPolarHBondContact OH-CA 3.5Å; D482-K486 VanDerWaalsContact O-CA 3.29Å; D482-K486 WeakPolarHBondContact O-CA 3.39Å; D482-K486 PolarHBondContact O-N 3.18Å
487	E	95.6	Very high	94.9	Very high	1 Å²	1	76.7 Å²	76.7	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.7	-179	72	-169.3	-176.1	0	0	111.3	T448 N450 K455 D482 R485	T448-E487 HydrophobicContact CG2-CB 4.1Å; T448-E487 WeakPolarHBondContact O-CA 3.32Å; N450-E487 HydrophobicContact CB-CG 4.08Å; N450-E487 PolarHBondContact ND2-OE1 2.86Å; K455-E487 WeakPolarHBondContact CE-OE2 3.39Å; K455-E487 IonicContact NZ-OE2 2.7Å; K455-E487 PolarHBondContact NZ-OE2 2.92Å; D482-E487 HydrophobicContact CB-CG 4.49Å; D482-E487 PolarHBondContact N-O 3.17Å; D482-E487 PolarHBondContact O-N 3.26Å; R485-E487 VanDerWaalsContact C-N 3.28Å; R485-E487 HydrophobicContact CB-CG 3.76Å; R485-E487 WeakPolarHBondContact CD-OE1 3.26Å; R485-E487 IonicContact NH1-OE1 2.7Å; R485-E487 PolarHBondContact NH1-OE1 3.36Å; R485-E487 PolarHBondContact O-N 3.35Å
488	Y	96.4	Very high	94.9	Very high	16 Å²	16	81.7 Å²	81.7	6%	0.063	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.2	169.9	-65.7	-92.3	0	0	0	109.6	I447 T448 I449 N450 R477 F480 Y481	I447-Y488 HydrophobicContact CD1-CE2 4.09Å; I447-Y488 HydrophobicContact CG1-CE2 4.45Å; I447-Y488 HydrophobicContact CG2-CD2 3.54Å; I447-Y488 HydrophobicContact CG2-CE2 3.59Å; T448-Y488 PolarHBondContact O-N 3.38Å; I449-Y488 CarbonylContact C-O 3.55Å; I449-Y488 WeakPolarHBondContact CA-O 3.28Å; N450-Y488 PolarHBondContact N-O 3.14Å; R477-Y488 HydrophobicContact CB-CD1 3.98Å; R477-Y488 HydrophobicContact CB-CE1 3.7Å; R477-Y488 HydrophobicContact CG-CD1 4.38Å; R477-Y488 HydrophobicContact CG-CE1 3.61Å; R477-Y488 VanDerWaalsContact O-CD1 3.26Å; R477-Y488 WeakPolarHBondContact O-CD1 3.13Å; R477-Y488 VanDerWaalsContact O-CE1 3.31Å; R477-Y488 WeakPolarHBondContact O-CE1 3.4Å; F480-Y488 HydrophobicContact CB-CD1 4.41Å; F480-Y488 CarbonylContact O-C 3.51Å; F480-Y488 VanDerWaalsContact O-CA 3.31Å; F480-Y488 WeakPolarHBondContact O-CA 3.4Å; Y481-Y488 HydrophobicContact CD2-CD1 4.1Å; Y481-Y488 HydrophobicContact CD2-CD2 4.07Å; Y481-Y488 AromaticContact CD2-CE1 3.86Å; Y481-Y488 HydrophobicContact CD2-CE1 3.86Å; Y481-Y488 AromaticContact CD2-CE2 3.82Å; Y481-Y488 HydrophobicContact CD2-CE2 3.82Å; Y481-Y488 HydrophobicContact CD2-CG 4.22Å; Y481-Y488 AromaticContact CD2-CZ 3.72Å; Y481-Y488 HydrophobicContact CE2-CE2 4.3Å; Y481-Y488 HydrophobicContact CG-CD1 4.5Å; Y481-Y488 HydrophobicContact CG-CE1 4.2Å
489	F	96.9	Very high	94.9	Very high	82 Å²	82	76.1 Å²	76.1	36%	0.36	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129.5	-176.9	-179.1	-105.5	0	0	0	112.6	N450 F480 D491	N450-F489 HydrophobicContact CB-CD2 4.21Å; N450-F489 WeakPolarHBondContact O-CA 3.37Å; N450-F489 WeakPolarHBondContact O-CD2 3.43Å; F480-F489 PolarHBondContact O-N 3.13Å; F489-D491 HydrophobicContact CE1-CB 4Å; F489-D491 HydrophobicContact CZ-CB 4.08Å
490	F	96.9	Very high	95	Very high	2 Å²	2	71.1 Å²	71.1	1%	0.009	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.6	175.6	-63	-84.4	0	0	0	110.2	I449 N450 V451 S452 L470 L471 F480 R492 F527 F528	I449-F490 HydrophobicContact CG2-CD2 3.7Å; I449-F490 HydrophobicContact CG2-CE2 3.75Å; N450-F490 PolarHBondContact O-N 3.08Å; V451-F490 CarbonylContact C-O 3.57Å; V451-F490 VanDerWaalsContact CA-O 3.26Å; V451-F490 WeakPolarHBondContact CA-O 3.41Å; V451-F490 HydrophobicContact CG2-CB 4.35Å; S452-F490 PolarHBondContact N-O 3.31Å; L470-F490 HydrophobicContact CD2-CE1 3.58Å; L470-F490 HydrophobicContact CD2-CZ 3.61Å; L471-F490 HydrophobicContact CD2-CE2 3.76Å; L471-F490 HydrophobicContact CD2-CZ 3.65Å; F480-F490 HydrophobicContact CB-CD1 4.49Å; F480-F490 HydrophobicContact CB-CE1 3.88Å; F480-F490 HydrophobicContact CB-CE2 4.4Å; F480-F490 HydrophobicContact CB-CZ 3.83Å; F480-F490 AromaticContact CD1-CD1 3.64Å; F480-F490 HydrophobicContact CD1-CD1 3.64Å; F480-F490 AromaticContact CD1-CE1 3.47Å; F480-F490 HydrophobicContact CD1-CE1 3.47Å; F480-F490 VanDerWaalsContact CD1-CE1 3.47Å; F480-F490 HydrophobicContact CD1-CZ 4.3Å; F480-F490 AromaticContact CD2-CE1 3.64Å; F480-F490 HydrophobicContact CD2-CE1 3.64Å; F480-F490 HydrophobicContact CD2-CZ 4.04Å; F480-F490 AromaticContact CE1-CD1 3.95Å; F480-F490 HydrophobicContact CE1-CD1 3.95Å; F480-F490 AromaticContact CE1-CE1 3.84Å; F480-F490 HydrophobicContact CE1-CE1 3.84Å; F480-F490 HydrophobicContact CE2-CE1 4Å; F480-F490 AromaticContact CG-CD1 4Å; F480-F490 HydrophobicContact CG-CD1 4Å; F480-F490 AromaticContact CG-CE1 3.36Å; F480-F490 HydrophobicContact CG-CE1 3.36Å; F480-F490 AromaticContact CG-CZ 3.79Å; F480-F490 HydrophobicContact CG-CZ 3.79Å; F480-F490 HydrophobicContact CZ-CE1 4.09Å; F490-R492 HydrophobicContact CB-CG 4.46Å; F490-R492 PolarHBondContact O-N 3.32Å; F490-F527 AromaticContact CD1-CE1 3.81Å; F490-F527 HydrophobicContact CD1-CE1 3.81Å; F490-F527 AromaticContact CD1-CZ 3.98Å; F490-F527 HydrophobicContact CD1-CZ 3.98Å; F490-F527 HydrophobicContact CE1-CE1 4.01Å; F490-F527 HydrophobicContact CE1-CZ 4.22Å; F490-F528 AromaticContact CD1-CE1 3.92Å; F490-F528 HydrophobicContact CD1-CE1 3.92Å; F490-F528 HydrophobicContact CD1-CZ 4.21Å; F490-F528 HydrophobicContact CD2-CE1 4.38Å; F490-F528 AromaticContact CE1-CE1 3.9Å; F490-F528 HydrophobicContact CE1-CE1 3.9Å; F490-F528 HydrophobicContact CE2-CE1 4.36Å; F490-F528 HydrophobicContact CG-CE1 4.17Å; F490-F528 HydrophobicContact CG-CZ 4.22Å; F490-F528 HydrophobicContact CZ-CE1 4.13Å
491	D	96.3	Very high	95	Very high	127 Å²	127	68.9 Å²	68.9	68%	0.679	31%	0.305	S	S	*	.			trans	-91.7	78.7	174.4	-162.5	29.3	0	0	0	110.8	S452 F489	S452-D491 WeakPolarHBondContact CB-OD1 3.48Å; S452-D491 VanDerWaalsContact OG-CA 3.32Å; S452-D491 WeakPolarHBondContact OG-CA 3.32Å; S452-D491 PolarHBondContact OG-OD1 3.38Å; F489-D491 HydrophobicContact CE1-CB 4Å; F489-D491 HydrophobicContact CZ-CB 4.08Å
492	R	95.8	Very high	95	Very high	45 Å²	45	66.3 Å²	66.3	17%	0.17	30%	0.298	C	S	.	.	S	Bend	trans	-145.9	178.5	-167.1	-62	-158.2	78.1	-126.8	2	113.3	V451 S452 F490 R494 T523 E524 F527 F528	V451-R492 HydrophobicContact CG1-CB 4.45Å; S452-R492 PolarHBondContact OG-N 3.3Å; S452-R492 VanDerWaalsContact OG-N 3.08Å; S452-R492 PolarHBondContact OG-O 3.02Å; F490-R492 HydrophobicContact CB-CG 4.46Å; F490-R492 PolarHBondContact O-N 3.32Å; R492-R494 PolarHBondContact O-N 3.38Å; R492-T523 PolarHBondContact NH2-O 3.38Å; R492-E524 IonicContact CZ-OE1 2.74Å; R492-E524 IonicContact CZ-OE2 2.81Å; R492-E524 VanDerWaalsContact CZ-OE2 3.25Å; R492-E524 IonicContact NE-OE1 2.68Å; R492-E524 IonicContact NE-OE2 3.36Å; R492-E524 PolarHBondContact NH1-O 3.02Å; R492-E524 IonicContact NH1-OE1 3.08Å; R492-E524 PolarHBondContact NH1-OE1 3.39Å; R492-E524 IonicContact NH1-OE2 3.55Å; R492-E524 PolarHBondContact NH1-OE2 3.17Å; R492-E524 IonicContact NH2-OE1 2.85Å; R492-E524 PolarHBondContact NH2-OE1 3.04Å; R492-E524 IonicContact NH2-OE2 3.92Å; R492-F527 VanDerWaalsContact NH1-CB 3.3Å; R492-F527 VanDerWaalsContact NH1-CG 3.28Å; R492-F528 VanDerWaalsContact NH1-CE2 3.29Å
493	H	94.7	Very high	95	Very high	66 Å²	66	64.1 Å²	64.1	31%	0.306	29%	0.286	S	S	.	.			trans	-69.5	96.6	-168.3	-168	-116.2	0	0	0	113.4	P495 S496 F497 I520 E524	H493-P495 VanDerWaalsContact C-CD 3.49Å; H493-S496 PolarHBondContact ND1-OG 3.13Å; H493-S496 WeakPolarHBondContact O-CB 3.46Å; H493-S496 PolarHBondContact O-N 2.96Å; H493-F497 PolarHBondContact O-N 3.3Å; H493-I520 HydrophobicContact CB-CG2 4.22Å; H493-E524 HydrophobicContact CB-CG 3.99Å; H493-E524 VanDerWaalsContact CB-OE1 3.23Å; H493-E524 WeakPolarHBondContact CB-OE1 3.12Å; H493-E524 PolarHBondContact N-OE1 3.17Å
494	R	94.5	Very high	95.1	Very high	110 Å²	110	56.6 Å²	56.6	42%	0.415	25%	0.25	S	S	.	.	H	α-helix	trans	-44.7	-47.7	-175.6	-60.7	171.3	54.8	159.3	-9.1	114.9	V451 S452 L454 R492 S496 F497	V451-R494 HydrophobicContact CG1-CG 4.36Å; V451-R494 WeakPolarHBondContact O-CG 3.38Å; S452-R494 WeakPolarHBondContact O-CD 3.38Å; S452-R494 PolarHBondContact O-NH1 3.34Å; L454-R494 HydrophobicContact CD2-CB 4.41Å; R492-R494 PolarHBondContact O-N 3.38Å; R494-S496 PolarHBondContact O-N 3.09Å; R494-F497 PolarHBondContact O-N 2.54Å
495	P	94.4	Very high	95.1	Very high	53 Å²	53	50.3 Å²	50.3	34%	0.344	23%	0.229	S	C	.	.	H	α-helix	trans	-67.9	-30.5	179.9	-20	34.2	0	0	0	113.8	H493 F497 P513 V516	H493-P495 VanDerWaalsContact C-CD 3.49Å; P495-F497 VanDerWaalsContact C-N 3.3Å; P495-F497 PolarHBondContact O-N 3.19Å; P495-P513 WeakPolarHBondContact O-CG 3.48Å; P495-V516 HydrophobicContact CB-CG2 3.71Å
496	S	95	Very high	95.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.1	-35.9	176.1	-62.3	0	0	0	0	111.6	H493 R494 E498 A499 I500 V516	H493-S496 PolarHBondContact ND1-OG 3.13Å; H493-S496 WeakPolarHBondContact O-CB 3.46Å; H493-S496 PolarHBondContact O-N 2.96Å; R494-S496 PolarHBondContact O-N 3.09Å; S496-E498 VanDerWaalsContact C-N 3.28Å; S496-E498 PolarHBondContact O-N 2.95Å; S496-A499 PolarHBondContact O-N 2.93Å; S496-I500 PolarHBondContact O-N 3.28Å; S496-V516 WeakPolarHBondContact OG-CG1 3.38Å
497	F	96.3	Very high	94.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-29.5	-173.2	-166.6	-94.9	0	0	0	113.4	I449 V451 F456 L471 H493 R494 P495 A499 I500 F501 F528	I449-F497 HydrophobicContact CB-CZ 4.38Å; I449-F497 HydrophobicContact CD1-CZ 4.08Å; I449-F497 HydrophobicContact CG2-CE1 4.18Å; I449-F497 HydrophobicContact CG2-CE2 4.43Å; I449-F497 HydrophobicContact CG2-CZ 3.73Å; V451-F497 HydrophobicContact CB-CB 4.45Å; V451-F497 HydrophobicContact CB-CG 4.41Å; V451-F497 HydrophobicContact CG1-CB 4.24Å; V451-F497 HydrophobicContact CG2-CB 4.09Å; V451-F497 HydrophobicContact CG2-CD1 3.72Å; V451-F497 HydrophobicContact CG2-CD2 3.72Å; V451-F497 HydrophobicContact CG2-CE1 4.02Å; V451-F497 HydrophobicContact CG2-CE2 4.02Å; V451-F497 HydrophobicContact CG2-CG 3.55Å; V451-F497 HydrophobicContact CG2-CZ 4.17Å; F456-F497 HydrophobicContact CB-CE1 4.2Å; F456-F497 HydrophobicContact CD1-CD1 4.18Å; F456-F497 HydrophobicContact CD1-CE1 4.34Å; F456-F497 AromaticContact CD2-CD1 3.51Å; F456-F497 HydrophobicContact CD2-CD1 3.51Å; F456-F497 AromaticContact CD2-CE1 3.7Å; F456-F497 HydrophobicContact CD2-CE1 3.7Å; F456-F497 HydrophobicContact CE1-CD1 4.11Å; F456-F497 HydrophobicContact CE2-CB 4.43Å; F456-F497 AromaticContact CE2-CD1 3.42Å; F456-F497 HydrophobicContact CE2-CD1 3.42Å; F456-F497 VanDerWaalsContact CE2-CD1 3.42Å; F456-F497 HydrophobicContact CE2-CE1 4.12Å; F456-F497 HydrophobicContact CE2-CG 4.3Å; F456-F497 AromaticContact CG-CD1 3.91Å; F456-F497 HydrophobicContact CG-CD1 3.91Å; F456-F497 AromaticContact CG-CE1 3.83Å; F456-F497 HydrophobicContact CG-CE1 3.83Å; F456-F497 HydrophobicContact CZ-CB 4.47Å; F456-F497 AromaticContact CZ-CD1 3.74Å; F456-F497 HydrophobicContact CZ-CD1 3.74Å; L471-F497 HydrophobicContact CD1-CE2 3.92Å; L471-F497 HydrophobicContact CD1-CZ 3.87Å; H493-F497 PolarHBondContact O-N 3.3Å; R494-F497 PolarHBondContact O-N 2.54Å; P495-F497 VanDerWaalsContact C-N 3.3Å; P495-F497 PolarHBondContact O-N 3.19Å; F497-A499 VanDerWaalsContact C-N 3.3Å; F497-A499 PolarHBondContact O-N 2.88Å; F497-I500 HydrophobicContact CD2-CB 4.44Å; F497-I500 HydrophobicContact CD2-CG2 4.2Å; F497-I500 HydrophobicContact CE2-CG2 4.15Å; F497-I500 CarbonylContact O-C 3.54Å; F497-I500 PolarHBondContact O-N 2.64Å; F497-I500 VanDerWaalsContact O-N 3.14Å; F497-F501 HydrophobicContact CD1-CB 4.09Å; F497-F501 HydrophobicContact CE1-CB 3.88Å; F497-F501 HydrophobicContact CE1-CD2 4.04Å; F497-F501 HydrophobicContact CE1-CG 4.33Å; F497-F501 VanDerWaalsContact O-CB 3.26Å; F497-F501 WeakPolarHBondContact O-CB 3.3Å; F497-F501 PolarHBondContact O-N 2.6Å; F497-F528 HydrophobicContact CD2-CE1 4.18Å; F497-F528 AromaticContact CD2-CE2 3.73Å; F497-F528 HydrophobicContact CD2-CE2 3.73Å; F497-F528 AromaticContact CD2-CZ 3.53Å; F497-F528 HydrophobicContact CD2-CZ 3.53Å; F497-F528 HydrophobicContact CE2-CD1 4.4Å; F497-F528 AromaticContact CE2-CE1 3.72Å; F497-F528 HydrophobicContact CE2-CE1 3.72Å; F497-F528 HydrophobicContact CE2-CE2 4.11Å; F497-F528 AromaticContact CE2-CZ 3.55Å; F497-F528 HydrophobicContact CE2-CZ 3.55Å
498	E	94.7	Very high	94.5	Very high	111 Å²	111	46.4 Å²	46.4	52%	0.519	23%	0.234	S	C	.	.	H	α-helix	trans	-55.1	-46.5	175.3	-170.4	-170.3	146.7	0	0	111.6	F456 S496 F501 N502	F456-E498 HydrophobicContact CE1-CB 4.47Å; S496-E498 VanDerWaalsContact C-N 3.28Å; S496-E498 PolarHBondContact O-N 2.95Å; E498-F501 PolarHBondContact O-N 3.38Å; E498-N502 VanDerWaalsContact O-CB 3.3Å; E498-N502 WeakPolarHBondContact O-CB 3.16Å; E498-N502 PolarHBondContact O-N 2.73Å; E498-N502 PolarHBondContact O-ND2 3.09Å; E498-N502 VanDerWaalsContact O-ND2 3.15Å
499	A	94.8	Very high	94.2	Very high	6 Å²	6	55.1 Å²	55.1	5%	0.05	27%	0.266	C	S	.	.	H	α-helix	trans	-71.3	-32.1	177.3	0	0	0	0	0	113.6	S496 F497 Y503 K511 P513 F521	S496-A499 PolarHBondContact O-N 2.93Å; F497-A499 VanDerWaalsContact C-N 3.3Å; F497-A499 PolarHBondContact O-N 2.88Å; A499-Y503 PolarHBondContact O-N 2.77Å; A499-Y503 VanDerWaalsContact O-N 3.1Å; A499-K511 WeakPolarHBondContact CB-O 3.23Å; A499-P513 HydrophobicContact CB-CG 3.92Å; A499-F521 HydrophobicContact CB-CE2 3.7Å; A499-F521 HydrophobicContact CB-CZ 3.7Å
500	I	95.9	Very high	94	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69.5	-38.4	174.2	-73.9	151.4	0	0	0	111.1	S496 F497 Y503 Y504 E524 L525 F528 I530	S496-I500 PolarHBondContact O-N 3.28Å; F497-I500 HydrophobicContact CD2-CB 4.44Å; F497-I500 HydrophobicContact CD2-CG2 4.2Å; F497-I500 HydrophobicContact CE2-CG2 4.15Å; F497-I500 CarbonylContact O-C 3.54Å; F497-I500 PolarHBondContact O-N 2.64Å; F497-I500 VanDerWaalsContact O-N 3.14Å; I500-Y503 WeakPolarHBondContact O-CB 3.47Å; I500-Y503 PolarHBondContact O-N 3.36Å; I500-Y504 HydrophobicContact CG2-CE2 4.19Å; I500-Y504 WeakPolarHBondContact O-CD2 3.49Å; I500-Y504 VanDerWaalsContact O-CE2 3.24Å; I500-Y504 WeakPolarHBondContact O-CE2 3.18Å; I500-E524 HydrophobicContact CD1-CB 3.87Å; I500-L525 HydrophobicContact CD1-CD2 4.42Å; I500-L525 HydrophobicContact CG1-CD2 3.88Å; I500-F528 HydrophobicContact CD1-CD2 3.65Å; I500-F528 HydrophobicContact CD1-CE2 4.1Å; I500-F528 HydrophobicContact CG1-CD2 4.49Å; I500-F528 HydrophobicContact CG2-CB 4.25Å; I500-F528 HydrophobicContact CG2-CD2 4.09Å; I500-F528 HydrophobicContact CG2-CG 4.08Å; I500-I530 HydrophobicContact CG2-CD1 4.38Å
501	F	95.5	Very high	93.7	Very high	17 Å²	17	60.6 Å²	60.6	8%	0.075	29%	0.291	C	S	.	.	H	α-helix	trans	-67.6	-46.8	175.2	-177.9	-102.2	0	0	0	111.1	F456 E457 T458 F497 E498 Y503 Y504 Q505	F456-F501 HydrophobicContact CB-CD2 3.9Å; F456-F501 HydrophobicContact CB-CE2 3.73Å; F456-F501 HydrophobicContact CB-CG 4.41Å; F456-F501 HydrophobicContact CB-CZ 4.1Å; F456-F501 HydrophobicContact CD1-CB 4.27Å; F456-F501 AromaticContact CD1-CD1 3.9Å; F456-F501 HydrophobicContact CD1-CD1 3.9Å; F456-F501 HydrophobicContact CD1-CD2 4.23Å; F456-F501 HydrophobicContact CD1-CE1 4.24Å; F456-F501 AromaticContact CD1-CG 3.88Å; F456-F501 HydrophobicContact CD1-CG 3.88Å; F456-F501 HydrophobicContact CG-CD2 4.34Å; F456-F501 HydrophobicContact CG-CG 4.43Å; E457-F501 WeakPolarHBondContact O-CZ 3.38Å; T458-F501 HydrophobicContact CG2-CE2 3.94Å; F497-F501 HydrophobicContact CD1-CB 4.09Å; F497-F501 HydrophobicContact CE1-CB 3.88Å; F497-F501 HydrophobicContact CE1-CD2 4.04Å; F497-F501 HydrophobicContact CE1-CG 4.33Å; F497-F501 VanDerWaalsContact O-CB 3.26Å; F497-F501 WeakPolarHBondContact O-CB 3.3Å; F497-F501 PolarHBondContact O-N 2.6Å; E498-F501 PolarHBondContact O-N 3.38Å; F501-Y503 PolarHBondContact O-N 3.07Å; F501-Y504 PolarHBondContact O-N 2.82Å; F501-Y504 VanDerWaalsContact O-N 3.15Å; F501-Q505 HydrophobicContact CD1-CG 4.4Å; F501-Q505 HydrophobicContact CE1-CG 4.17Å; F501-Q505 VanDerWaalsContact CE1-NE2 3.33Å; F501-Q505 PolarHBondContact O-N 3.31Å
502	N	94.6	Very high	93.5	Very high	40 Å²	40	57.6 Å²	57.6	21%	0.214	27%	0.27	C	S	.	.	H	α-helix	trans	-56.4	-34.2	173.8	-76.4	-24	0	0	0	112.8	E498 Y504 Q505 Y506	E498-N502 VanDerWaalsContact O-CB 3.3Å; E498-N502 WeakPolarHBondContact O-CB 3.16Å; E498-N502 PolarHBondContact O-N 2.73Å; E498-N502 PolarHBondContact O-ND2 3.09Å; E498-N502 VanDerWaalsContact O-ND2 3.15Å; N502-Y504 VanDerWaalsContact C-N 3.34Å; N502-Y504 PolarHBondContact O-N 2.95Å; N502-Q505 PolarHBondContact O-N 3.04Å; N502-Q505 PolarHBondContact OD1-OE1 3.39Å; N502-Y506 HydrophobicContact CB-CD2 3.84Å; N502-Y506 HydrophobicContact CB-CE2 3.73Å; N502-Y506 WeakPolarHBondContact O-CB 3.39Å; N502-Y506 WeakPolarHBondContact O-CD2 3.49Å; N502-Y506 PolarHBondContact O-N 2.7Å
503	Y	95.4	Very high	93.4	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.9	-41.4	176	155.7	-85	0	0	0	112.8	H466 T469 A499 I500 F501 G507 G508 L510 I530 E531 A534	H466-Y503 HydrophobicContact CB-CE1 4.39Å; H466-Y503 AromaticContact CE1-CZ 3.95Å; H466-Y503 AromaticContact CG-CE1 3.97Å; H466-Y503 AromaticContact ND1-CZ 3.79Å; H466-Y503 PolarHBondContact ND1-OH 3.33Å; T469-Y503 HydrophobicContact CG2-CE1 4.4Å; A499-Y503 PolarHBondContact O-N 2.77Å; A499-Y503 VanDerWaalsContact O-N 3.1Å; I500-Y503 WeakPolarHBondContact O-CB 3.47Å; I500-Y503 PolarHBondContact O-N 3.36Å; F501-Y503 PolarHBondContact O-N 3.07Å; Y503-G507 PolarHBondContact O-N 2.8Å; Y503-G508 VanDerWaalsContact CD2-C 3.44Å; Y503-G508 WeakPolarHBondContact CD2-O 3.39Å; Y503-G508 VanDerWaalsContact CE2-CA 3.49Å; Y503-G508 PolarHBondContact O-N 3Å; Y503-L510 HydrophobicContact CD2-CB 4.26Å; Y503-L510 HydrophobicContact CD2-CD1 4.49Å; Y503-I530 HydrophobicContact CD1-CD1 3.88Å; Y503-I530 HydrophobicContact CD2-CG2 4.3Å; Y503-I530 HydrophobicContact CE1-CD1 3.79Å; Y503-I530 HydrophobicContact CE1-CG2 4.4Å; Y503-I530 HydrophobicContact CE2-CG2 3.84Å; Y503-E531 VanDerWaalsContact OH-CD 3.26Å; Y503-E531 PolarHBondContact OH-OE2 3.35Å; Y503-A534 HydrophobicContact CD2-CB 4.43Å; Y503-A534 HydrophobicContact CE2-CB 3.68Å
504	Y	95.2	Very high	93.1	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-71.1	-42.6	175.3	-59.6	-90.8	0	0	0	111.6	L463 H466 T469 L471 I500 F501 N502 Y506 G507 I530	L463-Y504 HydrophobicContact CD2-CD1 3.9Å; L463-Y504 HydrophobicContact CD2-CD2 4.15Å; L463-Y504 HydrophobicContact CD2-CE1 4.32Å; L463-Y504 HydrophobicContact CD2-CG 3.83Å; H466-Y504 HydrophobicContact CB-CD1 4.09Å; H466-Y504 HydrophobicContact CB-CE1 3.91Å; H466-Y504 AromaticContact CD2-CD1 3.94Å; T469-Y504 VanDerWaalsContact CB-OH 3.31Å; T469-Y504 WeakPolarHBondContact CB-OH 3.42Å; T469-Y504 HydrophobicContact CG2-CE1 4.33Å; T469-Y504 WeakPolarHBondContact OG1-CE1 3.33Å; T469-Y504 PolarHBondContact OG1-OH 3.03Å; L471-Y504 HydrophobicContact CB-CE1 4.32Å; L471-Y504 HydrophobicContact CB-CE2 4.43Å; L471-Y504 HydrophobicContact CD1-CE2 3.84Å; I500-Y504 HydrophobicContact CG2-CE2 4.19Å; I500-Y504 WeakPolarHBondContact O-CD2 3.49Å; I500-Y504 VanDerWaalsContact O-CE2 3.24Å; I500-Y504 WeakPolarHBondContact O-CE2 3.18Å; F501-Y504 PolarHBondContact O-N 2.82Å; F501-Y504 VanDerWaalsContact O-N 3.15Å; N502-Y504 VanDerWaalsContact C-N 3.34Å; N502-Y504 PolarHBondContact O-N 2.95Å; Y504-Y506 VanDerWaalsContact C-N 3.35Å; Y504-Y506 PolarHBondContact O-N 3.32Å; Y504-G507 PolarHBondContact O-N 2.99Å; Y504-I530 HydrophobicContact CE2-CD1 4.47Å
505	Q	93.1	Very high	92.9	Very high	83 Å²	83	59.3 Å²	59.3	39%	0.388	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-39.3	-178.9	-66	-169.6	-51.5	0	0	112.6	V462 F501 N502	V462-Q505 HydrophobicContact CG1-CG 4.44Å; F501-Q505 HydrophobicContact CD1-CG 4.4Å; F501-Q505 HydrophobicContact CE1-CG 4.17Å; F501-Q505 VanDerWaalsContact CE1-NE2 3.33Å; F501-Q505 PolarHBondContact O-N 3.31Å; N502-Q505 PolarHBondContact O-N 3.04Å; N502-Q505 PolarHBondContact OD1-OE1 3.39Å
506	Y	91.4	Very high	92.8	Very high	142 Å²	142	57 Å²	57	56%	0.557	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	14.2	-179.4	-56.6	-48.9	0	0	0	114.1	N502 Y504	N502-Y506 HydrophobicContact CB-CD2 3.84Å; N502-Y506 HydrophobicContact CB-CE2 3.73Å; N502-Y506 WeakPolarHBondContact O-CB 3.39Å; N502-Y506 WeakPolarHBondContact O-CD2 3.49Å; N502-Y506 PolarHBondContact O-N 2.7Å; Y504-Y506 VanDerWaalsContact C-N 3.35Å; Y504-Y506 PolarHBondContact O-N 3.32Å
507	G	88.1	Confident	92.5	Very high	49 Å²	49	59.1 Å²	59.1	51%	0.505	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	56.4	172.3	0	0	0	0	0	113.9	Y503 Y504	Y503-G507 PolarHBondContact O-N 2.8Å; Y504-G507 PolarHBondContact O-N 2.99Å
508	G	89.1	Confident	92	Very high	24 Å²	24	60.1 Å²	60.1	25%	0.247	32%	0.319	C	S	.	.	S	Bend	trans	96.3	-3	174.7	0	0	0	0	0	115.5	H466 Y503 L510	H466-G508 PolarHBondContact NE2-N 3.3Å; Y503-G508 VanDerWaalsContact CD2-C 3.44Å; Y503-G508 WeakPolarHBondContact CD2-O 3.39Å; Y503-G508 VanDerWaalsContact CE2-CA 3.49Å; Y503-G508 PolarHBondContact O-N 3Å; G508-L510 PolarHBondContact O-N 2.99Å
509	R	90.4	Very high	91.6	Very high	199 Å²	199	58 Å²	58	75%	0.751	31%	0.311	S	S	*	.			trans	-81.6	109.4	-177	-65.4	-175.8	-178.4	-166.6	1.2	112.1
510	L	92.2	Very high	91.4	Very high	24 Å²	24	60.9 Å²	60.9	13%	0.126	33%	0.325	C	S	.	.			trans	-105.3	133	-179.2	-167.7	67.2	0	0	0	112.7	Y503 G508 F521 L525 I530 Y538	Y503-L510 HydrophobicContact CD2-CB 4.26Å; Y503-L510 HydrophobicContact CD2-CD1 4.49Å; G508-L510 PolarHBondContact O-N 2.99Å; L510-F521 HydrophobicContact CD1-CE1 4.34Å; L510-F521 HydrophobicContact CD1-CZ 3.92Å; L510-F521 HydrophobicContact CD2-CE1 4.33Å; L510-F521 HydrophobicContact CG-CE1 4.22Å; L510-F521 HydrophobicContact CG-CZ 4.29Å; L510-L525 HydrophobicContact CD1-CD2 3.77Å; L510-L525 HydrophobicContact CD2-CD1 3.63Å; L510-L525 HydrophobicContact CD2-CD2 3.53Å; L510-L525 HydrophobicContact CD2-CG 4.21Å; L510-L525 HydrophobicContact CG-CD2 4.22Å; L510-I530 HydrophobicContact CD2-CG2 4.43Å; L510-Y538 HydrophobicContact CD2-CD2 4.41Å; L510-Y538 HydrophobicContact CD2-CG 4.08Å
511	K	90.4	Very high	91.4	Very high	175 Å²	175	60.9 Å²	60.9	76%	0.761	33%	0.325	S	S	*	.			trans	-145.7	124.1	175.1	-177.5	177	-178.6	177.4	0	110	A499	A499-K511 WeakPolarHBondContact CB-O 3.23Å
512	R	92.1	Very high	91.2	Very high	64 Å²	64	61.7 Å²	61.7	24%	0.242	33%	0.33	C	S	.	.			trans	-64.3	137.8	177	178.3	171.6	57.8	93.3	0.8	111.1	V516 F521 Y538 E542	R512-V516 WeakPolarHBondContact CD-O 3.38Å; R512-V516 HydrophobicContact CG-CB 4.49Å; R512-V516 PolarHBondContact NH1-O 3.22Å; R512-F521 HydrophobicContact CB-CD1 3.62Å; R512-F521 HydrophobicContact CB-CE1 3.76Å; R512-F521 HydrophobicContact CB-CG 4.09Å; R512-F521 HydrophobicContact CB-CZ 4.37Å; R512-F521 HydrophobicContact CG-CB 3.99Å; R512-F521 HydrophobicContact CG-CD1 3.82Å; R512-F521 HydrophobicContact CG-CD2 4.34Å; R512-F521 HydrophobicContact CG-CE1 4.38Å; R512-F521 HydrophobicContact CG-CG 3.79Å; R512-Y538 HydrophobicContact CB-CE2 3.77Å; R512-Y538 VanDerWaalsContact CD-OH 3.32Å; R512-Y538 WeakPolarHBondContact CD-OH 3.3Å; R512-Y538 PolarHBondContact NE-OH 2.68Å; R512-E542 IonicContact CZ-OE1 2.97Å; R512-E542 IonicContact CZ-OE2 3.33Å; R512-E542 IonicContact NE-OE1 2.9Å; R512-E542 PolarHBondContact NE-OE1 3.22Å; R512-E542 IonicContact NE-OE2 3.94Å; R512-E542 VanDerWaalsContact NH2-CD 3.27Å; R512-E542 IonicContact NH2-OE1 3.1Å; R512-E542 PolarHBondContact NH2-OE1 3.17Å; R512-E542 VanDerWaalsContact NH2-OE1 3.07Å; R512-E542 IonicContact NH2-OE2 3.6Å; R512-E542 PolarHBondContact NH2-OE2 3.04Å
513	P	92.9	Very high	91.1	Very high	25 Å²	25	63.5 Å²	63.5	16%	0.162	34%	0.343	C	S	.	.			trans	-70.1	135.8	170.1	-7.3	21.9	0	0	0	110.1	P495 A499 T515 V516	P495-P513 WeakPolarHBondContact O-CG 3.48Å; A499-P513 HydrophobicContact CB-CG 3.92Å; P513-T515 PolarHBondContact O-N 2.97Å; P513-V516 HydrophobicContact CB-CG2 3.99Å; P513-V516 HydrophobicContact CG-CG2 3.9Å; P513-V516 PolarHBondContact O-N 2.84Å
514	A	88.5	Confident	91.2	Very high	104 Å²	104	64.1 Å²	64.1	86%	0.86	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.3	-174.3	0	0	0	0	0	114.6	V516	A514-V516 VanDerWaalsContact C-N 3.34Å
515	T	91.4	Very high	91.1	Very high	128 Å²	128	64.1 Å²	64.1	79%	0.785	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.8	175.6	48.3	0	0	0	0	114.1	P513	P513-T515 PolarHBondContact O-N 2.97Å
516	V	91.2	Very high	91.2	Very high	4 Å²	4	67 Å²	67	2%	0.024	36%	0.359	C	S	.	.	S	Bend	trans	-111.3	132.5	-174.8	-174	0	0	0	0	109.9	P495 S496 R512 P513 A514 I520 F521	P495-V516 HydrophobicContact CB-CG2 3.71Å; S496-V516 WeakPolarHBondContact OG-CG1 3.38Å; R512-V516 WeakPolarHBondContact CD-O 3.38Å; R512-V516 HydrophobicContact CG-CB 4.49Å; R512-V516 PolarHBondContact NH1-O 3.22Å; P513-V516 HydrophobicContact CB-CG2 3.99Å; P513-V516 HydrophobicContact CG-CG2 3.9Å; P513-V516 PolarHBondContact O-N 2.84Å; A514-V516 VanDerWaalsContact C-N 3.34Å; V516-I520 HydrophobicContact CG1-CB 4.29Å; V516-I520 HydrophobicContact CG1-CG2 4.06Å; V516-F521 HydrophobicContact CG1-CB 4.05Å; V516-F521 HydrophobicContact CG1-CD2 4.48Å
517	S	88.7	Confident	91.4	Very high	44 Å²	44	63.4 Å²	63.4	31%	0.308	35%	0.346	S	S	.	.			trans	-69.8	148.9	173.5	64.1	0	0	0	0	111.3	D519 I520 F521	S517-D519 VanDerWaalsContact C-N 3.31Å; S517-D519 WeakPolarHBondContact CB-OD1 3.46Å; S517-D519 PolarHBondContact O-N 3.26Å; S517-D519 PolarHBondContact OG-OD1 2.86Å; S517-I520 PolarHBondContact O-N 3.37Å; S517-I520 WeakPolarHBondContact OG-CD1 3.4Å; S517-I520 VanDerWaalsContact OG-CG1 3.3Å; S517-I520 WeakPolarHBondContact OG-CG1 3.39Å; S517-F521 WeakPolarHBondContact O-CB 3.28Å; S517-F521 PolarHBondContact O-N 3.37Å
518	D	86.1	Confident	91.8	Very high	21 Å²	21	61 Å²	61	11%	0.112	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-33.6	-174.1	170.9	54.5	0	0	0	112.9	F521 L522 Y538 Y544	D518-F521 PolarHBondContact O-N 2.81Å; D518-L522 WeakPolarHBondContact O-CB 3.32Å; D518-L522 VanDerWaalsContact O-CG 3.28Å; D518-L522 WeakPolarHBondContact O-CG 3.31Å; D518-L522 PolarHBondContact O-N 3.13Å; D518-Y538 PolarHBondContact OD1-OH 3.39Å; D518-Y544 WeakPolarHBondContact OD2-CE2 3.19Å; D518-Y544 PolarHBondContact OD2-OH 3.37Å
519	D	86.5	Confident	92.1	Very high	68 Å²	68	64.1 Å²	64.1	36%	0.364	33%	0.33	S	S	.	.	H	α-helix	trans	-69.1	-43.4	175.6	67.3	-33.6	0	0	0	113.3	S517 F521 T523	S517-D519 VanDerWaalsContact C-N 3.31Å; S517-D519 WeakPolarHBondContact CB-OD1 3.46Å; S517-D519 PolarHBondContact O-N 3.26Å; S517-D519 PolarHBondContact OG-OD1 2.86Å; D519-F521 VanDerWaalsContact C-N 3.33Å; D519-T523 WeakPolarHBondContact O-CB 3.47Å; D519-T523 PolarHBondContact O-N 3.02Å; D519-T523 PolarHBondContact O-OG1 3.4Å
520	I	91.7	Very high	92.3	Very high	66 Å²	66	55.2 Å²	55.2	34%	0.338	30%	0.297	S	S	.	.	H	α-helix	trans	-63	-43.3	172.2	-67.1	177	0	0	0	109.6	H493 V516 S517 T523 E524	H493-I520 HydrophobicContact CB-CG2 4.22Å; V516-I520 HydrophobicContact CG1-CB 4.29Å; V516-I520 HydrophobicContact CG1-CG2 4.06Å; S517-I520 PolarHBondContact O-N 3.37Å; S517-I520 WeakPolarHBondContact OG-CD1 3.4Å; S517-I520 VanDerWaalsContact OG-CG1 3.3Å; S517-I520 WeakPolarHBondContact OG-CG1 3.39Å; I520-T523 PolarHBondContact O-N 3.4Å; I520-E524 VanDerWaalsContact O-CG 3.25Å; I520-E524 WeakPolarHBondContact O-CG 3.36Å; I520-E524 PolarHBondContact O-N 2.66Å
521	F	94.3	Very high	92.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-48.2	-179.9	-165.8	-117.1	0	0	0	111.8	A499 L510 R512 V516 S517 D518 D519 T523 E524 L525 Y538	A499-F521 HydrophobicContact CB-CE2 3.7Å; A499-F521 HydrophobicContact CB-CZ 3.7Å; L510-F521 HydrophobicContact CD1-CE1 4.34Å; L510-F521 HydrophobicContact CD1-CZ 3.92Å; L510-F521 HydrophobicContact CD2-CE1 4.33Å; L510-F521 HydrophobicContact CG-CE1 4.22Å; L510-F521 HydrophobicContact CG-CZ 4.29Å; R512-F521 HydrophobicContact CB-CD1 3.62Å; R512-F521 HydrophobicContact CB-CE1 3.76Å; R512-F521 HydrophobicContact CB-CG 4.09Å; R512-F521 HydrophobicContact CB-CZ 4.37Å; R512-F521 HydrophobicContact CG-CB 3.99Å; R512-F521 HydrophobicContact CG-CD1 3.82Å; R512-F521 HydrophobicContact CG-CD2 4.34Å; R512-F521 HydrophobicContact CG-CE1 4.38Å; R512-F521 HydrophobicContact CG-CG 3.79Å; V516-F521 HydrophobicContact CG1-CB 4.05Å; V516-F521 HydrophobicContact CG1-CD2 4.48Å; S517-F521 WeakPolarHBondContact O-CB 3.28Å; S517-F521 PolarHBondContact O-N 3.37Å; D518-F521 PolarHBondContact O-N 2.81Å; D519-F521 VanDerWaalsContact C-N 3.33Å; F521-T523 VanDerWaalsContact C-N 3.31Å; F521-T523 PolarHBondContact O-N 3.15Å; F521-E524 WeakPolarHBondContact O-CA 3.3Å; F521-E524 WeakPolarHBondContact O-CB 3.49Å; F521-E524 PolarHBondContact O-N 2.87Å; F521-L525 HydrophobicContact CD1-CD1 3.87Å; F521-L525 HydrophobicContact CD1-CG 4.21Å; F521-L525 HydrophobicContact CE1-CD1 3.8Å; F521-L525 HydrophobicContact CE1-CD2 3.94Å; F521-L525 HydrophobicContact CE1-CG 4.09Å; F521-L525 HydrophobicContact CE2-CD2 4.34Å; F521-L525 HydrophobicContact CZ-CD2 3.84Å; F521-L525 HydrophobicContact CZ-CG 4.38Å; F521-L525 WeakPolarHBondContact O-CG 3.19Å; F521-L525 PolarHBondContact O-N 3.46Å; F521-Y538 HydrophobicContact CD1-CE1 4.16Å; F521-Y538 AromaticContact CD1-CE2 3.86Å; F521-Y538 HydrophobicContact CD1-CE2 3.86Å; F521-Y538 AromaticContact CD1-CZ 3.59Å; F521-Y538 HydrophobicContact CE1-CD2 4.26Å; F521-Y538 AromaticContact CE1-CE2 3.83Å; F521-Y538 HydrophobicContact CE1-CE2 3.83Å
522	L	91.9	Very high	92.3	Very high	33 Å²	33	52.5 Å²	52.5	17%	0.173	30%	0.296	C	S	.	.	H	α-helix	trans	-56.1	-43	174.7	-76.9	166	0	0	0	112.6	D518 E524 L525 E526 L535 Y538 K539 Y544	D518-L522 WeakPolarHBondContact O-CB 3.32Å; D518-L522 VanDerWaalsContact O-CG 3.28Å; D518-L522 WeakPolarHBondContact O-CG 3.31Å; D518-L522 PolarHBondContact O-N 3.13Å; L522-E524 PolarHBondContact O-N 3.08Å; L522-L525 HydrophobicContact CD2-CD1 4.4Å; L522-L525 PolarHBondContact O-N 2.99Å; L522-E526 WeakPolarHBondContact O-CB 3.3Å; L522-E526 PolarHBondContact O-N 3.01Å; L522-L535 HydrophobicContact CD2-CD1 3.85Å; L522-Y538 HydrophobicContact CD2-CD1 4.12Å; L522-Y538 HydrophobicContact CD2-CE1 3.76Å; L522-Y538 HydrophobicContact CG-CE1 4.09Å; L522-K539 HydrophobicContact CD2-CG 4.45Å; L522-Y544 HydrophobicContact CD1-CE1 4.29Å; L522-Y544 HydrophobicContact CD1-CE2 4.21Å; L522-Y544 VanDerWaalsContact CD1-OH 3.31Å; L522-Y544 WeakPolarHBondContact CD1-OH 3.48Å
523	T	93.5	Very high	92.3	Very high	79 Å²	79	57 Å²	57	49%	0.485	32%	0.32	S	S	.	.	H	α-helix	trans	-64	-26.7	176.1	-53.2	0	0	0	0	112.4	R492 D519 I520 F521	R492-T523 PolarHBondContact NH2-O 3.38Å; D519-T523 WeakPolarHBondContact O-CB 3.47Å; D519-T523 PolarHBondContact O-N 3.02Å; D519-T523 PolarHBondContact O-OG1 3.4Å; I520-T523 PolarHBondContact O-N 3.4Å; F521-T523 VanDerWaalsContact C-N 3.31Å; F521-T523 PolarHBondContact O-N 3.15Å
524	E	95.6	Very high	92.2	Very high	13 Å²	13	56.5 Å²	56.5	6%	0.061	32%	0.318	C	S	.	.	H	α-helix	trans	-79.4	-43.1	174.4	-69	-82	151.3	0	0	111.5	R492 H493 I500 I520 F521 L522 E526 F527 F528	R492-E524 IonicContact CZ-OE1 2.74Å; R492-E524 IonicContact CZ-OE2 2.81Å; R492-E524 VanDerWaalsContact CZ-OE2 3.25Å; R492-E524 IonicContact NE-OE1 2.68Å; R492-E524 IonicContact NE-OE2 3.36Å; R492-E524 PolarHBondContact NH1-O 3.02Å; R492-E524 IonicContact NH1-OE1 3.08Å; R492-E524 PolarHBondContact NH1-OE1 3.39Å; R492-E524 IonicContact NH1-OE2 3.55Å; R492-E524 PolarHBondContact NH1-OE2 3.17Å; R492-E524 IonicContact NH2-OE1 2.85Å; R492-E524 PolarHBondContact NH2-OE1 3.04Å; R492-E524 IonicContact NH2-OE2 3.92Å; H493-E524 HydrophobicContact CB-CG 3.99Å; H493-E524 VanDerWaalsContact CB-OE1 3.23Å; H493-E524 WeakPolarHBondContact CB-OE1 3.12Å; H493-E524 PolarHBondContact N-OE1 3.17Å; I500-E524 HydrophobicContact CD1-CB 3.87Å; I520-E524 VanDerWaalsContact O-CG 3.25Å; I520-E524 WeakPolarHBondContact O-CG 3.36Å; I520-E524 PolarHBondContact O-N 2.66Å; F521-E524 WeakPolarHBondContact O-CA 3.3Å; F521-E524 WeakPolarHBondContact O-CB 3.49Å; F521-E524 PolarHBondContact O-N 2.87Å; L522-E524 PolarHBondContact O-N 3.08Å; E524-E526 PolarHBondContact O-N 3.38Å; E524-F527 PolarHBondContact O-N 3.41Å; E524-F528 VanDerWaalsContact O-CD2 3.25Å; E524-F528 WeakPolarHBondContact O-CD2 3.06Å; E524-F528 PolarHBondContact O-N 3.09Å; E524-F528 VanDerWaalsContact O-N 3.13Å
525	L	94.8	Very high	92.3	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-60.4	-42.1	175.4	-59.7	174.8	0	0	0	113.1	I500 L510 F521 L522 F528 Q529 I530 L535 Y538	I500-L525 HydrophobicContact CD1-CD2 4.42Å; I500-L525 HydrophobicContact CG1-CD2 3.88Å; L510-L525 HydrophobicContact CD1-CD2 3.77Å; L510-L525 HydrophobicContact CD2-CD1 3.63Å; L510-L525 HydrophobicContact CD2-CD2 3.53Å; L510-L525 HydrophobicContact CD2-CG 4.21Å; L510-L525 HydrophobicContact CG-CD2 4.22Å; F521-L525 HydrophobicContact CD1-CD1 3.87Å; F521-L525 HydrophobicContact CD1-CG 4.21Å; F521-L525 HydrophobicContact CE1-CD1 3.8Å; F521-L525 HydrophobicContact CE1-CD2 3.94Å; F521-L525 HydrophobicContact CE1-CG 4.09Å; F521-L525 HydrophobicContact CE2-CD2 4.34Å; F521-L525 HydrophobicContact CZ-CD2 3.84Å; F521-L525 HydrophobicContact CZ-CG 4.38Å; F521-L525 WeakPolarHBondContact O-CG 3.19Å; F521-L525 PolarHBondContact O-N 3.46Å; L522-L525 HydrophobicContact CD2-CD1 4.4Å; L522-L525 PolarHBondContact O-N 2.99Å; L525-F528 PolarHBondContact O-N 3.01Å; L525-Q529 PolarHBondContact O-N 3.18Å; L525-Q529 VanDerWaalsContact O-N 3.11Å; L525-I530 HydrophobicContact CB-CB 4.44Å; L525-I530 HydrophobicContact CB-CG1 4.29Å; L525-I530 HydrophobicContact CD2-CG1 3.95Å; L525-I530 PolarHBondContact O-N 3.42Å; L525-I530 VanDerWaalsContact O-N 3.14Å; L525-L535 HydrophobicContact CB-CD1 4.15Å; L525-L535 HydrophobicContact CD1-CD1 3.63Å; L525-Y538 HydrophobicContact CD1-CD1 3.91Å; L525-Y538 HydrophobicContact CD1-CE1 4.13Å; L525-Y538 HydrophobicContact CD1-CG 4.44Å
526	E	94.2	Very high	92.1	Very high	144 Å²	144	51 Å²	51	67%	0.673	27%	0.27	S	S	*	.	H	α-helix	trans	-62.6	-47.2	-179.9	-178.4	168.2	-140.8	0	0	111.5	L522 E524 Q529	L522-E526 WeakPolarHBondContact O-CB 3.3Å; L522-E526 PolarHBondContact O-N 3.01Å; E524-E526 PolarHBondContact O-N 3.38Å; E526-Q529 PolarHBondContact O-N 3.18Å; E526-Q529 VanDerWaalsContact O-N 3.1Å
527	F	96.1	Very high	91.9	Very high	66 Å²	66	54.4 Å²	54.4	29%	0.289	29%	0.29	S	S	.	.	H	α-helix	trans	-62.6	-43.8	176.1	169.7	-82.8	0	0	0	112.7	L470 F480 F490 R492 E524 Q529	L470-F527 HydrophobicContact CD1-CD1 4.25Å; L470-F527 HydrophobicContact CD1-CE1 3.86Å; L470-F527 HydrophobicContact CD1-CZ 4.1Å; L470-F527 VanDerWaalsContact CD1-O 3.26Å; L470-F527 WeakPolarHBondContact CD1-O 3.34Å; F480-F527 AromaticContact CE1-CZ 3.92Å; F480-F527 HydrophobicContact CE1-CZ 3.92Å; F480-F527 HydrophobicContact CZ-CE2 4.38Å; F480-F527 AromaticContact CZ-CZ 3.8Å; F480-F527 HydrophobicContact CZ-CZ 3.8Å; F490-F527 AromaticContact CD1-CE1 3.81Å; F490-F527 HydrophobicContact CD1-CE1 3.81Å; F490-F527 AromaticContact CD1-CZ 3.98Å; F490-F527 HydrophobicContact CD1-CZ 3.98Å; F490-F527 HydrophobicContact CE1-CE1 4.01Å; F490-F527 HydrophobicContact CE1-CZ 4.22Å; R492-F527 VanDerWaalsContact NH1-CB 3.3Å; R492-F527 VanDerWaalsContact NH1-CG 3.28Å; E524-F527 PolarHBondContact O-N 3.41Å; F527-Q529 PolarHBondContact O-N 3.45Å
528	F	96.5	Very high	92	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	0.3	177.5	-74.1	-69.4	0	0	0	113.1	L470 L471 F490 R492 F497 I500 E524 L525 I530	L470-F528 WeakPolarHBondContact CB-O 3.5Å; L470-F528 HydrophobicContact CD2-CD1 4.27Å; L470-F528 PolarHBondContact N-O 3.06Å; L471-F528 HydrophobicContact CD1-CD1 4.21Å; L471-F528 HydrophobicContact CD1-CE1 4.44Å; L471-F528 HydrophobicContact CD2-CD1 4.43Å; L471-F528 HydrophobicContact CD2-CE1 4.38Å; L471-F528 HydrophobicContact CG-CD1 4.08Å; L471-F528 HydrophobicContact CG-CE1 4.45Å; F490-F528 AromaticContact CD1-CE1 3.92Å; F490-F528 HydrophobicContact CD1-CE1 3.92Å; F490-F528 HydrophobicContact CD1-CZ 4.21Å; F490-F528 HydrophobicContact CD2-CE1 4.38Å; F490-F528 AromaticContact CE1-CE1 3.9Å; F490-F528 HydrophobicContact CE1-CE1 3.9Å; F490-F528 HydrophobicContact CE2-CE1 4.36Å; F490-F528 HydrophobicContact CG-CE1 4.17Å; F490-F528 HydrophobicContact CG-CZ 4.22Å; F490-F528 HydrophobicContact CZ-CE1 4.13Å; R492-F528 VanDerWaalsContact NH1-CE2 3.29Å; F497-F528 HydrophobicContact CD2-CE1 4.18Å; F497-F528 AromaticContact CD2-CE2 3.73Å; F497-F528 HydrophobicContact CD2-CE2 3.73Å; F497-F528 AromaticContact CD2-CZ 3.53Å; F497-F528 HydrophobicContact CD2-CZ 3.53Å; F497-F528 HydrophobicContact CE2-CD1 4.4Å; F497-F528 AromaticContact CE2-CE1 3.72Å; F497-F528 HydrophobicContact CE2-CE1 3.72Å; F497-F528 HydrophobicContact CE2-CE2 4.11Å; F497-F528 AromaticContact CE2-CZ 3.55Å; F497-F528 HydrophobicContact CE2-CZ 3.55Å; I500-F528 HydrophobicContact CD1-CD2 3.65Å; I500-F528 HydrophobicContact CD1-CE2 4.1Å; I500-F528 HydrophobicContact CG1-CD2 4.49Å; I500-F528 HydrophobicContact CG2-CB 4.25Å; I500-F528 HydrophobicContact CG2-CD2 4.09Å; I500-F528 HydrophobicContact CG2-CG 4.08Å; E524-F528 VanDerWaalsContact O-CD2 3.25Å; E524-F528 WeakPolarHBondContact O-CD2 3.06Å; E524-F528 PolarHBondContact O-N 3.09Å; E524-F528 VanDerWaalsContact O-N 3.13Å; L525-F528 PolarHBondContact O-N 3.01Å; F528-I530 VanDerWaalsContact C-N 3.31Å; F528-I530 HydrophobicContact CB-CD1 4.35Å; F528-I530 HydrophobicContact CB-CG1 4.39Å; F528-I530 PolarHBondContact O-N 3.41Å
529	Q	95	Very high	92	Very high	89 Å²	89	54.3 Å²	54.3	42%	0.416	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	45.5	176.8	-56.3	-178.6	10.9	0	0	112.1	T469 L525 E526 F527	T469-Q529 WeakPolarHBondContact CA-O 3.42Å; T469-Q529 WeakPolarHBondContact CB-O 3.36Å; T469-Q529 WeakPolarHBondContact CG2-O 3.44Å; L525-Q529 PolarHBondContact O-N 3.18Å; L525-Q529 VanDerWaalsContact O-N 3.11Å; E526-Q529 PolarHBondContact O-N 3.18Å; E526-Q529 VanDerWaalsContact O-N 3.1Å; F527-Q529 PolarHBondContact O-N 3.45Å
530	I	95	Very high	91.8	Very high	12 Å²	12	58 Å²	58	6%	0.062	30%	0.296	C	S	.	.			trans	-61.8	139.9	176.1	-59.5	-59.1	0	0	0	110.1	I500 Y503 Y504 L510 L525 F528 S532 A534	I500-I530 HydrophobicContact CG2-CD1 4.38Å; Y503-I530 HydrophobicContact CD1-CD1 3.88Å; Y503-I530 HydrophobicContact CD2-CG2 4.3Å; Y503-I530 HydrophobicContact CE1-CD1 3.79Å; Y503-I530 HydrophobicContact CE1-CG2 4.4Å; Y503-I530 HydrophobicContact CE2-CG2 3.84Å; Y504-I530 HydrophobicContact CE2-CD1 4.47Å; L510-I530 HydrophobicContact CD2-CG2 4.43Å; L525-I530 HydrophobicContact CB-CB 4.44Å; L525-I530 HydrophobicContact CB-CG1 4.29Å; L525-I530 HydrophobicContact CD2-CG1 3.95Å; L525-I530 PolarHBondContact O-N 3.42Å; L525-I530 VanDerWaalsContact O-N 3.14Å; F528-I530 VanDerWaalsContact C-N 3.31Å; F528-I530 HydrophobicContact CB-CD1 4.35Å; F528-I530 HydrophobicContact CB-CG1 4.39Å; F528-I530 PolarHBondContact O-N 3.41Å; I530-S532 PolarHBondContact O-N 3.27Å; I530-A534 HydrophobicContact CG2-CB 4.27Å
531	E	93.3	Very high	91.4	Very high	53 Å²	53	59.5 Å²	59.5	25%	0.248	30%	0.304	C	S	.	.			trans	-55.3	135.4	-173.4	-74.3	159.5	175.4	0	0	112.2	H466 T468 T469 Y503 E533 A534 L535	H466-E531 IonicContact CE1-OE2 2.81Å; H466-E531 IonicContact CG-OE1 2.71Å; H466-E531 IonicContact CG-OE2 3.99Å; H466-E531 IonicContact ND1-OE1 3.17Å; H466-E531 PolarHBondContact ND1-OE1 3.43Å; H466-E531 IonicContact ND1-OE2 3.89Å; H466-E531 PolarHBondContact ND1-OE2 3.45Å; T468-E531 WeakPolarHBondContact OG1-CG 3.48Å; T468-E531 PolarHBondContact OG1-OE1 3.37Å; T469-E531 HydrophobicContact CG2-CG 4.28Å; Y503-E531 VanDerWaalsContact OH-CD 3.26Å; Y503-E531 PolarHBondContact OH-OE2 3.35Å; E531-E533 PolarHBondContact O-N 3.23Å; E531-A534 PolarHBondContact O-N 3.22Å; E531-L535 PolarHBondContact O-N 3.29Å
532	S	89.9	Confident	90.9	Very high	88 Å²	88	61.9 Å²	61.9	62%	0.615	32%	0.316	S	S	*	.	H	α-helix	trans	-59.6	-33.7	-171.6	52.3	0	0	0	0	113.3	I530 L535 D536	I530-S532 PolarHBondContact O-N 3.27Å; S532-L535 PolarHBondContact O-N 2.88Å; S532-D536 WeakPolarHBondContact O-CB 3.25Å; S532-D536 PolarHBondContact O-N 2.95Å
533	E	90.4	Very high	90.1	Very high	158 Å²	158	60.3 Å²	60.3	74%	0.738	31%	0.308	S	S	*	.	H	α-helix	trans	-62.2	-48.5	174.2	-177.5	171.9	-172.2	0	0	111.9	E531 L535 D536 V537	E531-E533 PolarHBondContact O-N 3.23Å; E533-L535 VanDerWaalsContact C-N 3.33Å; E533-L535 PolarHBondContact O-N 2.9Å; E533-D536 PolarHBondContact O-N 2.97Å; E533-V537 WeakPolarHBondContact O-CB 3.35Å; E533-V537 WeakPolarHBondContact O-CG2 3.44Å; E533-V537 PolarHBondContact O-N 3.47Å
534	A	91.5	Very high	89.2	Confident	16 Å²	16	58.4 Å²	58.4	13%	0.132	29%	0.292	C	S	.	.	H	α-helix	trans	-65.5	-37.4	177	0	0	0	0	0	111.9	Y503 I530 E531 Y538	Y503-A534 HydrophobicContact CD2-CB 4.43Å; Y503-A534 HydrophobicContact CE2-CB 3.68Å; I530-A534 HydrophobicContact CG2-CB 4.27Å; E531-A534 PolarHBondContact O-N 3.22Å; A534-Y538 WeakPolarHBondContact O-CB 3.16Å; A534-Y538 PolarHBondContact O-N 3.24Å
535	L	90.6	Very high	87.9	Confident	32 Å²	32	61.2 Å²	61.2	17%	0.168	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-39	175.1	-178.6	64.4	0	0	0	112.2	L522 L525 E531 S532 E533 Y538 K539	L522-L535 HydrophobicContact CD2-CD1 3.85Å; L525-L535 HydrophobicContact CB-CD1 4.15Å; L525-L535 HydrophobicContact CD1-CD1 3.63Å; E531-L535 PolarHBondContact O-N 3.29Å; S532-L535 PolarHBondContact O-N 2.88Å; E533-L535 VanDerWaalsContact C-N 3.33Å; E533-L535 PolarHBondContact O-N 2.9Å; L535-Y538 HydrophobicContact CD1-CD1 4.49Å; L535-Y538 PolarHBondContact O-N 3.11Å; L535-K539 WeakPolarHBondContact O-CB 3.27Å; L535-K539 VanDerWaalsContact O-CG 3.26Å; L535-K539 WeakPolarHBondContact O-CG 3.36Å; L535-K539 PolarHBondContact O-N 3.35Å
536	D	87.2	Confident	86.3	Confident	84 Å²	84	65.5 Å²	65.5	45%	0.449	34%	0.338	S	S	.	.	H	α-helix	trans	-77.9	-32.2	179.2	-74.7	-8.5	0	0	0	112.5	S532 E533 K539 K540	S532-D536 WeakPolarHBondContact O-CB 3.25Å; S532-D536 PolarHBondContact O-N 2.95Å; E533-D536 PolarHBondContact O-N 2.97Å; D536-K539 WeakPolarHBondContact OD1-CD 3.12Å; D536-K539 IonicContact OD1-NZ 3.34Å; D536-K539 PolarHBondContact OD1-NZ 3.47Å; D536-K540 WeakPolarHBondContact O-CB 3.29Å; D536-K540 PolarHBondContact O-N 3.22Å
537	V	88.2	Confident	84.9	Confident	76 Å²	76	64.5 Å²	64.5	46%	0.461	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-45.6	166.2	169.6	0	0	0	0	110.8	E533 K540 N541	E533-V537 WeakPolarHBondContact O-CB 3.35Å; E533-V537 WeakPolarHBondContact O-CG2 3.44Å; E533-V537 PolarHBondContact O-N 3.47Å; V537-K540 PolarHBondContact O-N 3.47Å; V537-N541 WeakPolarHBondContact O-CB 3.33Å; V537-N541 PolarHBondContact O-N 3.33Å; V537-N541 PolarHBondContact O-ND2 3.15Å
538	Y	89.8	Confident	83.5	Confident	7 Å²	7	68 Å²	68	3%	0.027	36%	0.358	C	S	.	.	H	α-helix	trans	-58.9	-52.2	175.2	165.8	-99.3	0	0	0	111.9	L510 R512 D518 F521 L522 L525 A534 L535 K540 N541 E542	L510-Y538 HydrophobicContact CD2-CD2 4.41Å; L510-Y538 HydrophobicContact CD2-CG 4.08Å; R512-Y538 HydrophobicContact CB-CE2 3.77Å; R512-Y538 VanDerWaalsContact CD-OH 3.32Å; R512-Y538 WeakPolarHBondContact CD-OH 3.3Å; R512-Y538 PolarHBondContact NE-OH 2.68Å; D518-Y538 PolarHBondContact OD1-OH 3.39Å; F521-Y538 HydrophobicContact CD1-CE1 4.16Å; F521-Y538 AromaticContact CD1-CE2 3.86Å; F521-Y538 HydrophobicContact CD1-CE2 3.86Å; F521-Y538 AromaticContact CD1-CZ 3.59Å; F521-Y538 HydrophobicContact CE1-CD2 4.26Å; F521-Y538 AromaticContact CE1-CE2 3.83Å; F521-Y538 HydrophobicContact CE1-CE2 3.83Å; L522-Y538 HydrophobicContact CD2-CD1 4.12Å; L522-Y538 HydrophobicContact CD2-CE1 3.76Å; L522-Y538 HydrophobicContact CG-CE1 4.09Å; L525-Y538 HydrophobicContact CD1-CD1 3.91Å; L525-Y538 HydrophobicContact CD1-CE1 4.13Å; L525-Y538 HydrophobicContact CD1-CG 4.44Å; A534-Y538 WeakPolarHBondContact O-CB 3.16Å; A534-Y538 PolarHBondContact O-N 3.24Å; L535-Y538 HydrophobicContact CD1-CD1 4.49Å; L535-Y538 PolarHBondContact O-N 3.11Å; Y538-K540 PolarHBondContact O-N 2.99Å; Y538-N541 PolarHBondContact O-N 3Å; Y538-E542 HydrophobicContact CD2-CG 4.16Å; Y538-E542 HydrophobicContact CE1-CG 4.14Å; Y538-E542 HydrophobicContact CE2-CG 3.47Å; Y538-E542 VanDerWaalsContact CE2-CG 3.47Å; Y538-E542 WeakPolarHBondContact CE2-OE1 3.15Å; Y538-E542 VanDerWaalsContact CZ-CG 3.45Å; Y538-E542 PolarHBondContact O-N 3.45Å; Y538-E542 WeakPolarHBondContact OH-CG 3.43Å; Y538-E542 PolarHBondContact OH-OE1 3.34Å
539	K	86.7	Confident	82.6	Confident	56 Å²	56	71.3 Å²	71.3	24%	0.243	37%	0.374	C	S	.	.	H	α-helix	trans	-50.3	-53.4	174.7	-81.6	173.2	-161	151.1	0	111.3	L522 L535 D536 N541 E542 G543 Y544	L522-K539 HydrophobicContact CD2-CG 4.45Å; L535-K539 WeakPolarHBondContact O-CB 3.27Å; L535-K539 VanDerWaalsContact O-CG 3.26Å; L535-K539 WeakPolarHBondContact O-CG 3.36Å; L535-K539 PolarHBondContact O-N 3.35Å; D536-K539 WeakPolarHBondContact OD1-CD 3.12Å; D536-K539 IonicContact OD1-NZ 3.34Å; D536-K539 PolarHBondContact OD1-NZ 3.47Å; K539-N541 VanDerWaalsContact C-N 3.27Å; K539-N541 PolarHBondContact O-N 2.76Å; K539-E542 PolarHBondContact O-N 2.98Å; K539-G543 PolarHBondContact O-N 2.82Å; K539-G543 VanDerWaalsContact O-N 3.09Å; K539-Y544 HydrophobicContact CB-CD2 4.33Å; K539-Y544 HydrophobicContact CB-CG 4.08Å; K539-Y544 HydrophobicContact CG-CD1 4.49Å; K539-Y544 HydrophobicContact CG-CD2 4.41Å; K539-Y544 HydrophobicContact CG-CG 4.15Å; K539-Y544 WeakPolarHBondContact O-CB 3.36Å; K539-Y544 PolarHBondContact O-N 2.98Å
540	K	82	Confident	81.9	Confident	145 Å²	145	71.1 Å²	71.1	63%	0.63	38%	0.379	S	S	*	.	H	α-helix	trans	-56.3	-42.8	178.3	-175.7	-170	174.2	-165.2	0	111.6	D536 V537 Y538 G543	D536-K540 WeakPolarHBondContact O-CB 3.29Å; D536-K540 PolarHBondContact O-N 3.22Å; V537-K540 PolarHBondContact O-N 3.47Å; Y538-K540 PolarHBondContact O-N 2.99Å; K540-G543 PolarHBondContact O-N 2.91Å
541	N	84	Confident	81.5	Confident	97 Å²	97	72.6 Å²	72.6	52%	0.519	39%	0.387	S	S	.	.	H	α-helix	trans	-69.5	-33.4	-178.2	-70.2	-14.3	0	0	0	113.5	V537 Y538 K539 G543 K804	V537-N541 WeakPolarHBondContact O-CB 3.33Å; V537-N541 PolarHBondContact O-N 3.33Å; V537-N541 PolarHBondContact O-ND2 3.15Å; Y538-N541 PolarHBondContact O-N 3Å; K539-N541 VanDerWaalsContact C-N 3.27Å; K539-N541 PolarHBondContact O-N 2.76Å; N541-G543 VanDerWaalsContact C-N 3.32Å; N541-K804 WeakPolarHBondContact O-CE 3.27Å; N541-K804 PolarHBondContact O-NZ 3.33Å
542	E	83.3	Confident	81.2	Confident	50 Å²	50	70.5 Å²	70.5	23%	0.234	38%	0.378	C	S	.	.	H	α-helix	trans	-76.1	-18.3	171.5	-68.2	-75.6	-179.6	0	0	112.9	R512 Y538 K539 Y544 K804	R512-E542 IonicContact CZ-OE1 2.97Å; R512-E542 IonicContact CZ-OE2 3.33Å; R512-E542 IonicContact NE-OE1 2.9Å; R512-E542 PolarHBondContact NE-OE1 3.22Å; R512-E542 IonicContact NE-OE2 3.94Å; R512-E542 VanDerWaalsContact NH2-CD 3.27Å; R512-E542 IonicContact NH2-OE1 3.1Å; R512-E542 PolarHBondContact NH2-OE1 3.17Å; R512-E542 VanDerWaalsContact NH2-OE1 3.07Å; R512-E542 IonicContact NH2-OE2 3.6Å; R512-E542 PolarHBondContact NH2-OE2 3.04Å; Y538-E542 HydrophobicContact CD2-CG 4.16Å; Y538-E542 HydrophobicContact CE1-CG 4.14Å; Y538-E542 HydrophobicContact CE2-CG 3.47Å; Y538-E542 VanDerWaalsContact CE2-CG 3.47Å; Y538-E542 WeakPolarHBondContact CE2-OE1 3.15Å; Y538-E542 VanDerWaalsContact CZ-CG 3.45Å; Y538-E542 PolarHBondContact O-N 3.45Å; Y538-E542 WeakPolarHBondContact OH-CG 3.43Å; Y538-E542 PolarHBondContact OH-OE1 3.34Å; K539-E542 PolarHBondContact O-N 2.98Å; E542-Y544 HydrophobicContact CB-CD2 4.19Å; E542-Y544 HydrophobicContact CB-CE2 4.41Å; E542-K804 WeakPolarHBondContact O-CE 3.49Å; E542-K804 WeakPolarHBondContact O-CG 3.31Å
543	G	74.1	Confident	80.9	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.01	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	105.8	16.6	178.3	0	0	0	0	0	114.9	K539 K540 N541 V545 H808	K539-G543 PolarHBondContact O-N 2.82Å; K539-G543 VanDerWaalsContact O-N 3.09Å; K540-G543 PolarHBondContact O-N 2.91Å; N541-G543 VanDerWaalsContact C-N 3.32Å; G543-V545 PolarHBondContact O-N 2.88Å; G543-H808 PolarHBondContact O-ND1 3.43Å
544	Y	75.4	Confident	80.9	Confident	39 Å²	39	72.9 Å²	72.9	15%	0.153	38%	0.383	C	S	.	.			trans	-66.9	118.3	163.5	-72.6	-107.2	0	0	0	109.3	D518 L522 K539 E542 P546 H808	D518-Y544 WeakPolarHBondContact OD2-CE2 3.19Å; D518-Y544 PolarHBondContact OD2-OH 3.37Å; L522-Y544 HydrophobicContact CD1-CE1 4.29Å; L522-Y544 HydrophobicContact CD1-CE2 4.21Å; L522-Y544 VanDerWaalsContact CD1-OH 3.31Å; L522-Y544 WeakPolarHBondContact CD1-OH 3.48Å; K539-Y544 HydrophobicContact CB-CD2 4.33Å; K539-Y544 HydrophobicContact CB-CG 4.08Å; K539-Y544 HydrophobicContact CG-CD1 4.49Å; K539-Y544 HydrophobicContact CG-CD2 4.41Å; K539-Y544 HydrophobicContact CG-CG 4.15Å; K539-Y544 WeakPolarHBondContact O-CB 3.36Å; K539-Y544 PolarHBondContact O-N 2.98Å; E542-Y544 HydrophobicContact CB-CD2 4.19Å; E542-Y544 HydrophobicContact CB-CE2 4.41Å; Y544-P546 WeakPolarHBondContact O-CD 3.46Å; Y544-H808 AromaticContact CD1-CD2 3.99Å; Y544-H808 AromaticContact CD1-CE1 3.76Å; Y544-H808 AromaticContact CD1-NE2 3.28Å; Y544-H808 VanDerWaalsContact CD1-NE2 3.28Å; Y544-H808 WeakPolarHBondContact CD1-NE2 3.48Å; Y544-H808 AromaticContact CE1-CD2 3.8Å; Y544-H808 AromaticContact CE1-NE2 3.3Å; Y544-H808 VanDerWaalsContact CE1-NE2 3.3Å; Y544-H808 WeakPolarHBondContact CE1-NE2 3.4Å; Y544-H808 AromaticContact CG-NE2 3.81Å; Y544-H808 AromaticContact CZ-CD2 3.82Å; Y544-H808 AromaticContact CZ-NE2 3.84Å
545	V	68.6	Low	80.8	Confident	71 Å²	71	78.3 Å²	78.3	43%	0.43	41%	0.409	S	S	.	.			trans	-94.2	111.9	163.5	-179.8	0	0	0	0	107.4	G543 D547 L708	G543-V545 PolarHBondContact O-N 2.88Å; V545-D547 PolarHBondContact O-N 3.13Å; V545-D547 VanDerWaalsContact O-N 3.13Å; V545-L708 HydrophobicContact CG2-CD1 4.38Å; V545-L708 HydrophobicContact CG2-CD2 3.54Å
546	P	61.4	Low	80.9	Confident	92 Å²	92	83.1 Å²	83.1	60%	0.597	43%	0.433	S	S	*	.			trans	-73.6	101.3	171.5	29.2	-32.2	0	0	0	109.3	Y544 I548	Y544-P546 WeakPolarHBondContact O-CD 3.46Å; P546-I548 VanDerWaalsContact C-N 3.28Å; P546-I548 HydrophobicContact CB-CG1 4.31Å; P546-I548 PolarHBondContact O-N 3.14Å
547	D	64.2	Low	81.1	Confident	123 Å²	123	82.6 Å²	82.6	66%	0.658	43%	0.427	S	S	*	.			trans	-67.7	89	163.6	-79.6	-44.6	0	0	0	108.3	V545 I549	V545-D547 PolarHBondContact O-N 3.13Å; V545-D547 VanDerWaalsContact O-N 3.13Å; D547-I549 WeakPolarHBondContact O-CG1 3.07Å; D547-I549 PolarHBondContact O-N 3.24Å
548	I	67.6	Low	81.3	Confident	140 Å²	140	83.1 Å²	83.1	72%	0.718	42%	0.421	S	S	*	.			trans	-72.1	93.3	177.9	-57.6	176	0	0	0	108.6	P546 V550	P546-I548 VanDerWaalsContact C-N 3.28Å; P546-I548 HydrophobicContact CB-CG1 4.31Å; P546-I548 PolarHBondContact O-N 3.14Å; I548-V550 VanDerWaalsContact C-N 3.34Å; I548-V550 HydrophobicContact CG2-CG2 4.19Å; I548-V550 PolarHBondContact O-N 2.95Å
549	I	76.3	Confident	81.3	Confident	68 Å²	68	89.2 Å²	89.2	35%	0.349	45%	0.447	S	S	.	.			trans	-73.3	84.6	-179.5	-53.9	-178.6	0	0	0	110	D547 L551 Y566	D547-I549 WeakPolarHBondContact O-CG1 3.07Å; D547-I549 PolarHBondContact O-N 3.24Å; I549-L551 HydrophobicContact CG2-CD2 3.58Å; I549-L551 HydrophobicContact CG2-CG 3.9Å; I549-L551 PolarHBondContact O-N 3.39Å; I549-Y566 HydrophobicContact CD1-CE1 4.22Å; I549-Y566 HydrophobicContact CG1-CE1 4.42Å; I549-Y566 HydrophobicContact CG2-CE2 4.18Å
550	V	81	Confident	81.6	Confident	86 Å²	86	89.6 Å²	89.6	52%	0.521	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-72.2	120.2	166.5	-173	0	0	0	0	108.5	I548 P639	I548-V550 VanDerWaalsContact C-N 3.34Å; I548-V550 HydrophobicContact CG2-CG2 4.19Å; I548-V550 PolarHBondContact O-N 2.95Å; V550-P639 HydrophobicContact CB-CG 4.19Å; V550-P639 HydrophobicContact CG1-CB 3.72Å; V550-P639 HydrophobicContact CG1-CG 3.86Å; V550-P639 VanDerWaalsContact O-CG 3.23Å; V550-P639 WeakPolarHBondContact O-CG 3.49Å
551	L	85.4	Confident	82	Confident	43 Å²	43	83.8 Å²	83.8	23%	0.225	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-104	141.5	178.5	-63.6	175.1	0	0	0	110.3	I549 M562	I549-L551 HydrophobicContact CG2-CD2 3.58Å; I549-L551 HydrophobicContact CG2-CG 3.9Å; I549-L551 PolarHBondContact O-N 3.39Å; L551-M562 HydrophobicContact CD2-SD 3.77Å
552	P	88	Confident	82.3	Confident	9 Å²	9	81.9 Å²	81.9	6%	0.058	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-70.1	142.3	172.8	33.1	-37.4	0	0	0	110	K557 R558 W561 S637	P552-K557 HydrophobicContact CB-CB 3.87Å; P552-K557 HydrophobicContact CB-CD 4.49Å; P552-K557 HydrophobicContact CG-CB 3.82Å; P552-R558 HydrophobicContact CG-CB 4.15Å; P552-W561 HydrophobicContact CG-CB 4.15Å; P552-W561 HydrophobicContact CG-CG 4.47Å; P552-S637 WeakPolarHBondContact CG-O 3.23Å
553	E	84.1	Confident	82.7	Confident	187 Å²	187	80.9 Å²	80.9	87%	0.874	41%	0.411	S	S	*	.	S	Bend	trans	-63.6	-44.4	-175.5	-60.6	172	167.7	0	0	112.5	L555	E553-L555 PolarHBondContact O-N 3.43Å
554	N	89.1	Confident	83.5	Confident	108 Å²	108	81.8 Å²	81.8	58%	0.578	41%	0.414	S	S	*	.	S	Bend	trans	-65.2	120.6	-177.4	-77.3	-27.1	0	0	0	111.9	I556 K557 R558	N554-I556 PolarHBondContact O-N 3.19Å; N554-I556 VanDerWaalsContact O-N 3.08Å; N554-K557 HydrophobicContact CB-CB 4.19Å; N554-K557 HydrophobicContact CB-CG 4.16Å; N554-K557 WeakPolarHBondContact O-CA 3.3Å; N554-K557 WeakPolarHBondContact O-CB 3.4Å; N554-K557 PolarHBondContact O-N 2.72Å; N554-R558 PolarHBondContact O-N 3.21Å
555	L	90.7	Very high	84	Confident	130 Å²	130	80.9 Å²	80.9	68%	0.681	41%	0.412	S	S	*	.	H	α-helix	trans	-52.8	-36.1	-175.5	-62.4	178.6	0	0	0	114.3	E553 K559	E553-L555 PolarHBondContact O-N 3.43Å; L555-K559 WeakPolarHBondContact O-CG 3.22Å; L555-K559 PolarHBondContact O-N 3.38Å
556	I	91.2	Very high	84.9	Confident	133 Å²	133	80.7 Å²	80.7	68%	0.682	40%	0.404	S	S	*	.	H	α-helix	trans	-69.9	-48.4	177.2	-59.4	176.2	0	0	0	110.6	N554 R558 K559 L560	N554-I556 PolarHBondContact O-N 3.19Å; N554-I556 VanDerWaalsContact O-N 3.08Å; I556-R558 VanDerWaalsContact C-N 3.27Å; I556-R558 PolarHBondContact O-N 3.21Å; I556-K559 PolarHBondContact O-N 2.88Å; I556-L560 HydrophobicContact CG2-CD1 4.2Å; I556-L560 PolarHBondContact O-N 3.45Å
557	K	91.9	Very high	86	Confident	73 Å²	73	78.2 Å²	78.2	32%	0.317	39%	0.387	S	S	.	.	H	α-helix	trans	-58.2	-41.5	173.6	-70	-162.3	175.9	-155.1	0	110.9	P552 N554 K559 L560 W561 I636	P552-K557 HydrophobicContact CB-CB 3.87Å; P552-K557 HydrophobicContact CB-CD 4.49Å; P552-K557 HydrophobicContact CG-CB 3.82Å; N554-K557 HydrophobicContact CB-CB 4.19Å; N554-K557 HydrophobicContact CB-CG 4.16Å; N554-K557 WeakPolarHBondContact O-CA 3.3Å; N554-K557 WeakPolarHBondContact O-CB 3.4Å; N554-K557 PolarHBondContact O-N 2.72Å; K557-K559 PolarHBondContact O-N 2.81Å; K557-L560 PolarHBondContact O-N 2.71Å; K557-W561 WeakPolarHBondContact O-CB 3.42Å; K557-W561 PolarHBondContact O-N 3.2Å; K557-I636 WeakPolarHBondContact CE-O 3.16Å; K557-I636 PolarHBondContact NZ-O 3.38Å
558	R	91.9	Very high	86.9	Confident	88 Å²	88	79.3 Å²	79.3	33%	0.332	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-43.6	177.7	-171.5	173.6	170.5	169.9	1.1	111.8	P552 N554 I556 M562	P552-R558 HydrophobicContact CG-CB 4.15Å; N554-R558 PolarHBondContact O-N 3.21Å; I556-R558 VanDerWaalsContact C-N 3.27Å; I556-R558 PolarHBondContact O-N 3.21Å; R558-M562 WeakPolarHBondContact O-CB 3.46Å; R558-M562 WeakPolarHBondContact O-CG 3.1Å; R558-M562 PolarHBondContact O-N 3.04Å
559	K	90.7	Very high	87.8	Confident	135 Å²	135	75.5 Å²	75.5	59%	0.587	37%	0.372	S	S	*	.	H	α-helix	trans	-62.5	-46.7	174.7	-76.3	177.7	177.7	-177.1	0	112.1	L555 I556 K557 L563	L555-K559 WeakPolarHBondContact O-CG 3.22Å; L555-K559 PolarHBondContact O-N 3.38Å; I556-K559 PolarHBondContact O-N 2.88Å; K557-K559 PolarHBondContact O-N 2.81Å; K559-L563 VanDerWaalsContact O-CB 3.29Å; K559-L563 WeakPolarHBondContact O-CB 3.44Å; K559-L563 PolarHBondContact O-N 3Å
560	L	92.7	Very high	88.4	Confident	64 Å²	64	74.7 Å²	74.7	34%	0.335	37%	0.372	S	S	.	.	H	α-helix	trans	-66.9	-41.1	179	-68.9	172.9	0	0	0	112.7	I556 K557 L563 F564 I633 S637	I556-L560 HydrophobicContact CG2-CD1 4.2Å; I556-L560 PolarHBondContact O-N 3.45Å; K557-L560 PolarHBondContact O-N 2.71Å; L560-L563 PolarHBondContact O-N 2.92Å; L560-F564 PolarHBondContact O-N 3.27Å; L560-I633 HydrophobicContact CB-CG2 4.34Å; L560-S637 VanDerWaalsContact CB-OG 3.25Å; L560-S637 WeakPolarHBondContact CB-OG 3.37Å
561	W	91.5	Very high	88.9	Confident	23 Å²	23	75.9 Å²	75.9	9%	0.087	37%	0.374	C	S	.	.	H	α-helix	trans	-61.8	-48.3	175.3	-173.7	-109.1	0	0	0	111.2	P552 K557 L563 F564 E565 Y566 R634 C638 F644	P552-W561 HydrophobicContact CG-CB 4.15Å; P552-W561 HydrophobicContact CG-CG 4.47Å; K557-W561 WeakPolarHBondContact O-CB 3.42Å; K557-W561 PolarHBondContact O-N 3.2Å; W561-L563 VanDerWaalsContact C-N 3.29Å; W561-L563 PolarHBondContact O-N 2.81Å; W561-F564 PolarHBondContact O-N 3.03Å; W561-E565 HydrophobicContact CD2-CB 4.42Å; W561-E565 HydrophobicContact CZ2-CG 4.14Å; W561-E565 WeakPolarHBondContact O-CB 3.36Å; W561-E565 PolarHBondContact O-N 3.47Å; W561-Y566 AromaticContact NE1-CE2 3.97Å; W561-R634 HydrophobicContact CZ3-CB 4.18Å; W561-R634 WeakPolarHBondContact CZ3-O 3.43Å; W561-C638 HydrophobicContact CE3-CB 4Å; W561-C638 HydrophobicContact CH2-CB 3.86Å; W561-C638 HydrophobicContact CZ3-CB 3.47Å; W561-C638 VanDerWaalsContact CZ3-CB 3.47Å; W561-F644 AromaticContact CH2-CD2 3.91Å; W561-F644 HydrophobicContact CH2-CD2 3.91Å; W561-F644 HydrophobicContact CH2-CE2 4.03Å; W561-F644 HydrophobicContact CZ3-CD2 4.05Å; W561-F644 AromaticContact CZ3-CE2 3.94Å; W561-F644 HydrophobicContact CZ3-CE2 3.94Å
562	M	89.8	Confident	89.3	Confident	56 Å²	56	78.3 Å²	78.3	28%	0.276	39%	0.387	S	S	.	.	H	α-helix	trans	-61	-38.3	175.7	-67.8	-67.8	-85.5	0	0	112.1	L551 R558 Y566 T569	L551-M562 HydrophobicContact CD2-SD 3.77Å; R558-M562 WeakPolarHBondContact O-CB 3.46Å; R558-M562 WeakPolarHBondContact O-CG 3.1Å; R558-M562 PolarHBondContact O-N 3.04Å; M562-Y566 PolarHBondContact O-N 3.01Å; M562-Y566 VanDerWaalsContact O-O 3.11Å; M562-Y566 HydrophobicContact SD-CD2 3.74Å; M562-Y566 HydrophobicContact SD-CE2 4.25Å; M562-T569 HydrophobicContact CB-CG2 4.26Å; M562-T569 HydrophobicContact CE-CG2 3.51Å; M562-T569 PolarHBondContact O-OG1 3.1Å; M562-T569 HydrophobicContact SD-CG2 4.26Å
563	L	91.3	Very high	89.4	Confident	29 Å²	29	78 Å²	78	15%	0.152	39%	0.385	C	S	.	.	H	α-helix	trans	-66.3	-41.2	178.8	-175.1	69.8	0	0	0	113.6	K559 L560 W561 L572 A573 F576	K559-L563 VanDerWaalsContact O-CB 3.29Å; K559-L563 WeakPolarHBondContact O-CB 3.44Å; K559-L563 PolarHBondContact O-N 3Å; L560-L563 PolarHBondContact O-N 2.92Å; W561-L563 VanDerWaalsContact C-N 3.29Å; W561-L563 PolarHBondContact O-N 2.81Å; L563-L572 HydrophobicContact CD1-CB 3.92Å; L563-L572 HydrophobicContact CD1-CD2 3.85Å; L563-L572 HydrophobicContact CD1-CG 3.81Å; L563-L572 HydrophobicContact CD2-CD2 4.43Å; L563-A573 HydrophobicContact CD1-CB 4.05Å; L563-A573 WeakPolarHBondContact O-CB 3.49Å; L563-F576 HydrophobicContact CD1-CD2 4.09Å; L563-F576 HydrophobicContact CD2-CD2 4.22Å; L563-F576 HydrophobicContact CD2-CE2 4.16Å; L563-F576 HydrophobicContact CG-CD2 4.18Å
564	F	90.4	Very high	89.7	Confident	20 Å²	20	72.6 Å²	72.6	9%	0.088	36%	0.359	C	S	.	.	H	α-helix	trans	-98.1	-15.4	-174.7	-83.1	-94.6	0	0	0	114.7	L560 W561 F576 E630 I633 R634	L560-F564 PolarHBondContact O-N 3.27Å; W561-F564 PolarHBondContact O-N 3.03Å; F564-F576 HydrophobicContact CZ-CD1 4.23Å; F564-F576 HydrophobicContact CZ-CE1 4.37Å; F564-E630 HydrophobicContact CD1-CG 4.05Å; F564-E630 HydrophobicContact CE1-CG 4.33Å; F564-I633 HydrophobicContact CD2-CG2 3.63Å; F564-I633 HydrophobicContact CE1-CD1 4.23Å; F564-I633 HydrophobicContact CE2-CB 4.47Å; F564-I633 HydrophobicContact CE2-CD1 3.9Å; F564-I633 HydrophobicContact CE2-CG2 3.78Å; F564-I633 HydrophobicContact CG-CG2 4.08Å; F564-I633 HydrophobicContact CZ-CD1 3.62Å; F564-I633 HydrophobicContact CZ-CG2 4.34Å; F564-R634 HydrophobicContact CB-CG 4.01Å; F564-R634 VanDerWaalsContact O-CZ 3.3Å; F564-R634 PolarHBondContact O-NE 3.2Å; F564-R634 PolarHBondContact O-NH2 2.95Å
565	E	87.1	Confident	89.9	Confident	21 Å²	21	70.9 Å²	70.9	10%	0.098	35%	0.353	C	S	.	.	H	α-helix	trans	-101.9	-41.4	179.1	-165.4	56.1	-137.5	0	0	112.9	W561 P567 R634 K698	W561-E565 HydrophobicContact CD2-CB 4.42Å; W561-E565 HydrophobicContact CZ2-CG 4.14Å; W561-E565 WeakPolarHBondContact O-CB 3.36Å; W561-E565 PolarHBondContact O-N 3.47Å; E565-P567 WeakPolarHBondContact O-CD 3.3Å; E565-R634 IonicContact OE2-NE 3.89Å; E565-K698 WeakPolarHBondContact OE1-CE 3.45Å; E565-K698 IonicContact OE1-NZ 3.72Å; E565-K698 PolarHBondContact OE1-NZ 3.43Å; E565-K698 IonicContact OE2-NZ 2.71Å; E565-K698 PolarHBondContact OE2-NZ 3.28Å
566	Y	86.3	Confident	89.9	Confident	67 Å²	67	67.8 Å²	67.8	26%	0.263	33%	0.334	S	S	.	.			trans	-117.6	96	-168.8	-61.8	-79	0	0	0	111.6	I549 W561 M562 E568 T569	I549-Y566 HydrophobicContact CD1-CE1 4.22Å; I549-Y566 HydrophobicContact CG1-CE1 4.42Å; I549-Y566 HydrophobicContact CG2-CE2 4.18Å; W561-Y566 AromaticContact NE1-CE2 3.97Å; M562-Y566 PolarHBondContact O-N 3.01Å; M562-Y566 VanDerWaalsContact O-O 3.11Å; M562-Y566 HydrophobicContact SD-CD2 3.74Å; M562-Y566 HydrophobicContact SD-CE2 4.25Å; Y566-E568 VanDerWaalsContact C-N 3.25Å; Y566-E568 PolarHBondContact O-N 2.94Å; Y566-T569 VanDerWaalsContact CB-CG2 3.48Å; Y566-T569 WeakPolarHBondContact O-CB 3.45Å; Y566-T569 VanDerWaalsContact O-CG2 3.3Å; Y566-T569 WeakPolarHBondContact O-CG2 3.4Å; Y566-T569 PolarHBondContact O-N 3.21Å; Y566-T569 PolarHBondContact O-OG1 3.44Å
567	P	85.6	Confident	89.9	Confident	39 Å²	39	62.7 Å²	62.7	25%	0.253	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-63.1	-29	-173.2	25.4	-35	0	0	0	113.9	E565 T569 F574	E565-P567 WeakPolarHBondContact O-CD 3.3Å; P567-T569 PolarHBondContact O-N 3.26Å; P567-F574 PolarHBondContact O-N 3.11Å
568	E	81.6	Confident	89.8	Confident	146 Å²	146	61.5 Å²	61.5	68%	0.682	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-71	-8.5	-178.6	-49.7	-55.2	151.5	0	0	113.7	Y566	Y566-E568 VanDerWaalsContact C-N 3.25Å; Y566-E568 PolarHBondContact O-N 2.94Å
569	T	86.6	Confident	89.8	Confident	60 Å²	60	58.7 Å²	58.7	37%	0.368	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-75	-26.1	-171.9	58	0	0	0	0	114.2	M562 Y566 P567 A573	M562-T569 HydrophobicContact CB-CG2 4.26Å; M562-T569 HydrophobicContact CE-CG2 3.51Å; M562-T569 PolarHBondContact O-OG1 3.1Å; M562-T569 HydrophobicContact SD-CG2 4.26Å; Y566-T569 VanDerWaalsContact CB-CG2 3.48Å; Y566-T569 WeakPolarHBondContact O-CB 3.45Å; Y566-T569 VanDerWaalsContact O-CG2 3.3Å; Y566-T569 WeakPolarHBondContact O-CG2 3.4Å; Y566-T569 PolarHBondContact O-N 3.21Å; Y566-T569 PolarHBondContact O-OG1 3.44Å; P567-T569 PolarHBondContact O-N 3.26Å; T569-A573 WeakPolarHBondContact OG1-CB 3.33Å
570	S	90.4	Very high	89.8	Confident	51 Å²	51	52.3 Å²	52.3	36%	0.357	27%	0.274	S	S	.	.			trans	-166.1	159.6	-179.3	61	0	0	0	0	111.3	L572 A573 F574	S570-L572 PolarHBondContact O-N 3.48Å; S570-A573 PolarHBondContact O-N 3.22Å; S570-A573 VanDerWaalsContact O-N 3.1Å; S570-A573 WeakPolarHBondContact OG-CB 3.44Å; S570-A573 PolarHBondContact OG-N 2.91Å; S570-F574 PolarHBondContact O-N 3.42Å
571	I	91	Very high	89.8	Confident	111 Å²	111	51.7 Å²	51.7	57%	0.569	27%	0.268	S	S	*	.	H	α-helix	trans	-53.3	-37.4	171.7	-47.3	166.3	0	0	0	110.6	F337 F574 T575	F337-I571 HydrophobicContact CE1-CD1 3.92Å; F337-I571 HydrophobicContact CE1-CG1 4.2Å; F337-I571 HydrophobicContact CE2-CD1 4.02Å; F337-I571 HydrophobicContact CZ-CD1 3.37Å; F337-I571 HydrophobicContact CZ-CG1 4Å; I571-F574 PolarHBondContact O-N 2.94Å; I571-T575 WeakPolarHBondContact O-CG2 3.33Å; I571-T575 PolarHBondContact O-N 2.66Å; I571-T575 PolarHBondContact O-OG1 3.35Å
572	L	93	Very high	89.8	Confident	95 Å²	95	54 Å²	54	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-70.1	-40.9	179.9	-164.5	69.3	0	0	0	112	L563 S570 F574 T575 F576	L563-L572 HydrophobicContact CD1-CB 3.92Å; L563-L572 HydrophobicContact CD1-CD2 3.85Å; L563-L572 HydrophobicContact CD1-CG 3.81Å; L563-L572 HydrophobicContact CD2-CD2 4.43Å; S570-L572 PolarHBondContact O-N 3.48Å; L572-F574 VanDerWaalsContact C-N 3.31Å; L572-F574 PolarHBondContact O-N 3.06Å; L572-T575 WeakPolarHBondContact CA-OG1 3.46Å; L572-T575 PolarHBondContact O-N 3.22Å; L572-T575 PolarHBondContact O-OG1 2.79Å; L572-F576 HydrophobicContact CD1-CD2 4.38Å; L572-F576 HydrophobicContact CD1-CE2 4Å; L572-F576 HydrophobicContact CD2-CE2 4.28Å; L572-F576 HydrophobicContact CG-CD2 3.99Å; L572-F576 HydrophobicContact CG-CE2 3.83Å; L572-F576 VanDerWaalsContact O-CD2 3.26Å; L572-F576 WeakPolarHBondContact O-CD2 3.3Å; L572-F576 PolarHBondContact O-N 3.38Å
573	A	91.3	Very high	89.9	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-63.4	-40	173.3	0	0	0	0	0	111.2	L563 T569 S570 S577	L563-A573 HydrophobicContact CD1-CB 4.05Å; L563-A573 WeakPolarHBondContact O-CB 3.49Å; T569-A573 WeakPolarHBondContact OG1-CB 3.33Å; S570-A573 PolarHBondContact O-N 3.22Å; S570-A573 VanDerWaalsContact O-N 3.1Å; S570-A573 WeakPolarHBondContact OG-CB 3.44Å; S570-A573 PolarHBondContact OG-N 2.91Å; A573-S577 VanDerWaalsContact O-CB 3.23Å; A573-S577 WeakPolarHBondContact O-CB 3.49Å; A573-S577 PolarHBondContact O-N 2.74Å
574	F	90.5	Very high	90	Very high	75 Å²	75	52.8 Å²	52.8	33%	0.329	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-43	174.1	-174.6	-90.5	0	0	0	112.3	M47 P567 S570 I571 L572 S577 M578	M47-F574 HydrophobicContact SD-CE2 4.26Å; P567-F574 PolarHBondContact O-N 3.11Å; S570-F574 PolarHBondContact O-N 3.42Å; I571-F574 PolarHBondContact O-N 2.94Å; L572-F574 VanDerWaalsContact C-N 3.31Å; L572-F574 PolarHBondContact O-N 3.06Å; F574-S577 PolarHBondContact O-N 3.47Å; F574-M578 HydrophobicContact CE1-CE 3.97Å; F574-M578 HydrophobicContact CE2-CE 4.48Å; F574-M578 HydrophobicContact CZ-CE 3.66Å; F574-M578 VanDerWaalsContact O-CB 3.32Å; F574-M578 WeakPolarHBondContact O-CB 3.26Å; F574-M578 PolarHBondContact O-N 2.97Å
575	T	91.8	Very high	90.1	Very high	72 Å²	72	53.2 Å²	53.2	44%	0.442	28%	0.278	S	S	.	.	H	α-helix	trans	-69.4	-39.7	177.7	54.3	0	0	0	0	112.9	I571 L572 M578 A579	I571-T575 WeakPolarHBondContact O-CG2 3.33Å; I571-T575 PolarHBondContact O-N 2.66Å; I571-T575 PolarHBondContact O-OG1 3.35Å; L572-T575 WeakPolarHBondContact CA-OG1 3.46Å; L572-T575 PolarHBondContact O-N 3.22Å; L572-T575 PolarHBondContact O-OG1 2.79Å; T575-M578 PolarHBondContact O-N 2.89Å; T575-A579 WeakPolarHBondContact O-CB 3.47Å; T575-A579 PolarHBondContact O-N 3.47Å
576	F	91.7	Very high	90.4	Very high	65 Å²	65	55.3 Å²	55.3	29%	0.285	29%	0.289	S	S	.	.	H	α-helix	trans	-62.7	-42.4	172.4	-84.1	-71	0	0	0	111.9	L563 F564 L572 A579 S580 W626	L563-F576 HydrophobicContact CD1-CD2 4.09Å; L563-F576 HydrophobicContact CD2-CD2 4.22Å; L563-F576 HydrophobicContact CD2-CE2 4.16Å; L563-F576 HydrophobicContact CG-CD2 4.18Å; F564-F576 HydrophobicContact CZ-CD1 4.23Å; F564-F576 HydrophobicContact CZ-CE1 4.37Å; L572-F576 HydrophobicContact CD1-CD2 4.38Å; L572-F576 HydrophobicContact CD1-CE2 4Å; L572-F576 HydrophobicContact CD2-CE2 4.28Å; L572-F576 HydrophobicContact CG-CD2 3.99Å; L572-F576 HydrophobicContact CG-CE2 3.83Å; L572-F576 VanDerWaalsContact O-CD2 3.26Å; L572-F576 WeakPolarHBondContact O-CD2 3.3Å; L572-F576 PolarHBondContact O-N 3.38Å; F576-A579 PolarHBondContact O-N 2.86Å; F576-S580 PolarHBondContact O-N 2.83Å; F576-S580 PolarHBondContact O-OG 3.49Å; F576-W626 AromaticContact CD1-CH2 3.68Å; F576-W626 HydrophobicContact CD1-CH2 3.68Å; F576-W626 AromaticContact CD1-CZ2 3.84Å; F576-W626 HydrophobicContact CD1-CZ2 3.84Å; F576-W626 AromaticContact CE1-CH2 3.79Å; F576-W626 HydrophobicContact CE1-CH2 3.79Å; F576-W626 HydrophobicContact CE1-CZ2 4.4Å
577	S	89.9	Confident	90.6	Very high	26 Å²	26	52.1 Å²	52.1	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-45.6	174.4	176.7	0	0	0	0	112.5	A573 F574 S580 F581 H699	A573-S577 VanDerWaalsContact O-CB 3.23Å; A573-S577 WeakPolarHBondContact O-CB 3.49Å; A573-S577 PolarHBondContact O-N 2.74Å; F574-S577 PolarHBondContact O-N 3.47Å; S577-S580 PolarHBondContact O-N 2.98Å; S577-F581 PolarHBondContact O-N 3.17Å; S577-H699 PolarHBondContact O-CE1 3.36Å; S577-H699 PolarHBondContact OG-CE1 3.17Å; S577-H699 PolarHBondContact OG-ND1 3.17Å
578	M	90.4	Very high	90.9	Very high	48 Å²	48	52 Å²	52	24%	0.236	27%	0.274	C	S	.	.	H	α-helix	trans	-64.6	-39.9	177.3	-172.3	61.6	65.5	0	0	111.8	M40 T44 F574 T575 F581 I582	M40-M578 HydrophobicContact CE-SD 4.04Å; T44-M578 HydrophobicContact CG2-CE 4.05Å; F574-M578 HydrophobicContact CE1-CE 3.97Å; F574-M578 HydrophobicContact CE2-CE 4.48Å; F574-M578 HydrophobicContact CZ-CE 3.66Å; F574-M578 VanDerWaalsContact O-CB 3.32Å; F574-M578 WeakPolarHBondContact O-CB 3.26Å; F574-M578 PolarHBondContact O-N 2.97Å; T575-M578 PolarHBondContact O-N 2.89Å; M578-F581 PolarHBondContact O-N 2.9Å; M578-I582 HydrophobicContact CG-CD1 4.05Å; M578-I582 VanDerWaalsContact O-CG1 3.27Å; M578-I582 WeakPolarHBondContact O-CG1 3.46Å; M578-I582 PolarHBondContact O-N 3.43Å
579	A	92.2	Very high	91.4	Very high	28 Å²	28	47.6 Å²	47.6	23%	0.231	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-47.3	173.6	0	0	0	0	0	111.6	T575 F576 F581 I582 F583 W626	T575-A579 WeakPolarHBondContact O-CB 3.47Å; T575-A579 PolarHBondContact O-N 3.47Å; F576-A579 PolarHBondContact O-N 2.86Å; A579-F581 VanDerWaalsContact C-N 3.31Å; A579-F581 PolarHBondContact O-N 2.97Å; A579-I582 PolarHBondContact O-N 3.45Å; A579-I582 VanDerWaalsContact O-N 3.11Å; A579-F583 VanDerWaalsContact O-CD2 3.22Å; A579-F583 WeakPolarHBondContact O-CD2 3.48Å; A579-F583 PolarHBondContact O-N 3.31Å; A579-W626 HydrophobicContact CB-CH2 4.19Å; A579-W626 HydrophobicContact CB-CZ2 3.74Å
580	S	91.8	Very high	91.6	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.014	24%	0.24	C	C	.	.	H	α-helix	trans	-59.6	-39.2	175.5	-64.8	0	0	0	0	112.8	F576 S577 T584 W626 E630	F576-S580 PolarHBondContact O-N 2.83Å; F576-S580 PolarHBondContact O-OG 3.49Å; S577-S580 PolarHBondContact O-N 2.98Å; S580-T584 WeakPolarHBondContact O-CB 3.31Å; S580-T584 PolarHBondContact O-N 3.25Å; S580-T584 PolarHBondContact O-OG1 3.46Å; S580-W626 PolarHBondContact OG-NE1 3.13Å; S580-E630 VanDerWaalsContact OG-CD 3.26Å; S580-E630 PolarHBondContact OG-OE1 2.87Å; S580-E630 PolarHBondContact OG-OE2 2.96Å
581	F	90.8	Very high	91.4	Very high	50 Å²	50	44.6 Å²	44.6	22%	0.219	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-46.8	172.3	179.2	-80.7	0	0	0	111.6	M40 S577 M578 A579 T584 V585 L696 H699	M40-F581 HydrophobicContact CE-CD1 4.25Å; M40-F581 HydrophobicContact CE-CE1 4.12Å; M40-F581 HydrophobicContact CG-CE1 4.33Å; M40-F581 HydrophobicContact SD-CD1 3.93Å; M40-F581 HydrophobicContact SD-CE1 3.29Å; M40-F581 WeakPolarHBondContact SD-CE1 3.17Å; M40-F581 HydrophobicContact SD-CZ 4Å; S577-F581 PolarHBondContact O-N 3.17Å; M578-F581 PolarHBondContact O-N 2.9Å; A579-F581 VanDerWaalsContact C-N 3.31Å; A579-F581 PolarHBondContact O-N 2.97Å; F581-T584 WeakPolarHBondContact O-CB 3.4Å; F581-T584 PolarHBondContact O-N 2.94Å; F581-V585 HydrophobicContact CD1-CG2 4.08Å; F581-V585 HydrophobicContact CE1-CG2 3.53Å; F581-V585 HydrophobicContact CZ-CG2 3.89Å; F581-V585 PolarHBondContact O-N 3.32Å; F581-L696 HydrophobicContact CD2-CD2 3.76Å; F581-L696 HydrophobicContact CE2-CD2 3.68Å; F581-L696 HydrophobicContact CZ-CD2 4.36Å; F581-H699 HydrophobicContact CD2-CB 3.9Å
582	I	92.4	Very high	91.3	Very high	73 Å²	73	42.5 Å²	42.5	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-47	179.9	-70.8	164.5	0	0	0	111.1	M40 M578 A579 T584 V585 I586	M40-I582 HydrophobicContact CE-CG1 4.27Å; M578-I582 HydrophobicContact CG-CD1 4.05Å; M578-I582 VanDerWaalsContact O-CG1 3.27Å; M578-I582 WeakPolarHBondContact O-CG1 3.46Å; M578-I582 PolarHBondContact O-N 3.43Å; A579-I582 PolarHBondContact O-N 3.45Å; A579-I582 VanDerWaalsContact O-N 3.11Å; I582-T584 VanDerWaalsContact C-N 3.27Å; I582-T584 PolarHBondContact O-N 3.23Å; I582-V585 PolarHBondContact O-N 2.98Å; I582-I586 HydrophobicContact CG2-CD1 3.71Å; I582-I586 HydrophobicContact CG2-CG1 4.4Å; I582-I586 WeakPolarHBondContact O-CG1 3.39Å; I582-I586 PolarHBondContact O-N 2.92Å
583	F	92.9	Very high	91.2	Very high	58 Å²	58	39.6 Å²	39.6	25%	0.254	21%	0.21	S	C	.	.	H	α-helix	trans	-59.1	-38.3	173.3	-78	-65.8	0	0	0	111.9	A579 I586 S587 W626 F627	A579-F583 VanDerWaalsContact O-CD2 3.22Å; A579-F583 WeakPolarHBondContact O-CD2 3.48Å; A579-F583 PolarHBondContact O-N 3.31Å; F583-I586 PolarHBondContact O-N 3.38Å; F583-S587 VanDerWaalsContact O-CB 3.27Å; F583-S587 WeakPolarHBondContact O-CB 3.43Å; F583-S587 PolarHBondContact O-N 2.85Å; F583-S587 PolarHBondContact O-OG 3.44Å; F583-W626 HydrophobicContact CD2-CB 4.1Å; F583-W626 AromaticContact CD2-CD1 3.57Å; F583-W626 AromaticContact CD2-CD2 3.61Å; F583-W626 HydrophobicContact CD2-CD2 3.61Å; F583-W626 AromaticContact CD2-CE2 3.78Å; F583-W626 HydrophobicContact CD2-CE3 4.29Å; F583-W626 AromaticContact CD2-CG 3.48Å; F583-W626 HydrophobicContact CD2-CG 3.48Å; F583-W626 VanDerWaalsContact CD2-CG 3.48Å; F583-W626 AromaticContact CD2-NE1 3.75Å; F583-W626 HydrophobicContact CE2-CB 4.28Å; F583-W626 AromaticContact CE2-CD2 3.47Å; F583-W626 HydrophobicContact CE2-CD2 3.47Å; F583-W626 VanDerWaalsContact CE2-CD2 3.47Å; F583-W626 AromaticContact CE2-CE2 3.88Å; F583-W626 AromaticContact CE2-CE3 3.66Å; F583-W626 HydrophobicContact CE2-CE3 3.66Å; F583-W626 AromaticContact CE2-CG 3.74Å; F583-W626 HydrophobicContact CE2-CG 3.74Å; F583-W626 HydrophobicContact CE2-CZ2 4.41Å; F583-W626 HydrophobicContact CE2-CZ3 4.21Å; F583-W626 HydrophobicContact CG-CB 4.3Å; F583-W626 HydrophobicContact CG-CG 4.08Å; F583-W626 HydrophobicContact CZ-CD2 4.38Å; F583-W626 HydrophobicContact CZ-CE3 4.31Å; F583-F627 HydrophobicContact CB-CE1 3.83Å; F583-F627 HydrophobicContact CB-CZ 4.13Å
584	T	92.1	Very high	90.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.3	-50.6	174.3	-54.3	0	0	0	0	110.9	S580 F581 I582 I586 S587 I588 R692 K695 L696	S580-T584 WeakPolarHBondContact O-CB 3.31Å; S580-T584 PolarHBondContact O-N 3.25Å; S580-T584 PolarHBondContact O-OG1 3.46Å; F581-T584 WeakPolarHBondContact O-CB 3.4Å; F581-T584 PolarHBondContact O-N 2.94Å; I582-T584 VanDerWaalsContact C-N 3.27Å; I582-T584 PolarHBondContact O-N 3.23Å; T584-I586 PolarHBondContact O-N 3.02Å; T584-S587 PolarHBondContact O-N 3.25Å; T584-S587 PolarHBondContact O-OG 2.84Å; T584-I588 HydrophobicContact CG2-CD1 4.02Å; T584-I588 WeakPolarHBondContact O-CD1 3.38Å; T584-I588 VanDerWaalsContact O-CG1 3.3Å; T584-I588 WeakPolarHBondContact O-CG1 3.27Å; T584-I588 PolarHBondContact O-N 3.44Å; T584-I588 VanDerWaalsContact O-N 3.14Å; T584-R692 WeakPolarHBondContact CG2-O 3.47Å; T584-K695 HydrophobicContact CG2-CB 4.19Å; T584-L696 HydrophobicContact CG2-CD2 3.57Å; T584-L696 HydrophobicContact CG2-CG 3.93Å
585	V	92.4	Very high	90.5	Very high	29 Å²	29	42.4 Å²	42.4	18%	0.176	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-44.5	178.4	174	0	0	0	0	112.2	L36 F581 I582 S587 I588 I589	L36-V585 HydrophobicContact CD1-CG1 4.29Å; F581-V585 HydrophobicContact CD1-CG2 4.08Å; F581-V585 HydrophobicContact CE1-CG2 3.53Å; F581-V585 HydrophobicContact CZ-CG2 3.89Å; F581-V585 PolarHBondContact O-N 3.32Å; I582-V585 PolarHBondContact O-N 2.98Å; V585-S587 PolarHBondContact O-N 3.05Å; V585-I588 PolarHBondContact O-N 3.49Å; V585-I589 HydrophobicContact CG1-CD1 3.83Å; V585-I589 HydrophobicContact CG1-CG1 4.49Å; V585-I589 WeakPolarHBondContact O-CG1 3.36Å; V585-I589 PolarHBondContact O-N 3.45Å
586	I	93.1	Very high	90.3	Very high	65 Å²	65	41.1 Å²	41.1	33%	0.333	22%	0.221	S	C	.	.	H	α-helix	trans	-58.7	-47.4	175.9	-69.6	169	0	0	0	110.5	I582 F583 T584 I588 I589 L590 I619	I582-I586 HydrophobicContact CG2-CD1 3.71Å; I582-I586 HydrophobicContact CG2-CG1 4.4Å; I582-I586 WeakPolarHBondContact O-CG1 3.39Å; I582-I586 PolarHBondContact O-N 2.92Å; F583-I586 PolarHBondContact O-N 3.38Å; T584-I586 PolarHBondContact O-N 3.02Å; I586-I588 PolarHBondContact O-N 3.32Å; I586-I589 PolarHBondContact O-N 3.46Å; I586-I589 VanDerWaalsContact O-N 3.13Å; I586-L590 HydrophobicContact CG2-CD1 3.71Å; I586-L590 HydrophobicContact CG2-CG 4.25Å; I586-L590 WeakPolarHBondContact O-CG 3.16Å; I586-L590 PolarHBondContact O-N 3.5Å; I586-I619 HydrophobicContact CG2-CG2 4.08Å
587	S	91.8	Very high	89.9	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.007	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-18.7	-179.9	73.5	0	0	0	0	114.7	F583 T584 V585 R692	F583-S587 VanDerWaalsContact O-CB 3.27Å; F583-S587 WeakPolarHBondContact O-CB 3.43Å; F583-S587 PolarHBondContact O-N 2.85Å; F583-S587 PolarHBondContact O-OG 3.44Å; T584-S587 PolarHBondContact O-N 3.25Å; T584-S587 PolarHBondContact O-OG 2.84Å; V585-S587 PolarHBondContact O-N 3.05Å; S587-R692 PolarHBondContact O-NH1 3.26Å; S587-R692 VanDerWaalsContact OG-CD 3.25Å; S587-R692 WeakPolarHBondContact OG-CD 3.32Å
588	I	91.5	Very high	89.6	Confident	37 Å²	37	46.1 Å²	46.1	19%	0.19	26%	0.257	C	S	.	.	H	α-helix	trans	-84.1	-43	172.1	-65.1	159.5	0	0	0	110	T584 V585 I586 L590 F591 C592 R692 V693 L696	T584-I588 HydrophobicContact CG2-CD1 4.02Å; T584-I588 WeakPolarHBondContact O-CD1 3.38Å; T584-I588 VanDerWaalsContact O-CG1 3.3Å; T584-I588 WeakPolarHBondContact O-CG1 3.27Å; T584-I588 PolarHBondContact O-N 3.44Å; T584-I588 VanDerWaalsContact O-N 3.14Å; V585-I588 PolarHBondContact O-N 3.49Å; I586-I588 PolarHBondContact O-N 3.32Å; I588-L590 PolarHBondContact O-N 3.27Å; I588-F591 PolarHBondContact O-N 3.43Å; I588-C592 PolarHBondContact O-N 3.38Å; I588-C592 PolarHBondContact O-SG 2.96Å; I588-C592 VanDerWaalsContact O-SG 3.36Å; I588-R692 HydrophobicContact CG1-CG 3.95Å; I588-V693 HydrophobicContact CD1-CB 4.39Å; I588-V693 HydrophobicContact CD1-CG2 3.86Å; I588-V693 HydrophobicContact CG1-CG2 3.95Å; I588-V693 HydrophobicContact CG2-CG2 4.45Å; I588-L696 HydrophobicContact CD1-CD1 4.21Å
589	I	92.1	Very high	89.2	Confident	52 Å²	52	48.3 Å²	48.3	27%	0.267	26%	0.263	S	S	.	.	H	α-helix	trans	-62.4	-43.5	177.6	-68.1	168.3	0	0	0	110.8	L36 V585 I586 C592 I593	L36-I589 HydrophobicContact CD1-CD1 4.17Å; V585-I589 HydrophobicContact CG1-CD1 3.83Å; V585-I589 HydrophobicContact CG1-CG1 4.49Å; V585-I589 WeakPolarHBondContact O-CG1 3.36Å; V585-I589 PolarHBondContact O-N 3.45Å; I586-I589 PolarHBondContact O-N 3.46Å; I586-I589 VanDerWaalsContact O-N 3.13Å; I589-C592 PolarHBondContact O-N 3.08Å; I589-I593 HydrophobicContact CG2-CD1 3.76Å; I589-I593 HydrophobicContact CG2-CG1 4.5Å; I589-I593 WeakPolarHBondContact O-CG1 3.1Å; I589-I593 PolarHBondContact O-N 3.18Å
590	L	90	Very high	88.2	Confident	14 Å²	14	49.4 Å²	49.4	7%	0.073	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-48.6	175.5	-67.4	164.9	0	0	0	111.6	I586 I588 C592 I593 E594 F616 I619	I586-L590 HydrophobicContact CG2-CD1 3.71Å; I586-L590 HydrophobicContact CG2-CG 4.25Å; I586-L590 WeakPolarHBondContact O-CG 3.16Å; I586-L590 PolarHBondContact O-N 3.5Å; I588-L590 PolarHBondContact O-N 3.27Å; L590-C592 VanDerWaalsContact C-N 3.25Å; L590-C592 PolarHBondContact O-N 3.05Å; L590-I593 PolarHBondContact O-N 3.35Å; L590-E594 WeakPolarHBondContact O-CG 3.18Å; L590-E594 PolarHBondContact O-N 2.97Å; L590-F616 HydrophobicContact CD2-CD1 3.73Å; L590-F616 HydrophobicContact CD2-CE1 4.49Å; L590-I619 HydrophobicContact CD1-CB 3.78Å; L590-I619 HydrophobicContact CD1-CG2 3.47Å; L590-I619 VanDerWaalsContact CD1-CG2 3.47Å; L590-I619 HydrophobicContact CD2-CB 4.5Å; L590-I619 HydrophobicContact CD2-CD1 4.22Å
591	F	87.2	Confident	87	Confident	34 Å²	34	55.8 Å²	55.8	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-56	-38.9	176	172.7	-92.5	0	0	0	112.4	I588 R686 R689 L690	I588-F591 PolarHBondContact O-N 3.43Å; F591-R686 WeakPolarHBondContact CE2-O 3.3Å; F591-R689 HydrophobicContact CD2-CB 3.86Å; F591-R689 HydrophobicContact CD2-CG 4.44Å; F591-R689 HydrophobicContact CE2-CB 3.79Å; F591-R689 HydrophobicContact CE2-CG 4.4Å; F591-L690 HydrophobicContact CD1-CD2 4.08Å; F591-L690 HydrophobicContact CE1-CD2 3.44Å; F591-L690 VanDerWaalsContact CE1-CD2 3.44Å; F591-L690 HydrophobicContact CE1-CG 4.06Å; F591-L690 HydrophobicContact CZ-CD2 4Å; F591-L690 HydrophobicContact CZ-CG 4.1Å
592	C	89.3	Confident	85.8	Confident	68 Å²	68	56.1 Å²	56.1	46%	0.459	31%	0.308	S	S	.	.	H	α-helix	trans	-66.4	-43.4	173.6	-66.2	0	0	0	0	112.2	I588 I589 L590 T595	I588-C592 PolarHBondContact O-N 3.38Å; I588-C592 PolarHBondContact O-SG 2.96Å; I588-C592 VanDerWaalsContact O-SG 3.36Å; I589-C592 PolarHBondContact O-N 3.08Å; L590-C592 VanDerWaalsContact C-N 3.25Å; L590-C592 PolarHBondContact O-N 3.05Å; C592-T595 PolarHBondContact O-N 3.27Å; C592-T595 PolarHBondContact O-OG1 3.17Å
593	I	89.7	Confident	84.4	Confident	34 Å²	34	54.6 Å²	54.6	17%	0.174	30%	0.299	C	S	.	.	H	α-helix	trans	-68	-37	-179.1	-63.3	165.2	0	0	0	111.6	I589 L590 T595 L596 Y599 F616	I589-I593 HydrophobicContact CG2-CD1 3.76Å; I589-I593 HydrophobicContact CG2-CG1 4.5Å; I589-I593 WeakPolarHBondContact O-CG1 3.1Å; I589-I593 PolarHBondContact O-N 3.18Å; L590-I593 PolarHBondContact O-N 3.35Å; I593-T595 PolarHBondContact O-N 3.24Å; I593-T595 VanDerWaalsContact O-N 3.12Å; I593-L596 HydrophobicContact CG2-CD1 4.38Å; I593-L596 WeakPolarHBondContact O-CB 3.37Å; I593-L596 PolarHBondContact O-N 2.79Å; I593-Y599 HydrophobicContact CG2-CD2 3.42Å; I593-Y599 VanDerWaalsContact CG2-CD2 3.42Å; I593-Y599 HydrophobicContact CG2-CE2 3.78Å; I593-Y599 HydrophobicContact CG2-CG 4.07Å; I593-F616 HydrophobicContact CB-CE1 4.22Å; I593-F616 HydrophobicContact CG2-CD1 4.46Å; I593-F616 HydrophobicContact CG2-CE1 3.51Å; I593-F616 HydrophobicContact CG2-CZ 3.92Å
594	E	83.6	Confident	83.1	Confident	36 Å²	36	52.6 Å²	52.6	17%	0.168	29%	0.292	C	S	.	.	H	α-helix	trans	-56.1	-24.1	173.1	-76.3	168.2	-155.2	0	0	113.3	L590 F616 R689	L590-E594 WeakPolarHBondContact O-CG 3.18Å; L590-E594 PolarHBondContact O-N 2.97Å; E594-F616 HydrophobicContact CG-CB 4.46Å; E594-R689 IonicContact OE2-NH1 3.91Å; E594-R689 PolarHBondContact OE2-NH1 2.92Å
595	T	84.6	Confident	81.9	Confident	98 Å²	98	58.6 Å²	58.6	60%	0.601	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-10.8	177.4	65.9	0	0	0	0	114.6	C592 I593	C592-T595 PolarHBondContact O-N 3.27Å; C592-T595 PolarHBondContact O-OG1 3.17Å; I593-T595 PolarHBondContact O-N 3.24Å; I593-T595 VanDerWaalsContact O-N 3.12Å
596	L	87.2	Confident	80.5	Confident	45 Å²	45	62.7 Å²	62.7	24%	0.236	35%	0.347	C	S	.	.	S	Bend	trans	-73.5	138.1	177.1	-63	172.3	0	0	0	110.2	I29 I593 V598 Y599 A600	I29-L596 HydrophobicContact CD1-CD1 4.05Å; I593-L596 HydrophobicContact CG2-CD1 4.38Å; I593-L596 WeakPolarHBondContact O-CB 3.37Å; I593-L596 PolarHBondContact O-N 2.79Å; L596-V598 PolarHBondContact O-N 3.09Å; L596-V598 VanDerWaalsContact O-N 3.08Å; L596-Y599 HydrophobicContact CB-CD2 4.12Å; L596-Y599 HydrophobicContact CD1-CD2 4.22Å; L596-Y599 HydrophobicContact CD1-CE2 4.28Å; L596-Y599 PolarHBondContact O-N 3.48Å; L596-A600 WeakPolarHBondContact O-CB 3.22Å; L596-A600 PolarHBondContact O-N 3.41Å
597	P	83.6	Confident	79.2	Confident	98 Å²	98	62.9 Å²	62.9	64%	0.636	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-26.1	-173.9	24.5	-34.5	0	0	0	113.4	Y599	P597-Y599 VanDerWaalsContact C-N 3.35Å
598	V	83.8	Confident	78.1	Confident	98 Å²	98	64.4 Å²	64.4	59%	0.594	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-32.9	176.4	-177.2	0	0	0	0	112.6	L596	L596-V598 PolarHBondContact O-N 3.09Å; L596-V598 VanDerWaalsContact O-N 3.08Å
599	Y	81.3	Confident	77.3	Confident	95 Å²	95	71.6 Å²	71.6	37%	0.373	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-20.1	-175.8	-57.2	-65.8	0	0	0	113.4	I593 L596 P597 Q601 T602 F616	I593-Y599 HydrophobicContact CG2-CD2 3.42Å; I593-Y599 VanDerWaalsContact CG2-CD2 3.42Å; I593-Y599 HydrophobicContact CG2-CE2 3.78Å; I593-Y599 HydrophobicContact CG2-CG 4.07Å; L596-Y599 HydrophobicContact CB-CD2 4.12Å; L596-Y599 HydrophobicContact CD1-CD2 4.22Å; L596-Y599 HydrophobicContact CD1-CE2 4.28Å; L596-Y599 PolarHBondContact O-N 3.48Å; P597-Y599 VanDerWaalsContact C-N 3.35Å; Y599-Q601 PolarHBondContact O-N 3.48Å; Y599-T602 PolarHBondContact O-N 3.33Å; Y599-T602 PolarHBondContact O-OG1 3.4Å; Y599-F616 AromaticContact CD1-CE2 3.84Å; Y599-F616 HydrophobicContact CD1-CE2 3.84Å; Y599-F616 AromaticContact CD1-CZ 3.66Å; Y599-F616 HydrophobicContact CD1-CZ 3.66Å; Y599-F616 HydrophobicContact CD2-CZ 4.48Å; Y599-F616 HydrophobicContact CE1-CZ 4.12Å; Y599-F616 HydrophobicContact CG-CE2 4.2Å; Y599-F616 AromaticContact CG-CZ 3.87Å; Y599-F616 HydrophobicContact CG-CZ 3.87Å
600	A	71.9	Confident	76.5	Confident	51 Å²	51	70 Å²	70	42%	0.421	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-6.6	-177.4	0	0	0	0	0	116	L596	L596-A600 WeakPolarHBondContact O-CB 3.22Å; L596-A600 PolarHBondContact O-N 3.41Å
601	Q	66.3	Low	76	Confident	136 Å²	136	72.7 Å²	72.7	64%	0.636	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-25.3	-179.2	-56.5	-168.7	11.7	0	0	114.5	Y599 H603 C604	Y599-Q601 PolarHBondContact O-N 3.48Å; Q601-H603 VanDerWaalsContact C-N 3.31Å; Q601-H603 PolarHBondContact O-N 3.05Å; Q601-H603 VanDerWaalsContact O-N 3.15Å; Q601-C604 CarbonylContact O-C 3.55Å; Q601-C604 PolarHBondContact O-N 3.37Å
602	T	65.6	Low	75.8	Confident	56 Å²	56	75.1 Å²	75.1	34%	0.344	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-32.4	-163.1	62.3	0	0	0	0	114.7	Y599 C604 D614	Y599-T602 PolarHBondContact O-N 3.33Å; Y599-T602 PolarHBondContact O-OG1 3.4Å; T602-C604 VanDerWaalsContact C-N 3.35Å; T602-D614 WeakPolarHBondContact CB-OD2 3.32Å; T602-D614 PolarHBondContact OG1-OD2 2.98Å
603	H	63.2	Low	75.5	Confident	41 Å²	41	82.3 Å²	82.3	19%	0.19	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-25.2	179.3	-60.9	-73.8	0	0	0	114.6	Q601 N611 D614 F616 F617	Q601-H603 VanDerWaalsContact C-N 3.31Å; Q601-H603 PolarHBondContact O-N 3.05Å; Q601-H603 VanDerWaalsContact O-N 3.15Å; H603-N611 PolarHBondContact O-N 3.18Å; H603-D614 IonicContact CE1-OD1 3.35Å; H603-D614 PolarHBondContact CE1-OD1 2.7Å; H603-D614 IonicContact CE1-OD2 3.79Å; H603-D614 PolarHBondContact CE1-OD2 2.9Å; H603-D614 IonicContact CG-OD2 2.66Å; H603-D614 PolarHBondContact N-OD2 3.32Å; H603-D614 WeakPolarHBondContact ND1-CB 3.49Å; H603-D614 IonicContact ND1-OD1 2.8Å; H603-D614 IonicContact ND1-OD2 3.07Å; H603-D614 PolarHBondContact ND1-OD2 3.27Å; H603-D614 IonicContact NE2-OD1 2.77Å; H603-D614 IonicContact NE2-OD2 3.7Å; H603-F616 VanDerWaalsContact CE1-CB 3.47Å; H603-F616 WeakPolarHBondContact CE1-CB 3.37Å; H603-F616 AromaticContact CE1-CD2 3.73Å; H603-F616 AromaticContact NE2-CD2 3.48Å; H603-F616 WeakPolarHBondContact NE2-CD2 3.46Å; H603-F616 AromaticContact NE2-CG 3.88Å; H603-F617 PolarHBondContact CE1-N 3.26Å
604	C	64.6	Low	75.3	Confident	17 Å²	17	81.1 Å²	81.1	12%	0.115	44%	0.438	C	S	.	.			trans	-161.7	54.4	-141.3	-163.8	0	0	0	0	112.6	Q601 T602 C673 K677	Q601-C604 CarbonylContact O-C 3.55Å; Q601-C604 PolarHBondContact O-N 3.37Å; T602-C604 VanDerWaalsContact C-N 3.35Å; C604-C673 WeakPolarHBondContact CA-SG 3.49Å; C604-C673 HydrophobicContact CB-CB 4.19Å; C604-C673 WeakPolarHBondContact CB-SG 3.3Å; C604-C673 WeakPolarHBondContact SG-CB 3.45Å; C604-C673 CovalentContact SG-SG 2.03Å; C604-C673 PolarHBondContact SG-SG 3.39Å; C604-K677 PolarHBondContact O-NZ 3.34Å; C604-K677 VanDerWaalsContact SG-CE 3.5Å
605	E	66.9	Low	75.4	Confident	125 Å²	125	83.3 Å²	83.3	58%	0.584	46%	0.456	S	S	*	.			trans	-60.9	142.7	171.4	-64.9	177.9	159.1	0	0	111	G607 A608	E605-G607 PolarHBondContact O-N 2.7Å; E605-A608 HydrophobicContact CB-CB 3.76Å; E605-A608 WeakPolarHBondContact O-CB 3.25Å; E605-A608 PolarHBondContact O-N 3.29Å
606	P	64.3	Low	75.5	Confident	115 Å²	115	80.2 Å²	80.2	75%	0.747	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	133	175	-22.3	34	0	0	0	111.6	A608	P606-A608 PolarHBondContact O-N 2.96Å
607	G	65.5	Low	75.5	Confident	70 Å²	70	80.5 Å²	80.5	72%	0.722	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	-7.7	-177.1	0	0	0	0	0	115.9	E605	E605-G607 PolarHBondContact O-N 2.7Å
608	A	69	Low	75.9	Confident	33 Å²	33	79.3 Å²	79.3	27%	0.273	42%	0.421	S	S	.	.	S	Bend	trans	-81.1	155.7	177.6	0	0	0	0	0	112.9	E605 P606	E605-A608 HydrophobicContact CB-CB 3.76Å; E605-A608 WeakPolarHBondContact O-CB 3.25Å; E605-A608 PolarHBondContact O-N 3.29Å; P606-A608 PolarHBondContact O-N 2.96Å
609	K	73.3	Confident	76.3	Confident	187 Å²	187	77.8 Å²	77.8	81%	0.813	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-69.2	144.6	169.3	-66.9	-179.1	180	178.7	0	109.7	N611	K609-N611 PolarHBondContact O-N 2.93Å
610	P	75	Confident	76.7	Confident	20 Å²	20	73.6 Å²	73.6	13%	0.13	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-59.3	125.5	-176.3	22.5	-33.9	0	0	0	112.5	F612 V667 F671	P610-F612 HydrophobicContact CB-CE1 4.29Å; P610-F612 HydrophobicContact CB-CE2 4.16Å; P610-F612 HydrophobicContact CB-CZ 3.97Å; P610-F612 HydrophobicContact CG-CE2 3.73Å; P610-F612 HydrophobicContact CG-CZ 3.75Å; P610-F612 PolarHBondContact O-N 3.1Å; P610-V667 HydrophobicContact CB-CG1 3.61Å; P610-V667 HydrophobicContact CG-CG1 3.88Å; P610-F671 VanDerWaalsContact CD-O 3.3Å; P610-F671 WeakPolarHBondContact CD-O 3.42Å
611	N	80.3	Confident	77.7	Confident	70 Å²	70	73.2 Å²	73.2	37%	0.374	39%	0.385	S	S	.	.			trans	-84	77.3	-176.4	-174.1	9.5	0	0	0	112.1	H603 K609 R613 D614	H603-N611 PolarHBondContact O-N 3.18Å; K609-N611 PolarHBondContact O-N 2.93Å; N611-R613 PolarHBondContact O-N 3.34Å; N611-R613 PolarHBondContact OD1-N 2.94Å; N611-D614 PolarHBondContact O-N 3.39Å; N611-D614 VanDerWaalsContact O-N 3.15Å
612	F	82.2	Confident	79	Confident	85 Å²	85	71.1 Å²	71.1	37%	0.373	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-4.5	175.8	-59.2	-62.5	0	0	0	114.8	P610 F617 L664 V667 L668	P610-F612 HydrophobicContact CB-CE1 4.29Å; P610-F612 HydrophobicContact CB-CE2 4.16Å; P610-F612 HydrophobicContact CB-CZ 3.97Å; P610-F612 HydrophobicContact CG-CE2 3.73Å; P610-F612 HydrophobicContact CG-CZ 3.75Å; P610-F612 PolarHBondContact O-N 3.1Å; F612-F617 HydrophobicContact CB-CE1 4.29Å; F612-F617 HydrophobicContact CD1-CD1 4.4Å; F612-F617 AromaticContact CD1-CE1 3.71Å; F612-F617 HydrophobicContact CD1-CE1 3.71Å; F612-F617 HydrophobicContact CD1-CE2 4.35Å; F612-F617 AromaticContact CD1-CZ 3.68Å; F612-F617 HydrophobicContact CD1-CZ 3.68Å; F612-F617 HydrophobicContact CE1-CZ 4.19Å; F612-F617 HydrophobicContact CG-CE1 4.49Å; F612-L664 HydrophobicContact CE1-CD1 4.46Å; F612-V667 HydrophobicContact CE1-CG1 4.35Å; F612-V667 HydrophobicContact CZ-CG1 4.25Å; F612-L668 HydrophobicContact CZ-CD2 4.13Å
613	R	84.1	Confident	80.4	Confident	219 Å²	219	68.5 Å²	68.5	83%	0.826	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-3.7	176.5	-70.7	-176.3	174.1	175.9	-1.8	113.7	N611	N611-R613 PolarHBondContact O-N 3.34Å; N611-R613 PolarHBondContact OD1-N 2.94Å
614	D	84.6	Confident	81.8	Confident	9 Å²	9	66.7 Å²	66.7	5%	0.048	35%	0.353	C	S	.	.			trans	-66.3	128.8	179	-169.3	-50.1	0	0	0	111.2	T602 H603 N611 F616 F617 I618	T602-D614 WeakPolarHBondContact CB-OD2 3.32Å; T602-D614 PolarHBondContact OG1-OD2 2.98Å; H603-D614 IonicContact CE1-OD1 3.35Å; H603-D614 PolarHBondContact CE1-OD1 2.7Å; H603-D614 IonicContact CE1-OD2 3.79Å; H603-D614 PolarHBondContact CE1-OD2 2.9Å; H603-D614 IonicContact CG-OD2 2.66Å; H603-D614 PolarHBondContact N-OD2 3.32Å; H603-D614 WeakPolarHBondContact ND1-CB 3.49Å; H603-D614 IonicContact ND1-OD1 2.8Å; H603-D614 IonicContact ND1-OD2 3.07Å; H603-D614 PolarHBondContact ND1-OD2 3.27Å; H603-D614 IonicContact NE2-OD1 2.77Å; H603-D614 IonicContact NE2-OD2 3.7Å; N611-D614 PolarHBondContact O-N 3.39Å; N611-D614 VanDerWaalsContact O-N 3.15Å; D614-F616 PolarHBondContact O-N 2.93Å; D614-F616 WeakPolarHBondContact OD1-CD2 3.42Å; D614-F616 PolarHBondContact OD1-N 3.49Å; D614-F616 VanDerWaalsContact OD1-N 3.09Å; D614-F617 HydrophobicContact CB-CB 4.45Å; D614-F617 WeakPolarHBondContact O-CB 3.23Å; D614-F617 PolarHBondContact O-N 3.44Å; D614-F617 VanDerWaalsContact O-N 3.11Å; D614-I618 PolarHBondContact O-N 3.24Å; D614-I618 VanDerWaalsContact O-N 3.07Å
615	P	87.2	Confident	83.2	Confident	82 Å²	82	71.6 Å²	71.6	53%	0.532	37%	0.373	S	S	.	.	H	α-helix	trans	-46.5	-45.5	178	-32	37.1	0	0	0	116.1	F617 I618 I619	P615-F617 VanDerWaalsContact C-N 3.33Å; P615-F617 PolarHBondContact O-N 2.92Å; P615-I618 PolarHBondContact O-N 3.1Å; P615-I619 WeakPolarHBondContact O-CD1 3.29Å; P615-I619 VanDerWaalsContact O-CG1 3.25Å; P615-I619 WeakPolarHBondContact O-CG1 3.43Å; P615-I619 PolarHBondContact O-N 3.03Å
616	F	86.7	Confident	84.6	Confident	32 Å²	32	68.4 Å²	68.4	14%	0.14	36%	0.356	C	S	.	.	H	α-helix	trans	-70.7	-32.6	-177.1	-41.7	-99.2	0	0	0	111.6	L590 I593 E594 Y599 H603 D614 I619 E620	L590-F616 HydrophobicContact CD2-CD1 3.73Å; L590-F616 HydrophobicContact CD2-CE1 4.49Å; I593-F616 HydrophobicContact CB-CE1 4.22Å; I593-F616 HydrophobicContact CG2-CD1 4.46Å; I593-F616 HydrophobicContact CG2-CE1 3.51Å; I593-F616 HydrophobicContact CG2-CZ 3.92Å; E594-F616 HydrophobicContact CG-CB 4.46Å; Y599-F616 AromaticContact CD1-CE2 3.84Å; Y599-F616 HydrophobicContact CD1-CE2 3.84Å; Y599-F616 AromaticContact CD1-CZ 3.66Å; Y599-F616 HydrophobicContact CD1-CZ 3.66Å; Y599-F616 HydrophobicContact CD2-CZ 4.48Å; Y599-F616 HydrophobicContact CE1-CZ 4.12Å; Y599-F616 HydrophobicContact CG-CE2 4.2Å; Y599-F616 AromaticContact CG-CZ 3.87Å; Y599-F616 HydrophobicContact CG-CZ 3.87Å; H603-F616 VanDerWaalsContact CE1-CB 3.47Å; H603-F616 WeakPolarHBondContact CE1-CB 3.37Å; H603-F616 AromaticContact CE1-CD2 3.73Å; H603-F616 AromaticContact NE2-CD2 3.48Å; H603-F616 WeakPolarHBondContact NE2-CD2 3.46Å; H603-F616 AromaticContact NE2-CG 3.88Å; D614-F616 PolarHBondContact O-N 2.93Å; D614-F616 WeakPolarHBondContact OD1-CD2 3.42Å; D614-F616 PolarHBondContact OD1-N 3.49Å; D614-F616 VanDerWaalsContact OD1-N 3.09Å; F616-I619 PolarHBondContact O-N 2.7Å; F616-E620 WeakPolarHBondContact O-CB 3.49Å; F616-E620 PolarHBondContact O-N 3.19Å
617	F	87	Confident	86	Confident	52 Å²	52	63.2 Å²	63.2	23%	0.228	32%	0.321	C	S	.	.	H	α-helix	trans	-63.8	-44	173.3	176.2	-92.5	0	0	0	110.6	H603 F612 D614 P615 I619 T621 Y660 L664	H603-F617 PolarHBondContact CE1-N 3.26Å; F612-F617 HydrophobicContact CB-CE1 4.29Å; F612-F617 HydrophobicContact CD1-CD1 4.4Å; F612-F617 AromaticContact CD1-CE1 3.71Å; F612-F617 HydrophobicContact CD1-CE1 3.71Å; F612-F617 HydrophobicContact CD1-CE2 4.35Å; F612-F617 AromaticContact CD1-CZ 3.68Å; F612-F617 HydrophobicContact CD1-CZ 3.68Å; F612-F617 HydrophobicContact CE1-CZ 4.19Å; F612-F617 HydrophobicContact CG-CE1 4.49Å; D614-F617 HydrophobicContact CB-CB 4.45Å; D614-F617 WeakPolarHBondContact O-CB 3.23Å; D614-F617 PolarHBondContact O-N 3.44Å; D614-F617 VanDerWaalsContact O-N 3.11Å; P615-F617 VanDerWaalsContact C-N 3.33Å; P615-F617 PolarHBondContact O-N 2.92Å; F617-I619 PolarHBondContact O-N 3.41Å; F617-T621 WeakPolarHBondContact CE1-OG1 3.34Å; F617-T621 VanDerWaalsContact O-CB 3.28Å; F617-T621 WeakPolarHBondContact O-CB 3.26Å; F617-T621 PolarHBondContact O-N 2.97Å; F617-T621 PolarHBondContact O-OG1 3.34Å; F617-Y660 HydrophobicContact CE2-CE2 4.38Å; F617-L664 HydrophobicContact CE2-CD1 4.36Å; F617-L664 HydrophobicContact CZ-CD1 4.09Å
618	I	90.9	Very high	87.4	Confident	73 Å²	73	61.5 Å²	61.5	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-61	-45.5	176.6	-65.1	169.1	0	0	0	110.6	D614 P615 T621 L622	D614-I618 PolarHBondContact O-N 3.24Å; D614-I618 VanDerWaalsContact O-N 3.07Å; P615-I618 PolarHBondContact O-N 3.1Å; I618-T621 WeakPolarHBondContact O-CB 3.49Å; I618-T621 PolarHBondContact O-N 3.35Å; I618-L622 HydrophobicContact CG2-CD1 4.07Å; I618-L622 VanDerWaalsContact O-CG 3.31Å; I618-L622 WeakPolarHBondContact O-CG 3.45Å; I618-L622 PolarHBondContact O-N 2.93Å
619	I	92.1	Very high	88.7	Confident	65 Å²	65	63 Å²	63	33%	0.333	30%	0.299	S	S	.	.	H	α-helix	trans	-76	-35.7	-176.1	-50.1	156.5	0	0	0	111.8	I586 L590 P615 F616 F617 T621 L622 C623	I586-I619 HydrophobicContact CG2-CG2 4.08Å; L590-I619 HydrophobicContact CD1-CB 3.78Å; L590-I619 HydrophobicContact CD1-CG2 3.47Å; L590-I619 VanDerWaalsContact CD1-CG2 3.47Å; L590-I619 HydrophobicContact CD2-CB 4.5Å; L590-I619 HydrophobicContact CD2-CD1 4.22Å; P615-I619 WeakPolarHBondContact O-CD1 3.29Å; P615-I619 VanDerWaalsContact O-CG1 3.25Å; P615-I619 WeakPolarHBondContact O-CG1 3.43Å; P615-I619 PolarHBondContact O-N 3.03Å; F616-I619 PolarHBondContact O-N 2.7Å; F617-I619 PolarHBondContact O-N 3.41Å; I619-T621 VanDerWaalsContact C-N 3.32Å; I619-L622 PolarHBondContact O-N 3.1Å; I619-C623 PolarHBondContact O-N 2.92Å; I619-C623 PolarHBondContact O-SG 3.19Å
620	E	90.2	Very high	89.6	Confident	8 Å²	8	54.1 Å²	54.1	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-37.3	170.9	-173.8	171.9	-129.9	0	0	111.4	F616 L622 C623 T624 Y660 R689 R692	F616-E620 WeakPolarHBondContact O-CB 3.49Å; F616-E620 PolarHBondContact O-N 3.19Å; E620-L622 PolarHBondContact O-N 3.09Å; E620-C623 PolarHBondContact O-N 3.23Å; E620-T624 VanDerWaalsContact O-CB 3.32Å; E620-T624 WeakPolarHBondContact O-CB 3.44Å; E620-T624 PolarHBondContact O-N 3.1Å; E620-T624 PolarHBondContact O-OG1 3.24Å; E620-Y660 HydrophobicContact CG-CD2 3.99Å; E620-Y660 HydrophobicContact CG-CE2 4.49Å; E620-R689 VanDerWaalsContact CD-NH1 3.29Å; E620-R689 IonicContact OE1-CZ 3.49Å; E620-R689 IonicContact OE1-NE 3.25Å; E620-R689 IonicContact OE1-NH1 2.68Å; E620-R689 PolarHBondContact OE1-NH1 3.23Å; E620-R689 VanDerWaalsContact OE1-NH1 3.1Å; E620-R689 IonicContact OE1-NH2 3.59Å; E620-R689 IonicContact OE2-CZ 3.71Å; E620-R689 IonicContact OE2-NH1 3.51Å; E620-R689 PolarHBondContact OE2-NH1 3.43Å; E620-R689 IonicContact OE2-NH2 2.77Å; E620-R689 PolarHBondContact OE2-NH2 2.98Å; E620-R692 IonicContact OE1-CZ 3.18Å; E620-R692 IonicContact OE1-NH1 3.81Å; E620-R692 PolarHBondContact OE1-NH1 3.45Å; E620-R692 IonicContact OE1-NH2 3.27Å; E620-R692 PolarHBondContact OE1-NH2 3.48Å
621	T	92.3	Very high	90.5	Very high	42 Å²	42	54.2 Å²	54.2	26%	0.258	26%	0.26	S	S	.	.	H	α-helix	trans	-57	-49.4	171.5	-59.6	0	0	0	0	110.7	F617 I618 I619 T624 F625 Y660	F617-T621 WeakPolarHBondContact CE1-OG1 3.34Å; F617-T621 VanDerWaalsContact O-CB 3.28Å; F617-T621 WeakPolarHBondContact O-CB 3.26Å; F617-T621 PolarHBondContact O-N 2.97Å; F617-T621 PolarHBondContact O-OG1 3.34Å; I618-T621 WeakPolarHBondContact O-CB 3.49Å; I618-T621 PolarHBondContact O-N 3.35Å; I619-T621 VanDerWaalsContact C-N 3.32Å; T621-T624 PolarHBondContact O-N 3.34Å; T621-F625 WeakPolarHBondContact O-CB 3.25Å; T621-F625 PolarHBondContact O-N 3.26Å; T621-Y660 WeakPolarHBondContact CG2-OH 3.5Å; T621-Y660 PolarHBondContact OG1-OH 2.81Å
622	L	94.5	Very high	91.2	Very high	92 Å²	92	57 Å²	57	48%	0.482	27%	0.269	S	S	.	.	H	α-helix	trans	-64.7	-42.8	179.9	-71	169.1	0	0	0	112.7	I618 I619 E620 W626	I618-L622 HydrophobicContact CG2-CD1 4.07Å; I618-L622 VanDerWaalsContact O-CG 3.31Å; I618-L622 WeakPolarHBondContact O-CG 3.45Å; I618-L622 PolarHBondContact O-N 2.93Å; I619-L622 PolarHBondContact O-N 3.1Å; E620-L622 PolarHBondContact O-N 3.09Å; L622-W626 PolarHBondContact O-N 2.95Å
623	C	94	Very high	91.7	Very high	1 Å²	1	55 Å²	55	1%	0.007	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-46.2	175.4	-66.8	0	0	0	0	111.4	I619 E620 W626 F627	I619-C623 PolarHBondContact O-N 2.92Å; I619-C623 PolarHBondContact O-SG 3.19Å; E620-C623 PolarHBondContact O-N 3.23Å; C623-W626 PolarHBondContact O-N 3.28Å; C623-F627 HydrophobicContact CB-CE2 4.24Å; C623-F627 HydrophobicContact CB-CZ 4.42Å; C623-F627 VanDerWaalsContact O-CD2 3.28Å; C623-F627 WeakPolarHBondContact O-CD2 3.37Å; C623-F627 WeakPolarHBondContact O-CG 3.16Å; C623-F627 PolarHBondContact O-N 3.12Å; C623-F627 VanDerWaalsContact O-N 3.1Å
624	T	93.4	Very high	92.1	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-68.1	-38.3	-179.1	-52.4	0	0	0	0	111.7	E620 T621 W626 F627 T628 I657 Y660 Y661	E620-T624 VanDerWaalsContact O-CB 3.32Å; E620-T624 WeakPolarHBondContact O-CB 3.44Å; E620-T624 PolarHBondContact O-N 3.1Å; E620-T624 PolarHBondContact O-OG1 3.24Å; T621-T624 PolarHBondContact O-N 3.34Å; T624-W626 PolarHBondContact O-N 3.46Å; T624-F627 PolarHBondContact O-N 3.02Å; T624-T628 WeakPolarHBondContact O-CB 3.39Å; T624-T628 PolarHBondContact O-N 2.99Å; T624-T628 PolarHBondContact O-OG1 3.23Å; T624-I657 HydrophobicContact CG2-CB 3.97Å; T624-I657 HydrophobicContact CG2-CG2 3.99Å; T624-Y660 HydrophobicContact CG2-CD1 3.54Å; T624-Y660 HydrophobicContact CG2-CE1 4.29Å; T624-Y660 HydrophobicContact CG2-CG 3.82Å; T624-Y661 HydrophobicContact CG2-CD2 4.34Å; T624-Y661 HydrophobicContact CG2-CE2 3.79Å
625	F	94.7	Very high	92.6	Very high	120 Å²	120	47.6 Å²	47.6	53%	0.526	24%	0.235	S	C	.	.	H	α-helix	trans	-59.5	-44	173.3	178.8	-110.1	0	0	0	111.7	T621 T628 I629	T621-F625 WeakPolarHBondContact O-CB 3.25Å; T621-F625 PolarHBondContact O-N 3.26Å; F625-T628 PolarHBondContact O-N 2.64Å; F625-I629 HydrophobicContact CD1-CD1 3.96Å; F625-I629 HydrophobicContact CE1-CD1 3.51Å; F625-I629 HydrophobicContact CE2-CD1 4.18Å; F625-I629 HydrophobicContact CG-CD1 4.49Å; F625-I629 HydrophobicContact CZ-CD1 3.65Å; F625-I629 HydrophobicContact CZ-CG1 4.47Å; F625-I629 WeakPolarHBondContact O-CG1 3.32Å; F625-I629 PolarHBondContact O-N 3.29Å
626	W	94.8	Very high	92.9	Very high	59 Å²	59	47.3 Å²	47.3	22%	0.223	23%	0.228	C	C	.	.	H	α-helix	trans	-59.2	-50.8	174.1	-177.4	-90.4	0	0	0	112.2	F576 A579 S580 F583 L622 C623 T624 T628 I629 E630	F576-W626 AromaticContact CD1-CH2 3.68Å; F576-W626 HydrophobicContact CD1-CH2 3.68Å; F576-W626 AromaticContact CD1-CZ2 3.84Å; F576-W626 HydrophobicContact CD1-CZ2 3.84Å; F576-W626 AromaticContact CE1-CH2 3.79Å; F576-W626 HydrophobicContact CE1-CH2 3.79Å; F576-W626 HydrophobicContact CE1-CZ2 4.4Å; A579-W626 HydrophobicContact CB-CH2 4.19Å; A579-W626 HydrophobicContact CB-CZ2 3.74Å; S580-W626 PolarHBondContact OG-NE1 3.13Å; F583-W626 HydrophobicContact CD2-CB 4.1Å; F583-W626 AromaticContact CD2-CD1 3.57Å; F583-W626 AromaticContact CD2-CD2 3.61Å; F583-W626 HydrophobicContact CD2-CD2 3.61Å; F583-W626 AromaticContact CD2-CE2 3.78Å; F583-W626 HydrophobicContact CD2-CE3 4.29Å; F583-W626 AromaticContact CD2-CG 3.48Å; F583-W626 HydrophobicContact CD2-CG 3.48Å; F583-W626 VanDerWaalsContact CD2-CG 3.48Å; F583-W626 AromaticContact CD2-NE1 3.75Å; F583-W626 HydrophobicContact CE2-CB 4.28Å; F583-W626 AromaticContact CE2-CD2 3.47Å; F583-W626 HydrophobicContact CE2-CD2 3.47Å; F583-W626 VanDerWaalsContact CE2-CD2 3.47Å; F583-W626 AromaticContact CE2-CE2 3.88Å; F583-W626 AromaticContact CE2-CE3 3.66Å; F583-W626 HydrophobicContact CE2-CE3 3.66Å; F583-W626 AromaticContact CE2-CG 3.74Å; F583-W626 HydrophobicContact CE2-CG 3.74Å; F583-W626 HydrophobicContact CE2-CZ2 4.41Å; F583-W626 HydrophobicContact CE2-CZ3 4.21Å; F583-W626 HydrophobicContact CG-CB 4.3Å; F583-W626 HydrophobicContact CG-CG 4.08Å; F583-W626 HydrophobicContact CZ-CD2 4.38Å; F583-W626 HydrophobicContact CZ-CE3 4.31Å; L622-W626 PolarHBondContact O-N 2.95Å; C623-W626 PolarHBondContact O-N 3.28Å; T624-W626 PolarHBondContact O-N 3.46Å; W626-T628 PolarHBondContact O-N 3.25Å; W626-I629 PolarHBondContact O-N 3.37Å; W626-E630 WeakPolarHBondContact O-CB 3.47Å; W626-E630 PolarHBondContact O-N 2.66Å
627	F	94.3	Very high	93.2	Very high	5 Å²	5	45.8 Å²	45.8	2%	0.022	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-31.8	177.7	-55.6	-33.1	0	0	0	112.7	F583 C623 T624 E630 I631 I657 K695	F583-F627 HydrophobicContact CB-CE1 3.83Å; F583-F627 HydrophobicContact CB-CZ 4.13Å; C623-F627 HydrophobicContact CB-CE2 4.24Å; C623-F627 HydrophobicContact CB-CZ 4.42Å; C623-F627 VanDerWaalsContact O-CD2 3.28Å; C623-F627 WeakPolarHBondContact O-CD2 3.37Å; C623-F627 WeakPolarHBondContact O-CG 3.16Å; C623-F627 PolarHBondContact O-N 3.12Å; C623-F627 VanDerWaalsContact O-N 3.1Å; T624-F627 PolarHBondContact O-N 3.02Å; F627-E630 WeakPolarHBondContact O-CB 3.42Å; F627-E630 PolarHBondContact O-N 3.36Å; F627-I631 WeakPolarHBondContact O-CG2 3.47Å; F627-I631 PolarHBondContact O-N 3.39Å; F627-I657 HydrophobicContact CB-CG2 3.56Å; F627-I657 HydrophobicContact CD2-CG2 4.36Å; F627-I657 HydrophobicContact CG-CG2 4.48Å; F627-K695 HydrophobicContact CD1-CD 4.17Å; F627-K695 HydrophobicContact CE1-CD 4.21Å
628	T	95.5	Very high	93.3	Very high	35 Å²	35	43.6 Å²	43.6	22%	0.215	21%	0.213	C	C	.	.	H	α-helix	trans	-71.5	-42.4	178.7	-56.7	0	0	0	0	111.5	T624 F625 W626 E630 I631 F632 I657 Y661	T624-T628 WeakPolarHBondContact O-CB 3.39Å; T624-T628 PolarHBondContact O-N 2.99Å; T624-T628 PolarHBondContact O-OG1 3.23Å; F625-T628 PolarHBondContact O-N 2.64Å; W626-T628 PolarHBondContact O-N 3.25Å; T628-E630 VanDerWaalsContact C-N 3.29Å; T628-E630 PolarHBondContact O-N 3.18Å; T628-I631 WeakPolarHBondContact O-CG2 3.23Å; T628-F632 WeakPolarHBondContact O-CB 3.4Å; T628-F632 PolarHBondContact O-N 3.15Å; T628-I657 HydrophobicContact CG2-CD1 4.43Å; T628-Y661 HydrophobicContact CG2-CE2 4.35Å; T628-Y661 WeakPolarHBondContact OG1-CE2 3.37Å; T628-Y661 PolarHBondContact OG1-OH 2.88Å
629	I	94.7	Very high	93.3	Very high	63 Å²	63	42.6 Å²	42.6	32%	0.323	21%	0.211	S	C	.	.	H	α-helix	trans	-58.7	-44.8	169.4	-71.1	170.8	0	0	0	110.3	F625 W626 F632 I633	F625-I629 HydrophobicContact CD1-CD1 3.96Å; F625-I629 HydrophobicContact CE1-CD1 3.51Å; F625-I629 HydrophobicContact CE2-CD1 4.18Å; F625-I629 HydrophobicContact CG-CD1 4.49Å; F625-I629 HydrophobicContact CZ-CD1 3.65Å; F625-I629 HydrophobicContact CZ-CG1 4.47Å; F625-I629 WeakPolarHBondContact O-CG1 3.32Å; F625-I629 PolarHBondContact O-N 3.29Å; W626-I629 PolarHBondContact O-N 3.37Å; I629-F632 PolarHBondContact O-N 3.49Å; I629-I633 HydrophobicContact CG2-CD1 3.57Å; I629-I633 HydrophobicContact CG2-CG1 4.28Å; I629-I633 WeakPolarHBondContact O-CB 3.48Å; I629-I633 WeakPolarHBondContact O-CG1 3.37Å; I629-I633 PolarHBondContact O-N 2.92Å
630	E	93.7	Very high	93.2	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-48.5	-176.9	-162	-168.9	162.8	0	0	112.5	F564 S580 W626 F627 T628 R634 K695	F564-E630 HydrophobicContact CD1-CG 4.05Å; F564-E630 HydrophobicContact CE1-CG 4.33Å; S580-E630 VanDerWaalsContact OG-CD 3.26Å; S580-E630 PolarHBondContact OG-OE1 2.87Å; S580-E630 PolarHBondContact OG-OE2 2.96Å; W626-E630 WeakPolarHBondContact O-CB 3.47Å; W626-E630 PolarHBondContact O-N 2.66Å; F627-E630 WeakPolarHBondContact O-CB 3.42Å; F627-E630 PolarHBondContact O-N 3.36Å; T628-E630 VanDerWaalsContact C-N 3.29Å; T628-E630 PolarHBondContact O-N 3.18Å; E630-R634 VanDerWaalsContact O-CG 3.3Å; E630-R634 WeakPolarHBondContact O-CG 3.42Å; E630-R634 PolarHBondContact O-N 3.49Å; E630-R634 IonicContact OE1-CZ 3.23Å; E630-R634 IonicContact OE1-NH1 2.63Å; E630-R634 PolarHBondContact OE1-NH1 3.38Å; E630-R634 IonicContact OE1-NH2 2.72Å; E630-R634 PolarHBondContact OE1-NH2 2.93Å; E630-K695 VanDerWaalsContact CD-NZ 3.33Å; E630-K695 IonicContact OE1-NZ 2.68Å; E630-K695 WeakPolarHBondContact OE2-CE 3.16Å; E630-K695 IonicContact OE2-NZ 3.36Å; E630-K695 PolarHBondContact OE2-NZ 3.3Å
631	I	93.4	Very high	93.2	Very high	21 Å²	21	46.1 Å²	46.1	11%	0.108	23%	0.231	C	C	.	.	H	α-helix	trans	-71.6	-35.7	176	-166.5	176.2	0	0	0	112.3	F627 T628 R634 F635 F644 D653 L654 I657	F627-I631 WeakPolarHBondContact O-CG2 3.47Å; F627-I631 PolarHBondContact O-N 3.39Å; T628-I631 WeakPolarHBondContact O-CG2 3.23Å; I631-R634 PolarHBondContact O-N 2.96Å; I631-F635 WeakPolarHBondContact O-CB 3.23Å; I631-F635 PolarHBondContact O-N 3.41Å; I631-F644 HydrophobicContact CG1-CE1 4.21Å; I631-F644 HydrophobicContact CG1-CZ 4.22Å; I631-D653 HydrophobicContact CD1-CB 4.02Å; I631-D653 HydrophobicContact CG1-CB 4.4Å; I631-L654 HydrophobicContact CD1-CB 3.83Å; I631-L654 HydrophobicContact CD1-CD1 4.37Å; I631-I657 HydrophobicContact CG2-CD1 4.05Å
632	F	94.4	Very high	93.1	Very high	130 Å²	130	52.6 Å²	52.6	57%	0.57	26%	0.256	S	S	*	.	H	α-helix	trans	-65.8	-45.1	179.7	-177.5	-105.9	0	0	0	112.3	T628 I629 F635 I636	T628-F632 WeakPolarHBondContact O-CB 3.4Å; T628-F632 PolarHBondContact O-N 3.15Å; I629-F632 PolarHBondContact O-N 3.49Å; F632-F635 PolarHBondContact O-N 2.65Å; F632-I636 HydrophobicContact CD1-CD1 3.93Å; F632-I636 HydrophobicContact CD2-CD1 4.28Å; F632-I636 HydrophobicContact CE1-CD1 3.48Å; F632-I636 VanDerWaalsContact CE1-CD1 3.48Å; F632-I636 HydrophobicContact CE2-CD1 3.87Å; F632-I636 HydrophobicContact CG-CD1 4.32Å; F632-I636 HydrophobicContact CZ-CD1 3.46Å; F632-I636 VanDerWaalsContact CZ-CD1 3.46Å; F632-I636 PolarHBondContact O-N 3.32Å
633	I	94	Very high	92.8	Very high	42 Å²	42	53.9 Å²	53.9	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-42.1	175.5	-67.7	173	0	0	0	110.5	L560 F564 I629 S637	L560-I633 HydrophobicContact CB-CG2 4.34Å; F564-I633 HydrophobicContact CD2-CG2 3.63Å; F564-I633 HydrophobicContact CE1-CD1 4.23Å; F564-I633 HydrophobicContact CE2-CB 4.47Å; F564-I633 HydrophobicContact CE2-CD1 3.9Å; F564-I633 HydrophobicContact CE2-CG2 3.78Å; F564-I633 HydrophobicContact CG-CG2 4.08Å; F564-I633 HydrophobicContact CZ-CD1 3.62Å; F564-I633 HydrophobicContact CZ-CG2 4.34Å; I629-I633 HydrophobicContact CG2-CD1 3.57Å; I629-I633 HydrophobicContact CG2-CG1 4.28Å; I629-I633 WeakPolarHBondContact O-CB 3.48Å; I629-I633 WeakPolarHBondContact O-CG1 3.37Å; I629-I633 PolarHBondContact O-N 2.92Å; I633-S637 WeakPolarHBondContact O-CB 3.48Å; I633-S637 PolarHBondContact O-N 3.11Å; I633-S637 PolarHBondContact O-OG 3.31Å
634	R	92.6	Very high	92.7	Very high	7 Å²	7	54.6 Å²	54.6	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-49.2	173.4	-75.3	178	-176.6	132	19.7	111.6	W561 F564 E565 E630 I631 I636 S637 C638 F644 D653 K698	W561-R634 HydrophobicContact CZ3-CB 4.18Å; W561-R634 WeakPolarHBondContact CZ3-O 3.43Å; F564-R634 HydrophobicContact CB-CG 4.01Å; F564-R634 VanDerWaalsContact O-CZ 3.3Å; F564-R634 PolarHBondContact O-NE 3.2Å; F564-R634 PolarHBondContact O-NH2 2.95Å; E565-R634 IonicContact OE2-NE 3.89Å; E630-R634 VanDerWaalsContact O-CG 3.3Å; E630-R634 WeakPolarHBondContact O-CG 3.42Å; E630-R634 PolarHBondContact O-N 3.49Å; E630-R634 IonicContact OE1-CZ 3.23Å; E630-R634 IonicContact OE1-NH1 2.63Å; E630-R634 PolarHBondContact OE1-NH1 3.38Å; E630-R634 IonicContact OE1-NH2 2.72Å; E630-R634 PolarHBondContact OE1-NH2 2.93Å; I631-R634 PolarHBondContact O-N 2.96Å; R634-I636 PolarHBondContact O-N 3.44Å; R634-S637 PolarHBondContact O-N 3.42Å; R634-C638 WeakPolarHBondContact O-CB 3.44Å; R634-C638 PolarHBondContact O-N 2.69Å; R634-F644 HydrophobicContact CB-CE2 3.69Å; R634-F644 HydrophobicContact CB-CZ 3.67Å; R634-D653 IonicContact CZ-OD2 2.96Å; R634-D653 IonicContact NH1-OD1 3.89Å; R634-D653 IonicContact NH1-OD2 3.45Å; R634-D653 PolarHBondContact NH1-OD2 2.98Å; R634-K698 VanDerWaalsContact CZ-NZ 3.26Å; R634-K698 VanDerWaalsContact NE-NZ 3.18Å
635	F	94.4	Very high	92.6	Very high	66 Å²	66	59.6 Å²	59.6	29%	0.289	29%	0.291	S	S	.	.	H	α-helix	trans	-60.6	-40.5	-178.7	-179.2	-106.2	0	0	0	113.3	I631 F632 C638 Q641 F644 I645	I631-F635 WeakPolarHBondContact O-CB 3.23Å; I631-F635 PolarHBondContact O-N 3.41Å; F632-F635 PolarHBondContact O-N 2.65Å; F635-C638 PolarHBondContact O-SG 2.91Å; F635-Q641 HydrophobicContact CD2-CG 4.23Å; F635-Q641 HydrophobicContact CE1-CG 4.4Å; F635-Q641 HydrophobicContact CE2-CB 3.74Å; F635-Q641 HydrophobicContact CE2-CG 3.67Å; F635-Q641 HydrophobicContact CZ-CB 4.07Å; F635-Q641 HydrophobicContact CZ-CG 3.76Å; F635-F644 HydrophobicContact CB-CD1 4.42Å; F635-F644 HydrophobicContact CB-CE1 4.01Å; F635-F644 HydrophobicContact CB-CZ 4.46Å; F635-F644 AromaticContact CD2-CD1 3.71Å; F635-F644 HydrophobicContact CD2-CD1 3.71Å; F635-F644 HydrophobicContact CD2-CE1 4.04Å; F635-I645 HydrophobicContact CE2-CD1 4.03Å; F635-I645 HydrophobicContact CE2-CG1 4.22Å
636	I	93.6	Very high	92.3	Very high	75 Å²	75	62.4 Å²	62.4	39%	0.385	30%	0.303	S	S	.	.	H	α-helix	trans	-73.2	-35.7	176.6	-69.1	172.4	0	0	0	111.6	K557 F632 R634	K557-I636 WeakPolarHBondContact CE-O 3.16Å; K557-I636 PolarHBondContact NZ-O 3.38Å; F632-I636 HydrophobicContact CD1-CD1 3.93Å; F632-I636 HydrophobicContact CD2-CD1 4.28Å; F632-I636 HydrophobicContact CE1-CD1 3.48Å; F632-I636 VanDerWaalsContact CE1-CD1 3.48Å; F632-I636 HydrophobicContact CE2-CD1 3.87Å; F632-I636 HydrophobicContact CG-CD1 4.32Å; F632-I636 HydrophobicContact CZ-CD1 3.46Å; F632-I636 VanDerWaalsContact CZ-CD1 3.46Å; F632-I636 PolarHBondContact O-N 3.32Å; R634-I636 PolarHBondContact O-N 3.44Å
637	S	92.1	Very high	92.1	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.007	31%	0.306	C	S	.	.	H	α-helix	trans	-84.1	-16.9	-176	-53.4	0	0	0	0	114.1	P552 L560 I633 R634	P552-S637 WeakPolarHBondContact CG-O 3.23Å; L560-S637 VanDerWaalsContact CB-OG 3.25Å; L560-S637 WeakPolarHBondContact CB-OG 3.37Å; I633-S637 WeakPolarHBondContact O-CB 3.48Å; I633-S637 PolarHBondContact O-N 3.11Å; I633-S637 PolarHBondContact O-OG 3.31Å; R634-S637 PolarHBondContact O-N 3.42Å
638	C	90.8	Very high	91.8	Very high	6 Å²	6	67.8 Å²	67.8	4%	0.041	34%	0.335	C	S	.	.	S	Bend	trans	-61.9	155.3	-174.9	76.1	0	0	0	0	113.3	W561 R634 F635 F644	W561-C638 HydrophobicContact CE3-CB 4Å; W561-C638 HydrophobicContact CH2-CB 3.86Å; W561-C638 HydrophobicContact CZ3-CB 3.47Å; W561-C638 VanDerWaalsContact CZ3-CB 3.47Å; R634-C638 WeakPolarHBondContact O-CB 3.44Å; R634-C638 PolarHBondContact O-N 2.69Å; F635-C638 PolarHBondContact O-SG 2.91Å; C638-F644 HydrophobicContact CB-CB 4.27Å; C638-F644 HydrophobicContact CB-CD2 3.82Å; C638-F644 HydrophobicContact CB-CG 4.26Å
639	P	89.3	Confident	91.4	Very high	51 Å²	51	70.3 Å²	70.3	33%	0.331	34%	0.343	S	S	.	.	S	Bend	trans	-67.7	-37.3	175.1	-14.3	26.6	0	0	0	112.8	V550	V550-P639 HydrophobicContact CB-CG 4.19Å; V550-P639 HydrophobicContact CG1-CB 3.72Å; V550-P639 HydrophobicContact CG1-CG 3.86Å; V550-P639 VanDerWaalsContact O-CG 3.23Å; V550-P639 WeakPolarHBondContact O-CG 3.49Å
640	S	89.9	Confident	91.2	Very high	50 Å²	50	67.6 Å²	67.6	35%	0.35	33%	0.329	S	S	.	.			trans	-150.7	118.2	179.8	59	0	0	0	0	113	K642 I643 F644	S640-K642 VanDerWaalsContact C-N 3.31Å; S640-K642 PolarHBondContact O-N 2.98Å; S640-I643 PolarHBondContact O-N 3.12Å; S640-I643 WeakPolarHBondContact OG-CD1 3.34Å; S640-I643 WeakPolarHBondContact OG-CG1 3.26Å; S640-F644 PolarHBondContact O-N 3.24Å
641	Q	90.5	Very high	91.1	Very high	97 Å²	97	72.1 Å²	72.1	45%	0.453	35%	0.353	S	S	.	.	H	α-helix	trans	-63.2	-33.5	-175.1	-68.8	170.2	-31.3	0	0	113.1	F635 I643 F644 I645	F635-Q641 HydrophobicContact CD2-CG 4.23Å; F635-Q641 HydrophobicContact CE1-CG 4.4Å; F635-Q641 HydrophobicContact CE2-CB 3.74Å; F635-Q641 HydrophobicContact CE2-CG 3.67Å; F635-Q641 HydrophobicContact CZ-CB 4.07Å; F635-Q641 HydrophobicContact CZ-CG 3.76Å; Q641-I643 VanDerWaalsContact C-N 3.33Å; Q641-I643 PolarHBondContact O-N 2.92Å; Q641-F644 PolarHBondContact O-N 3.33Å; Q641-I645 WeakPolarHBondContact O-CG1 3.07Å; Q641-I645 PolarHBondContact O-N 3.1Å; Q641-I645 VanDerWaalsContact O-N 3.08Å
642	K	90.5	Very high	91	Very high	179 Å²	179	72.6 Å²	72.6	78%	0.778	36%	0.355	S	S	*	.	H	α-helix	trans	-68.2	-28.1	178.3	-67.8	-175.2	179.5	179.9	0	113.5	S640 K646	S640-K642 VanDerWaalsContact C-N 3.31Å; S640-K642 PolarHBondContact O-N 2.98Å; K642-K646 WeakPolarHBondContact O-CG 3.49Å
643	I	89.3	Confident	90.9	Very high	119 Å²	119	66.7 Å²	66.7	61%	0.61	33%	0.329	S	S	*	.	H	α-helix	trans	-84	-41.8	173.3	-57.2	-174.9	0	0	0	109.3	S640 Q641 I645 K646 D647	S640-I643 PolarHBondContact O-N 3.12Å; S640-I643 WeakPolarHBondContact OG-CD1 3.34Å; S640-I643 WeakPolarHBondContact OG-CG1 3.26Å; Q641-I643 VanDerWaalsContact C-N 3.33Å; Q641-I643 PolarHBondContact O-N 2.92Å; I643-I645 VanDerWaalsContact C-N 3.34Å; I643-I645 PolarHBondContact O-N 3.13Å; I643-K646 PolarHBondContact O-N 3.39Å; I643-D647 PolarHBondContact O-N 2.98Å
644	F	91.4	Very high	90.8	Very high	15 Å²	15	68.3 Å²	68.3	7%	0.066	34%	0.338	C	S	.	.	H	α-helix	trans	-51.5	-48.7	177.3	-174.7	-91.5	0	0	0	113	W561 I631 R634 F635 C638 S640 Q641 K646 D647 N650	W561-F644 AromaticContact CH2-CD2 3.91Å; W561-F644 HydrophobicContact CH2-CD2 3.91Å; W561-F644 HydrophobicContact CH2-CE2 4.03Å; W561-F644 HydrophobicContact CZ3-CD2 4.05Å; W561-F644 AromaticContact CZ3-CE2 3.94Å; W561-F644 HydrophobicContact CZ3-CE2 3.94Å; I631-F644 HydrophobicContact CG1-CE1 4.21Å; I631-F644 HydrophobicContact CG1-CZ 4.22Å; R634-F644 HydrophobicContact CB-CE2 3.69Å; R634-F644 HydrophobicContact CB-CZ 3.67Å; F635-F644 HydrophobicContact CB-CD1 4.42Å; F635-F644 HydrophobicContact CB-CE1 4.01Å; F635-F644 HydrophobicContact CB-CZ 4.46Å; F635-F644 AromaticContact CD2-CD1 3.71Å; F635-F644 HydrophobicContact CD2-CD1 3.71Å; F635-F644 HydrophobicContact CD2-CE1 4.04Å; C638-F644 HydrophobicContact CB-CB 4.27Å; C638-F644 HydrophobicContact CB-CD2 3.82Å; C638-F644 HydrophobicContact CB-CG 4.26Å; S640-F644 PolarHBondContact O-N 3.24Å; Q641-F644 PolarHBondContact O-N 3.33Å; F644-K646 PolarHBondContact O-N 2.89Å; F644-D647 PolarHBondContact O-N 2.85Å; F644-N650 HydrophobicContact CD1-CB 4.21Å; F644-N650 VanDerWaalsContact CD2-ND2 3.31Å; F644-N650 WeakPolarHBondContact CD2-ND2 3.39Å; F644-N650 HydrophobicContact CE1-CB 3.82Å; F644-N650 HydrophobicContact CE2-CB 4.16Å; F644-N650 WeakPolarHBondContact CE2-ND2 3.42Å; F644-N650 VanDerWaalsContact CE2-OD1 3.27Å; F644-N650 WeakPolarHBondContact CE2-OD1 3.49Å; F644-N650 HydrophobicContact CZ-CB 3.79Å; F644-N650 VanDerWaalsContact CZ-CG 3.41Å; F644-N650 WeakPolarHBondContact CZ-OD1 3.3Å; F644-N650 WeakPolarHBondContact O-CB 3.29Å; F644-N650 PolarHBondContact O-ND2 3.25Å
645	I	90.7	Very high	90.8	Very high	108 Å²	108	69.1 Å²	69.1	55%	0.554	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.6	179.1	-67.1	167.2	0	0	0	112.7	F635 Q641 I643	F635-I645 HydrophobicContact CE2-CD1 4.03Å; F635-I645 HydrophobicContact CE2-CG1 4.22Å; Q641-I645 WeakPolarHBondContact O-CG1 3.07Å; Q641-I645 PolarHBondContact O-N 3.1Å; Q641-I645 VanDerWaalsContact O-N 3.08Å; I643-I645 VanDerWaalsContact C-N 3.34Å; I643-I645 PolarHBondContact O-N 3.13Å
646	K	89.5	Confident	90.6	Very high	179 Å²	179	66 Å²	66	78%	0.778	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-11	-179.8	-71.1	-174.7	175.7	-169.6	0	114.1	K642 I643 F644	K642-K646 WeakPolarHBondContact O-CG 3.49Å; I643-K646 PolarHBondContact O-N 3.39Å; F644-K646 PolarHBondContact O-N 2.89Å
647	D	89.2	Confident	90.5	Very high	54 Å²	54	63.1 Å²	63.1	29%	0.289	32%	0.318	S	S	.	.			trans	-78	126.4	176.4	175.7	9.1	0	0	0	110.7	I643 F644 K649 N650 L651	I643-D647 PolarHBondContact O-N 2.98Å; F644-D647 PolarHBondContact O-N 2.85Å; D647-K649 PolarHBondContact O-N 2.77Å; D647-K649 VanDerWaalsContact O-N 3.17Å; D647-K649 PolarHBondContact OD1-N 3.17Å; D647-N650 WeakPolarHBondContact CB-ND2 3.01Å; D647-N650 PolarHBondContact O-N 2.97Å; D647-N650 PolarHBondContact OD2-ND2 3.38Å; D647-L651 PolarHBondContact O-N 2.91Å
648	I	87.6	Confident	90.5	Very high	124 Å²	124	65.8 Å²	65.8	64%	0.636	33%	0.334	S	S	*	.	H	α-helix	trans	-53.5	-35.6	179.5	-60.6	171.6	0	0	0	111.3	N650 L651 I652	I648-N650 PolarHBondContact O-N 3.04Å; I648-L651 PolarHBondContact O-N 3.27Å; I648-I652 HydrophobicContact CG2-CD1 3.91Å; I648-I652 WeakPolarHBondContact O-CD1 3.47Å; I648-I652 VanDerWaalsContact O-CG1 3.3Å; I648-I652 WeakPolarHBondContact O-CG1 3.36Å; I648-I652 PolarHBondContact O-N 3.08Å
649	K	87	Confident	90.4	Very high	87 Å²	87	65.5 Å²	65.5	38%	0.378	33%	0.332	S	S	.	.	H	α-helix	trans	-59.7	-45.8	177.5	-61.9	171.9	-174.1	168	0	111.8	D647 I652 D653	D647-K649 PolarHBondContact O-N 2.77Å; D647-K649 VanDerWaalsContact O-N 3.17Å; D647-K649 PolarHBondContact OD1-N 3.17Å; K649-I652 PolarHBondContact O-N 3.45Å; K649-D653 PolarHBondContact O-N 2.92Å
650	N	91.3	Very high	90.4	Very high	6 Å²	6	63.5 Å²	63.5	3%	0.032	32%	0.318	C	S	.	.	H	α-helix	trans	-78.5	-29.6	-177.5	-54.5	-45.6	0	0	0	111.5	F644 D647 I648 I652 D653 L654	F644-N650 HydrophobicContact CD1-CB 4.21Å; F644-N650 VanDerWaalsContact CD2-ND2 3.31Å; F644-N650 WeakPolarHBondContact CD2-ND2 3.39Å; F644-N650 HydrophobicContact CE1-CB 3.82Å; F644-N650 HydrophobicContact CE2-CB 4.16Å; F644-N650 WeakPolarHBondContact CE2-ND2 3.42Å; F644-N650 VanDerWaalsContact CE2-OD1 3.27Å; F644-N650 WeakPolarHBondContact CE2-OD1 3.49Å; F644-N650 HydrophobicContact CZ-CB 3.79Å; F644-N650 VanDerWaalsContact CZ-CG 3.41Å; F644-N650 WeakPolarHBondContact CZ-OD1 3.3Å; F644-N650 WeakPolarHBondContact O-CB 3.29Å; F644-N650 PolarHBondContact O-ND2 3.25Å; D647-N650 WeakPolarHBondContact CB-ND2 3.01Å; D647-N650 PolarHBondContact O-N 2.97Å; D647-N650 PolarHBondContact OD2-ND2 3.38Å; I648-N650 PolarHBondContact O-N 3.04Å; N650-I652 VanDerWaalsContact C-N 3.34Å; N650-D653 PolarHBondContact O-N 3.44Å; N650-L654 WeakPolarHBondContact O-CB 3.17Å; N650-L654 PolarHBondContact O-N 3.06Å
651	L	91.5	Very high	90.5	Very high	98 Å²	98	65.4 Å²	65.4	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-64.6	-37.4	171.3	-174.3	62.6	0	0	0	111.8	D647 I648 L654 A655	D647-L651 PolarHBondContact O-N 2.91Å; I648-L651 PolarHBondContact O-N 3.27Å; L651-L654 PolarHBondContact O-N 3.3Å; L651-A655 VanDerWaalsContact O-CB 3.26Å; L651-A655 WeakPolarHBondContact O-CB 3.35Å; L651-A655 PolarHBondContact O-N 3.02Å
652	I	91.6	Very high	90.4	Very high	30 Å²	30	63.9 Å²	63.9	15%	0.154	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-45.4	172.7	-70.9	161.6	0	0	0	111.1	I648 K649 N650 L654 A655 A656 I691 F694	I648-I652 HydrophobicContact CG2-CD1 3.91Å; I648-I652 WeakPolarHBondContact O-CD1 3.47Å; I648-I652 VanDerWaalsContact O-CG1 3.3Å; I648-I652 WeakPolarHBondContact O-CG1 3.36Å; I648-I652 PolarHBondContact O-N 3.08Å; K649-I652 PolarHBondContact O-N 3.45Å; N650-I652 VanDerWaalsContact C-N 3.34Å; I652-L654 VanDerWaalsContact C-N 3.29Å; I652-L654 PolarHBondContact O-N 3.49Å; I652-A655 PolarHBondContact O-N 3.48Å; I652-A656 WeakPolarHBondContact O-CB 3.26Å; I652-A656 PolarHBondContact O-N 2.98Å; I652-I691 HydrophobicContact CG2-CG2 4.33Å; I652-F694 HydrophobicContact CD1-CB 4.11Å; I652-F694 HydrophobicContact CG1-CB 4.39Å; I652-F694 HydrophobicContact CG2-CB 3.76Å
653	D	91.9	Very high	90	Very high	6 Å²	6	56.5 Å²	56.5	3%	0.032	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-42.1	174.1	-91.6	-23.4	0	0	0	111.8	I631 R634 K649 N650 K695	I631-D653 HydrophobicContact CD1-CB 4.02Å; I631-D653 HydrophobicContact CG1-CB 4.4Å; R634-D653 IonicContact CZ-OD2 2.96Å; R634-D653 IonicContact NH1-OD1 3.89Å; R634-D653 IonicContact NH1-OD2 3.45Å; R634-D653 PolarHBondContact NH1-OD2 2.98Å; K649-D653 PolarHBondContact O-N 2.92Å; N650-D653 PolarHBondContact O-N 3.44Å; D653-K695 WeakPolarHBondContact OD1-CD 3.31Å; D653-K695 WeakPolarHBondContact OD1-CE 3.2Å; D653-K695 IonicContact OD1-NZ 3.07Å; D653-K695 PolarHBondContact OD1-NZ 2.86Å
654	L	92.4	Very high	89.9	Confident	77 Å²	77	52.6 Å²	52.6	40%	0.403	26%	0.263	S	S	.	.	H	α-helix	trans	-68.6	-47.7	177.9	-178.3	61.3	0	0	0	112	I631 N650 L651 I652 A656 I657 V658	I631-L654 HydrophobicContact CD1-CB 3.83Å; I631-L654 HydrophobicContact CD1-CD1 4.37Å; N650-L654 WeakPolarHBondContact O-CB 3.17Å; N650-L654 PolarHBondContact O-N 3.06Å; L651-L654 PolarHBondContact O-N 3.3Å; I652-L654 VanDerWaalsContact C-N 3.29Å; I652-L654 PolarHBondContact O-N 3.49Å; L654-A656 PolarHBondContact O-N 2.86Å; L654-I657 HydrophobicContact CD1-CD1 4.44Å; L654-I657 HydrophobicContact CD1-CG1 4.45Å; L654-I657 VanDerWaalsContact O-CG1 3.25Å; L654-I657 WeakPolarHBondContact O-CG1 3.35Å; L654-I657 PolarHBondContact O-N 3.41Å; L654-I657 VanDerWaalsContact O-N 3.14Å; L654-V658 HydrophobicContact CD1-CG2 4.07Å; L654-V658 HydrophobicContact CG-CG2 4.18Å; L654-V658 WeakPolarHBondContact O-CG2 3.29Å; L654-V658 PolarHBondContact O-N 3.36Å; L654-V658 VanDerWaalsContact O-N 3.13Å
655	A	91.4	Very high	89.7	Confident	23 Å²	23	58.3 Å²	58.3	19%	0.19	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-25.7	179.6	0	0	0	0	0	113	L651 I652 P659 I691	L651-A655 VanDerWaalsContact O-CB 3.26Å; L651-A655 WeakPolarHBondContact O-CB 3.35Å; L651-A655 PolarHBondContact O-N 3.02Å; I652-A655 PolarHBondContact O-N 3.48Å; A655-P659 WeakPolarHBondContact O-CD 3.4Å; A655-I691 HydrophobicContact CB-CB 4.48Å; A655-I691 HydrophobicContact CB-CD1 4.24Å; A655-I691 HydrophobicContact CB-CG2 3.86Å
656	A	91	Very high	89.3	Confident	2 Å²	2	55.5 Å²	55.5	2%	0.017	27%	0.274	C	S	.	.	H	α-helix	trans	-68.7	-33.6	174.6	0	0	0	0	0	113.6	I652 L654 R692	I652-A656 WeakPolarHBondContact O-CB 3.26Å; I652-A656 PolarHBondContact O-N 2.98Å; L654-A656 PolarHBondContact O-N 2.86Å; A656-R692 HydrophobicContact CB-CB 3.85Å
657	I	92.2	Very high	88.9	Confident	13 Å²	13	47.9 Å²	47.9	7%	0.067	24%	0.242	C	C	.	.	H	α-helix	trans	-93.6	-29.3	-177	65	168.4	0	0	0	113.8	T624 F627 T628 I631 L654 Y660 Y661	T624-I657 HydrophobicContact CG2-CB 3.97Å; T624-I657 HydrophobicContact CG2-CG2 3.99Å; F627-I657 HydrophobicContact CB-CG2 3.56Å; F627-I657 HydrophobicContact CD2-CG2 4.36Å; F627-I657 HydrophobicContact CG-CG2 4.48Å; T628-I657 HydrophobicContact CG2-CD1 4.43Å; I631-I657 HydrophobicContact CG2-CD1 4.05Å; L654-I657 HydrophobicContact CD1-CD1 4.44Å; L654-I657 HydrophobicContact CD1-CG1 4.45Å; L654-I657 VanDerWaalsContact O-CG1 3.25Å; L654-I657 WeakPolarHBondContact O-CG1 3.35Å; L654-I657 PolarHBondContact O-N 3.41Å; L654-I657 VanDerWaalsContact O-N 3.14Å; I657-Y660 PolarHBondContact O-N 3.18Å; I657-Y661 HydrophobicContact CB-CD2 4.32Å; I657-Y661 HydrophobicContact CB-CE2 4.26Å; I657-Y661 HydrophobicContact CD1-CE2 4.37Å; I657-Y661 WeakPolarHBondContact O-CD2 3.2Å; I657-Y661 PolarHBondContact O-N 3.01Å
658	V	91.3	Very high	88.7	Confident	57 Å²	57	49.1 Å²	49.1	35%	0.345	25%	0.249	S	C	.	.	H	α-helix	trans	-53.7	-45.2	-175.6	161.4	0	0	0	0	114	L654 Y660 Y661 I662	L654-V658 HydrophobicContact CD1-CG2 4.07Å; L654-V658 HydrophobicContact CG-CG2 4.18Å; L654-V658 WeakPolarHBondContact O-CG2 3.29Å; L654-V658 PolarHBondContact O-N 3.36Å; L654-V658 VanDerWaalsContact O-N 3.13Å; V658-Y660 VanDerWaalsContact C-N 3.35Å; V658-Y660 PolarHBondContact O-N 2.84Å; V658-Y661 PolarHBondContact O-N 2.8Å; V658-I662 HydrophobicContact CG1-CD1 3.55Å; V658-I662 HydrophobicContact CG1-CG1 4.29Å; V658-I662 WeakPolarHBondContact O-CG1 3.44Å; V658-I662 PolarHBondContact O-N 3.34Å
659	P	88.7	Confident	88.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.5	-42.7	-179.4	-28.6	37.3	0	0	0	113.7	A655 I662 T663 L685 I688 R689	A655-P659 WeakPolarHBondContact O-CD 3.4Å; P659-I662 PolarHBondContact O-N 2.87Å; P659-T663 PolarHBondContact O-N 3.4Å; P659-T663 PolarHBondContact O-OG1 3.12Å; P659-L685 HydrophobicContact CB-CB 4.39Å; P659-L685 WeakPolarHBondContact CB-O 3.44Å; P659-I688 HydrophobicContact CG-CB 3.72Å; P659-I688 HydrophobicContact CG-CG2 3.51Å; P659-R689 HydrophobicContact CB-CG 4.04Å
660	Y	89.2	Confident	88.2	Confident	10 Å²	10	47.3 Å²	47.3	4%	0.039	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-50.4	179.3	169.7	-90	0	0	0	110.8	F617 E620 T621 T624 I657 V658 I662 T663 L664	F617-Y660 HydrophobicContact CE2-CE2 4.38Å; E620-Y660 HydrophobicContact CG-CD2 3.99Å; E620-Y660 HydrophobicContact CG-CE2 4.49Å; T621-Y660 WeakPolarHBondContact CG2-OH 3.5Å; T621-Y660 PolarHBondContact OG1-OH 2.81Å; T624-Y660 HydrophobicContact CG2-CD1 3.54Å; T624-Y660 HydrophobicContact CG2-CE1 4.29Å; T624-Y660 HydrophobicContact CG2-CG 3.82Å; I657-Y660 PolarHBondContact O-N 3.18Å; V658-Y660 VanDerWaalsContact C-N 3.35Å; V658-Y660 PolarHBondContact O-N 2.84Å; Y660-I662 PolarHBondContact O-N 3.11Å; Y660-T663 WeakPolarHBondContact CA-OG1 3.28Å; Y660-T663 PolarHBondContact O-N 2.87Å; Y660-T663 PolarHBondContact O-OG1 3.45Å; Y660-L664 HydrophobicContact CE1-CB 4.43Å; Y660-L664 HydrophobicContact CE1-CD2 3.82Å; Y660-L664 WeakPolarHBondContact O-CB 3.22Å; Y660-L664 PolarHBondContact O-N 3.39Å
661	Y	91.2	Very high	87.6	Confident	89 Å²	89	54 Å²	54	35%	0.349	27%	0.274	S	S	.	.	H	α-helix	trans	-64.4	-37.4	-178.6	-77.1	-68.8	0	0	0	112.9	T624 T628 I657 V658 F665	T624-Y661 HydrophobicContact CG2-CD2 4.34Å; T624-Y661 HydrophobicContact CG2-CE2 3.79Å; T628-Y661 HydrophobicContact CG2-CE2 4.35Å; T628-Y661 WeakPolarHBondContact OG1-CE2 3.37Å; T628-Y661 PolarHBondContact OG1-OH 2.88Å; I657-Y661 HydrophobicContact CB-CD2 4.32Å; I657-Y661 HydrophobicContact CB-CE2 4.26Å; I657-Y661 HydrophobicContact CD1-CE2 4.37Å; I657-Y661 WeakPolarHBondContact O-CD2 3.2Å; I657-Y661 PolarHBondContact O-N 3.01Å; V658-Y661 PolarHBondContact O-N 2.8Å; Y661-F665 VanDerWaalsContact O-CB 3.23Å; Y661-F665 WeakPolarHBondContact O-CB 3.35Å; Y661-F665 PolarHBondContact O-N 3.04Å
662	I	88.6	Confident	86.6	Confident	65 Å²	65	50.9 Å²	50.9	33%	0.333	26%	0.261	S	S	.	.	H	α-helix	trans	-65.7	-44.5	173.6	-62.1	169.6	0	0	0	110.5	V658 P659 Y660 L664 F665 N666 L682 L685	V658-I662 HydrophobicContact CG1-CD1 3.55Å; V658-I662 HydrophobicContact CG1-CG1 4.29Å; V658-I662 WeakPolarHBondContact O-CG1 3.44Å; V658-I662 PolarHBondContact O-N 3.34Å; P659-I662 PolarHBondContact O-N 2.87Å; Y660-I662 PolarHBondContact O-N 3.11Å; I662-L664 PolarHBondContact O-N 3.38Å; I662-F665 PolarHBondContact O-N 2.75Å; I662-N666 WeakPolarHBondContact CG2-ND2 3.32Å; I662-N666 PolarHBondContact O-N 2.89Å; I662-N666 VanDerWaalsContact O-N 3.09Å; I662-N666 PolarHBondContact O-ND2 2.97Å; I662-L682 HydrophobicContact CG2-CD2 3.92Å; I662-L685 HydrophobicContact CB-CD1 3.77Å; I662-L685 HydrophobicContact CD1-CD1 4.03Å; I662-L685 HydrophobicContact CG2-CD1 3.45Å; I662-L685 VanDerWaalsContact CG2-CD1 3.45Å
663	T	83.5	Confident	85.5	Confident	25 Å²	25	50.1 Å²	50.1	15%	0.153	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-41.7	177.2	47.9	0	0	0	0	112.6	P659 Y660 N666 V667	P659-T663 PolarHBondContact O-N 3.4Å; P659-T663 PolarHBondContact O-OG1 3.12Å; Y660-T663 WeakPolarHBondContact CA-OG1 3.28Å; Y660-T663 PolarHBondContact O-N 2.87Å; Y660-T663 PolarHBondContact O-OG1 3.45Å; T663-N666 PolarHBondContact O-N 3.36Å; T663-V667 WeakPolarHBondContact O-CG2 3.32Å; T663-V667 PolarHBondContact O-N 2.96Å; T663-V667 VanDerWaalsContact O-N 3.08Å
664	L	86.9	Confident	84.2	Confident	36 Å²	36	54.5 Å²	54.5	19%	0.188	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-46.5	177.4	179.9	64.9	0	0	0	111.6	F612 F617 Y660 I662 N666 V667 L668	F612-L664 HydrophobicContact CE1-CD1 4.46Å; F617-L664 HydrophobicContact CE2-CD1 4.36Å; F617-L664 HydrophobicContact CZ-CD1 4.09Å; Y660-L664 HydrophobicContact CE1-CB 4.43Å; Y660-L664 HydrophobicContact CE1-CD2 3.82Å; Y660-L664 WeakPolarHBondContact O-CB 3.22Å; Y660-L664 PolarHBondContact O-N 3.39Å; I662-L664 PolarHBondContact O-N 3.38Å; L664-N666 VanDerWaalsContact C-N 3.34Å; L664-N666 PolarHBondContact O-N 2.74Å; L664-V667 PolarHBondContact O-N 2.94Å; L664-L668 HydrophobicContact CD1-CD1 4.06Å; L664-L668 HydrophobicContact CD1-CG 4.19Å; L664-L668 HydrophobicContact CD2-CD1 4.5Å; L664-L668 HydrophobicContact CG-CD1 3.85Å; L664-L668 HydrophobicContact CG-CG 4.38Å; L664-L668 WeakPolarHBondContact O-CB 3.49Å; L664-L668 VanDerWaalsContact O-CG 3.29Å; L664-L668 WeakPolarHBondContact O-CG 3.25Å; L664-L668 PolarHBondContact O-N 2.95Å
665	F	86.3	Confident	82.7	Confident	135 Å²	135	52 Å²	52	59%	0.592	27%	0.271	S	S	*	.	H	α-helix	trans	-60.4	-42.3	179	-176.9	-108.5	0	0	0	112.1	Y661 I662 L668 I669	Y661-F665 VanDerWaalsContact O-CB 3.23Å; Y661-F665 WeakPolarHBondContact O-CB 3.35Å; Y661-F665 PolarHBondContact O-N 3.04Å; I662-F665 PolarHBondContact O-N 2.75Å; F665-L668 PolarHBondContact O-N 3.17Å; F665-I669 HydrophobicContact CD1-CD1 3.84Å; F665-I669 HydrophobicContact CD2-CD1 4.39Å; F665-I669 HydrophobicContact CE1-CD1 3.42Å; F665-I669 VanDerWaalsContact CE1-CD1 3.42Å; F665-I669 HydrophobicContact CE2-CD1 4.02Å; F665-I669 HydrophobicContact CG-CD1 4.32Å; F665-I669 HydrophobicContact CZ-CD1 3.53Å; F665-I669 WeakPolarHBondContact O-CG1 3.35Å; F665-I669 PolarHBondContact O-N 2.69Å; F665-I669 VanDerWaalsContact O-N 3.08Å
666	N	82.9	Confident	81.1	Confident	49 Å²	49	51.7 Å²	51.7	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-47.6	174.8	-79.2	-82.2	0	0	0	111.9	I662 T663 L664 L668 I669 T670 L682	I662-N666 WeakPolarHBondContact CG2-ND2 3.32Å; I662-N666 PolarHBondContact O-N 2.89Å; I662-N666 VanDerWaalsContact O-N 3.09Å; I662-N666 PolarHBondContact O-ND2 2.97Å; T663-N666 PolarHBondContact O-N 3.36Å; L664-N666 VanDerWaalsContact C-N 3.34Å; L664-N666 PolarHBondContact O-N 2.74Å; N666-L668 VanDerWaalsContact C-N 3.3Å; N666-L668 PolarHBondContact O-N 3.17Å; N666-I669 PolarHBondContact O-N 3.23Å; N666-I669 VanDerWaalsContact O-N 3.17Å; N666-T670 PolarHBondContact O-N 3.47Å; N666-T670 PolarHBondContact O-OG1 3.1Å; N666-T670 VanDerWaalsContact O-OG1 3.1Å; N666-L682 HydrophobicContact CB-CD1 4.18Å
667	V	80.8	Confident	79.6	Confident	19 Å²	19	55.2 Å²	55.2	12%	0.115	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-34.7	178.8	170.3	0	0	0	0	112.4	P610 F612 T663 L664 F671 A676	P610-V667 HydrophobicContact CB-CG1 3.61Å; P610-V667 HydrophobicContact CG-CG1 3.88Å; F612-V667 HydrophobicContact CE1-CG1 4.35Å; F612-V667 HydrophobicContact CZ-CG1 4.25Å; T663-V667 WeakPolarHBondContact O-CG2 3.32Å; T663-V667 PolarHBondContact O-N 2.96Å; T663-V667 VanDerWaalsContact O-N 3.08Å; L664-V667 PolarHBondContact O-N 2.94Å; V667-F671 WeakPolarHBondContact O-CA 3.5Å; V667-F671 PolarHBondContact O-N 3.38Å; V667-A676 HydrophobicContact CG2-CB 3.96Å
668	L	84.7	Confident	78	Confident	81 Å²	81	60.1 Å²	60.1	42%	0.424	31%	0.31	S	S	.	.	H	α-helix	trans	-72.8	-28	175.7	-71.7	172.4	0	0	0	113.4	F612 L664 F665 N666 F671	F612-L668 HydrophobicContact CZ-CD2 4.13Å; L664-L668 HydrophobicContact CD1-CD1 4.06Å; L664-L668 HydrophobicContact CD1-CG 4.19Å; L664-L668 HydrophobicContact CD2-CD1 4.5Å; L664-L668 HydrophobicContact CG-CD1 3.85Å; L664-L668 HydrophobicContact CG-CG 4.38Å; L664-L668 WeakPolarHBondContact O-CB 3.49Å; L664-L668 VanDerWaalsContact O-CG 3.29Å; L664-L668 WeakPolarHBondContact O-CG 3.25Å; L664-L668 PolarHBondContact O-N 2.95Å; F665-L668 PolarHBondContact O-N 3.17Å; N666-L668 VanDerWaalsContact C-N 3.3Å; N666-L668 PolarHBondContact O-N 3.17Å; L668-F671 VanDerWaalsContact O-CE2 3.26Å; L668-F671 WeakPolarHBondContact O-CE2 3.27Å
669	I	83.9	Confident	76.6	Confident	110 Å²	110	59.7 Å²	59.7	56%	0.564	31%	0.309	S	S	*	.	H	α-helix	trans	-79	-46.6	175.1	-74.3	172.3	0	0	0	111.2	F665 N666	F665-I669 HydrophobicContact CD1-CD1 3.84Å; F665-I669 HydrophobicContact CD2-CD1 4.39Å; F665-I669 HydrophobicContact CE1-CD1 3.42Å; F665-I669 VanDerWaalsContact CE1-CD1 3.42Å; F665-I669 HydrophobicContact CE2-CD1 4.02Å; F665-I669 HydrophobicContact CG-CD1 4.32Å; F665-I669 HydrophobicContact CZ-CD1 3.53Å; F665-I669 WeakPolarHBondContact O-CG1 3.35Å; F665-I669 PolarHBondContact O-N 2.69Å; F665-I669 VanDerWaalsContact O-N 3.08Å; N666-I669 PolarHBondContact O-N 3.23Å; N666-I669 VanDerWaalsContact O-N 3.17Å
670	T	80.9	Confident	75.1	Confident	62 Å²	62	63.7 Å²	63.7	38%	0.38	34%	0.342	S	S	.	.	H	α-helix	trans	-78.1	-22.8	-175.8	58.9	0	0	0	0	113.2	N666 S672	N666-T670 PolarHBondContact O-N 3.47Å; N666-T670 PolarHBondContact O-OG1 3.1Å; N666-T670 VanDerWaalsContact O-OG1 3.1Å; T670-S672 PolarHBondContact O-N 2.86Å; T670-S672 PolarHBondContact OG1-N 3.33Å; T670-S672 VanDerWaalsContact OG1-N 3.13Å; T670-S672 PolarHBondContact OG1-O 3.31Å
671	F	77.9	Confident	73.9	Confident	146 Å²	146	67.1 Å²	67.1	64%	0.64	37%	0.368	S	S	*	.	S	Bend	trans	49.4	16.7	-162.2	-75.5	-85.3	0	0	0	114.2	P610 V667 L668	P610-F671 VanDerWaalsContact CD-O 3.3Å; P610-F671 WeakPolarHBondContact CD-O 3.42Å; V667-F671 WeakPolarHBondContact O-CA 3.5Å; V667-F671 PolarHBondContact O-N 3.38Å; L668-F671 VanDerWaalsContact O-CE2 3.26Å; L668-F671 WeakPolarHBondContact O-CE2 3.27Å
672	S	71.8	Confident	72.9	Confident	34 Å²	34	63.3 Å²	63.3	24%	0.238	35%	0.354	C	S	.	.	S	Bend	trans	-135.4	131	-172.5	170.5	0	0	0	0	110.3	T670 E674	T670-S672 PolarHBondContact O-N 2.86Å; T670-S672 PolarHBondContact OG1-N 3.33Å; T670-S672 VanDerWaalsContact OG1-N 3.13Å; T670-S672 PolarHBondContact OG1-O 3.31Å; S672-E674 PolarHBondContact O-N 3.49Å; S672-E674 WeakPolarHBondContact OG-CB 3.39Å; S672-E674 PolarHBondContact OG-N 3.33Å
673	C	68.9	Low	72	Confident	13 Å²	13	62.4 Å²	62.4	9%	0.088	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-14.6	179.8	-134.3	0	0	0	0	113.3	C604 A676	C604-C673 WeakPolarHBondContact CA-SG 3.49Å; C604-C673 HydrophobicContact CB-CB 4.19Å; C604-C673 WeakPolarHBondContact CB-SG 3.3Å; C604-C673 WeakPolarHBondContact SG-CB 3.45Å; C604-C673 CovalentContact SG-SG 2.03Å; C604-C673 PolarHBondContact SG-SG 3.39Å; C673-A676 PolarHBondContact O-N 3.21Å
674	E	64	Low	71.6	Confident	99 Å²	99	67.5 Å²	67.5	46%	0.463	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-37.6	-173.3	-169.2	164.1	-156.6	0	0	113.3	S672 A676 K677 N678	S672-E674 PolarHBondContact O-N 3.49Å; S672-E674 WeakPolarHBondContact OG-CB 3.39Å; S672-E674 PolarHBondContact OG-N 3.33Å; E674-A676 PolarHBondContact O-N 3.42Å; E674-K677 PolarHBondContact O-N 3.44Å; E674-N678 VanDerWaalsContact CG-ND2 3.31Å; E674-N678 WeakPolarHBondContact CG-ND2 3.27Å; E674-N678 PolarHBondContact O-N 2.96Å
675	G	59.7	Low	71.3	Confident	24 Å²	24	66.9 Å²	66.9	25%	0.247	37%	0.372	C	S	.	.	H	α-helix	trans	-59	-35.3	173.8	0	0	0	0	0	112.8	K677 S679	G675-K677 VanDerWaalsContact C-N 3.28Å; G675-K677 PolarHBondContact O-N 3.09Å; G675-S679 PolarHBondContact O-N 3.13Å; G675-S679 PolarHBondContact O-OG 3.21Å; G675-S679 VanDerWaalsContact O-OG 3.12Å
676	A	57.6	Low	70.9	Confident	16 Å²	16	65.8 Å²	65.8	13%	0.132	36%	0.364	C	S	.	.	H	α-helix	trans	-75.8	-10.8	176.7	0	0	0	0	0	114.5	V667 C673 E674 R686	V667-A676 HydrophobicContact CG2-CB 3.96Å; C673-A676 PolarHBondContact O-N 3.21Å; E674-A676 PolarHBondContact O-N 3.42Å; A676-R686 PolarHBondContact O-NH2 3.06Å; A676-R686 VanDerWaalsContact O-NH2 3.09Å
677	K	60.7	Low	70.9	Confident	77 Å²	77	67.5 Å²	67.5	34%	0.335	38%	0.376	S	S	.	.	H	α-helix	trans	-102.5	-41.9	176.6	-76.3	-179	165	179.2	0	112.5	C604 E674 G675	C604-K677 PolarHBondContact O-NZ 3.34Å; C604-K677 VanDerWaalsContact SG-CE 3.5Å; E674-K677 PolarHBondContact O-N 3.44Å; G675-K677 VanDerWaalsContact C-N 3.28Å; G675-K677 PolarHBondContact O-N 3.09Å
678	N	57.7	Low	71.2	Confident	116 Å²	116	68.5 Å²	68.5	62%	0.62	38%	0.381	S	S	*	.	H	α-helix	trans	-86.4	-20.9	-169.9	-62.9	1.6	0	0	0	113.3	E674 A680	E674-N678 VanDerWaalsContact CG-ND2 3.31Å; E674-N678 WeakPolarHBondContact CG-ND2 3.27Å; E674-N678 PolarHBondContact O-N 2.96Å; N678-A680 PolarHBondContact O-N 3.38Å
679	S	62.2	Low	71.3	Confident	47 Å²	47	66 Å²	66	33%	0.329	37%	0.366	S	S	.	.			trans	-74.6	106.8	172.6	-59.5	0	0	0	0	111.4	G675 S681 L682 A683	G675-S679 PolarHBondContact O-N 3.13Å; G675-S679 PolarHBondContact O-OG 3.21Å; G675-S679 VanDerWaalsContact O-OG 3.12Å; S679-S681 PolarHBondContact O-N 3.17Å; S679-S681 VanDerWaalsContact O-N 3.1Å; S679-L682 WeakPolarHBondContact O-CB 3.17Å; S679-L682 PolarHBondContact O-N 3.44Å; S679-A683 PolarHBondContact O-N 3.33Å
680	A	56.6	Low	71.5	Confident	84 Å²	84	64.7 Å²	64.7	69%	0.694	36%	0.36	S	S	*	.	H	α-helix	trans	-54.5	-31.6	179	0	0	0	0	0	113.8	N678 L682 A683 F684	N678-A680 PolarHBondContact O-N 3.38Å; A680-L682 VanDerWaalsContact C-N 3.35Å; A680-L682 PolarHBondContact O-N 3.46Å; A680-A683 WeakPolarHBondContact O-CB 3.39Å; A680-A683 PolarHBondContact O-N 3.01Å; A680-F684 PolarHBondContact O-N 3.19Å
681	S	65.8	Low	71.9	Confident	82 Å²	82	64.4 Å²	64.4	57%	0.573	36%	0.355	S	S	*	.	H	α-helix	trans	-60.5	-38.3	171.9	50.4	0	0	0	0	113.4	S679 F684 L685	S679-S681 PolarHBondContact O-N 3.17Å; S679-S681 VanDerWaalsContact O-N 3.1Å; S681-F684 PolarHBondContact O-N 2.97Å; S681-L685 PolarHBondContact O-N 3.11Å
682	L	69.1	Low	72.4	Confident	10 Å²	10	57.7 Å²	57.7	5%	0.052	33%	0.325	C	S	.	.	H	α-helix	trans	-77.3	-23.1	179.1	-58.9	-177.7	0	0	0	112.4	I662 N666 S679 A680 L685	I662-L682 HydrophobicContact CG2-CD2 3.92Å; N666-L682 HydrophobicContact CB-CD1 4.18Å; S679-L682 WeakPolarHBondContact O-CB 3.17Å; S679-L682 PolarHBondContact O-N 3.44Å; A680-L682 VanDerWaalsContact C-N 3.35Å; A680-L682 PolarHBondContact O-N 3.46Å; L682-L685 HydrophobicContact CD2-CD1 3.55Å; L682-L685 HydrophobicContact CD2-CG 4.42Å; L682-L685 PolarHBondContact O-N 2.95Å
683	A	70.3	Confident	73.2	Confident	45 Å²	45	58.9 Å²	58.9	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-65	-42.4	167.5	0	0	0	0	0	111.3	S679 A680 L685 R686	S679-A683 PolarHBondContact O-N 3.33Å; A680-A683 WeakPolarHBondContact O-CB 3.39Å; A680-A683 PolarHBondContact O-N 3.01Å; A683-L685 VanDerWaalsContact C-N 3.33Å; A683-L685 PolarHBondContact O-N 2.97Å; A683-R686 VanDerWaalsContact O-CB 3.3Å; A683-R686 WeakPolarHBondContact O-CB 3.44Å; A683-R686 WeakPolarHBondContact O-CG 3.3Å; A683-R686 PolarHBondContact O-N 3.34Å; A683-R686 VanDerWaalsContact O-N 3.09Å
684	F	75.6	Confident	74.2	Confident	133 Å²	133	63.9 Å²	63.9	58%	0.583	35%	0.352	S	S	*	.	H	α-helix	trans	-61.8	-36.8	175.8	-177.2	-102	0	0	0	112.9	A680 S681 R686 V687 I688	A680-F684 PolarHBondContact O-N 3.19Å; S681-F684 PolarHBondContact O-N 2.97Å; F684-R686 PolarHBondContact O-N 3.4Å; F684-R686 VanDerWaalsContact O-N 3.13Å; F684-V687 WeakPolarHBondContact O-CB 3.39Å; F684-V687 PolarHBondContact O-N 3.21Å; F684-I688 HydrophobicContact CD1-CD1 4.09Å; F684-I688 HydrophobicContact CD1-CG1 4.34Å; F684-I688 HydrophobicContact CE1-CD1 3.88Å; F684-I688 HydrophobicContact CE1-CG1 4.11Å; F684-I688 PolarHBondContact O-N 3.12Å
685	L	79.6	Confident	75.3	Confident	22 Å²	22	59.4 Å²	59.4	12%	0.115	33%	0.331	C	S	.	.	H	α-helix	trans	-58.9	-25.4	175	-60.7	-173.7	0	0	0	113.4	P659 I662 S681 L682 A683 V687 I688 R689	P659-L685 HydrophobicContact CB-CB 4.39Å; P659-L685 WeakPolarHBondContact CB-O 3.44Å; I662-L685 HydrophobicContact CB-CD1 3.77Å; I662-L685 HydrophobicContact CD1-CD1 4.03Å; I662-L685 HydrophobicContact CG2-CD1 3.45Å; I662-L685 VanDerWaalsContact CG2-CD1 3.45Å; S681-L685 PolarHBondContact O-N 3.11Å; L682-L685 HydrophobicContact CD2-CD1 3.55Å; L682-L685 HydrophobicContact CD2-CG 4.42Å; L682-L685 PolarHBondContact O-N 2.95Å; A683-L685 VanDerWaalsContact C-N 3.33Å; A683-L685 PolarHBondContact O-N 2.97Å; L685-V687 VanDerWaalsContact C-N 3.28Å; L685-V687 PolarHBondContact O-N 2.78Å; L685-I688 HydrophobicContact CD2-CD1 3.7Å; L685-I688 WeakPolarHBondContact O-CB 3.27Å; L685-I688 PolarHBondContact O-N 3.32Å; L685-R689 PolarHBondContact O-N 3.23Å
686	R	78.4	Confident	76.5	Confident	112 Å²	112	59.8 Å²	59.8	42%	0.423	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-32.2	174.8	-53.4	-177.3	-166.2	175.2	6.2	111.6	F591 A676 A683 F684 R689	F591-R686 WeakPolarHBondContact CE2-O 3.3Å; A676-R686 PolarHBondContact O-NH2 3.06Å; A676-R686 VanDerWaalsContact O-NH2 3.09Å; A683-R686 VanDerWaalsContact O-CB 3.3Å; A683-R686 WeakPolarHBondContact O-CB 3.44Å; A683-R686 WeakPolarHBondContact O-CG 3.3Å; A683-R686 PolarHBondContact O-N 3.34Å; A683-R686 VanDerWaalsContact O-N 3.09Å; F684-R686 PolarHBondContact O-N 3.4Å; F684-R686 VanDerWaalsContact O-N 3.13Å; R686-R689 VanDerWaalsContact O-CB 3.27Å; R686-R689 WeakPolarHBondContact O-CB 3.48Å; R686-R689 PolarHBondContact O-N 3.2Å
687	V	83.1	Confident	77.8	Confident	85 Å²	85	60 Å²	60	52%	0.515	33%	0.327	S	S	.	.	H	α-helix	trans	-70.1	-38.1	173.9	-171.7	0	0	0	0	110.6	F684 L685 R689 L690	F684-V687 WeakPolarHBondContact O-CB 3.39Å; F684-V687 PolarHBondContact O-N 3.21Å; L685-V687 VanDerWaalsContact C-N 3.28Å; L685-V687 PolarHBondContact O-N 2.78Å; V687-R689 PolarHBondContact O-N 3.25Å; V687-R689 VanDerWaalsContact O-N 3.17Å; V687-L690 HydrophobicContact CG1-CD1 4.29Å; V687-L690 VanDerWaalsContact O-CB 3.27Å; V687-L690 WeakPolarHBondContact O-CB 3.31Å; V687-L690 PolarHBondContact O-N 3.08Å
688	I	86.9	Confident	78.7	Confident	41 Å²	41	58.2 Å²	58.2	21%	0.21	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-26.4	176.5	-54.2	-175.1	0	0	0	111.6	P659 F684 L685 L690 I691	P659-I688 HydrophobicContact CG-CB 3.72Å; P659-I688 HydrophobicContact CG-CG2 3.51Å; F684-I688 HydrophobicContact CD1-CD1 4.09Å; F684-I688 HydrophobicContact CD1-CG1 4.34Å; F684-I688 HydrophobicContact CE1-CD1 3.88Å; F684-I688 HydrophobicContact CE1-CG1 4.11Å; F684-I688 PolarHBondContact O-N 3.12Å; L685-I688 HydrophobicContact CD2-CD1 3.7Å; L685-I688 WeakPolarHBondContact O-CB 3.27Å; L685-I688 PolarHBondContact O-N 3.32Å; I688-L690 PolarHBondContact O-N 3.31Å; I688-L690 VanDerWaalsContact O-N 3.1Å; I688-I691 HydrophobicContact CG2-CD1 3.89Å; I688-I691 HydrophobicContact CG2-CG1 4.45Å; I688-I691 WeakPolarHBondContact O-CB 3.29Å; I688-I691 WeakPolarHBondContact O-CG1 3.28Å; I688-I691 PolarHBondContact O-N 3.39Å
689	R	86.8	Confident	79.7	Confident	27 Å²	27	55 Å²	55	10%	0.102	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-52.6	-32.9	172.4	-64.3	-178.8	169.6	-138.5	-22.4	112.4	F591 E594 E620 P659 L685 R686 V687 I691 R692	F591-R689 HydrophobicContact CD2-CB 3.86Å; F591-R689 HydrophobicContact CD2-CG 4.44Å; F591-R689 HydrophobicContact CE2-CB 3.79Å; F591-R689 HydrophobicContact CE2-CG 4.4Å; E594-R689 IonicContact OE2-NH1 3.91Å; E594-R689 PolarHBondContact OE2-NH1 2.92Å; E620-R689 VanDerWaalsContact CD-NH1 3.29Å; E620-R689 IonicContact OE1-CZ 3.49Å; E620-R689 IonicContact OE1-NE 3.25Å; E620-R689 IonicContact OE1-NH1 2.68Å; E620-R689 PolarHBondContact OE1-NH1 3.23Å; E620-R689 VanDerWaalsContact OE1-NH1 3.1Å; E620-R689 IonicContact OE1-NH2 3.59Å; E620-R689 IonicContact OE2-CZ 3.71Å; E620-R689 IonicContact OE2-NH1 3.51Å; E620-R689 PolarHBondContact OE2-NH1 3.43Å; E620-R689 IonicContact OE2-NH2 2.77Å; E620-R689 PolarHBondContact OE2-NH2 2.98Å; P659-R689 HydrophobicContact CB-CG 4.04Å; L685-R689 PolarHBondContact O-N 3.23Å; R686-R689 VanDerWaalsContact O-CB 3.27Å; R686-R689 WeakPolarHBondContact O-CB 3.48Å; R686-R689 PolarHBondContact O-N 3.2Å; V687-R689 PolarHBondContact O-N 3.25Å; V687-R689 VanDerWaalsContact O-N 3.17Å; R689-I691 PolarHBondContact O-N 3.47Å; R689-R692 WeakPolarHBondContact O-CB 3.31Å; R689-R692 WeakPolarHBondContact O-CG 3.39Å; R689-R692 PolarHBondContact O-N 3.36Å; R689-R692 PolarHBondContact O-NE 3.37Å
690	L	87.4	Confident	80.7	Confident	84 Å²	84	54.9 Å²	54.9	44%	0.44	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-61.3	-22.4	176.9	-68.6	171	0	0	0	113.7	F591 V687 I688 R692 V693	F591-L690 HydrophobicContact CD1-CD2 4.08Å; F591-L690 HydrophobicContact CE1-CD2 3.44Å; F591-L690 VanDerWaalsContact CE1-CD2 3.44Å; F591-L690 HydrophobicContact CE1-CG 4.06Å; F591-L690 HydrophobicContact CZ-CD2 4Å; F591-L690 HydrophobicContact CZ-CG 4.1Å; V687-L690 HydrophobicContact CG1-CD1 4.29Å; V687-L690 VanDerWaalsContact O-CB 3.27Å; V687-L690 WeakPolarHBondContact O-CB 3.31Å; V687-L690 PolarHBondContact O-N 3.08Å; I688-L690 PolarHBondContact O-N 3.31Å; I688-L690 VanDerWaalsContact O-N 3.1Å; L690-R692 PolarHBondContact O-N 3.15Å; L690-R692 VanDerWaalsContact O-N 3.11Å; L690-V693 VanDerWaalsContact O-CB 3.31Å; L690-V693 WeakPolarHBondContact O-CB 3.46Å; L690-V693 VanDerWaalsContact O-CG2 3.28Å; L690-V693 WeakPolarHBondContact O-CG2 3.44Å; L690-V693 PolarHBondContact O-N 3.29Å
691	I	89.6	Confident	81.8	Confident	55 Å²	55	54.5 Å²	54.5	28%	0.282	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-61.4	-23	178	-60	-176.4	0	0	0	111.3	I652 A655 I688 R689 V693 F694	I652-I691 HydrophobicContact CG2-CG2 4.33Å; A655-I691 HydrophobicContact CB-CB 4.48Å; A655-I691 HydrophobicContact CB-CD1 4.24Å; A655-I691 HydrophobicContact CB-CG2 3.86Å; I688-I691 HydrophobicContact CG2-CD1 3.89Å; I688-I691 HydrophobicContact CG2-CG1 4.45Å; I688-I691 WeakPolarHBondContact O-CB 3.29Å; I688-I691 WeakPolarHBondContact O-CG1 3.28Å; I688-I691 PolarHBondContact O-N 3.39Å; R689-I691 PolarHBondContact O-N 3.47Å; I691-V693 PolarHBondContact O-N 3.37Å; I691-V693 VanDerWaalsContact O-N 3.09Å; I691-F694 HydrophobicContact CG2-CD2 4.4Å; I691-F694 PolarHBondContact O-N 3.16Å
692	R	89.4	Confident	82.6	Confident	5 Å²	5	52 Å²	52	2%	0.019	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-56.2	-24.8	172	83.2	-175	64.8	175.6	-16.7	113.4	T584 S587 I588 E620 A656 R689 L690 F694 K695	T584-R692 WeakPolarHBondContact CG2-O 3.47Å; S587-R692 PolarHBondContact O-NH1 3.26Å; S587-R692 VanDerWaalsContact OG-CD 3.25Å; S587-R692 WeakPolarHBondContact OG-CD 3.32Å; I588-R692 HydrophobicContact CG1-CG 3.95Å; E620-R692 IonicContact OE1-CZ 3.18Å; E620-R692 IonicContact OE1-NH1 3.81Å; E620-R692 PolarHBondContact OE1-NH1 3.45Å; E620-R692 IonicContact OE1-NH2 3.27Å; E620-R692 PolarHBondContact OE1-NH2 3.48Å; A656-R692 HydrophobicContact CB-CB 3.85Å; R689-R692 WeakPolarHBondContact O-CB 3.31Å; R689-R692 WeakPolarHBondContact O-CG 3.39Å; R689-R692 PolarHBondContact O-N 3.36Å; R689-R692 PolarHBondContact O-NE 3.37Å; L690-R692 PolarHBondContact O-N 3.15Å; L690-R692 VanDerWaalsContact O-N 3.11Å; R692-F694 VanDerWaalsContact C-N 3.32Å; R692-F694 PolarHBondContact O-N 2.82Å; R692-K695 VanDerWaalsContact O-CB 3.23Å; R692-K695 WeakPolarHBondContact O-CB 3.33Å; R692-K695 PolarHBondContact O-N 3.49Å
693	V	88.8	Confident	83.4	Confident	59 Å²	59	54.6 Å²	54.6	36%	0.358	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-62.8	-36.1	173.2	-178.8	0	0	0	0	111.8	I588 L690 I691 K695 L696	I588-V693 HydrophobicContact CD1-CB 4.39Å; I588-V693 HydrophobicContact CD1-CG2 3.86Å; I588-V693 HydrophobicContact CG1-CG2 3.95Å; I588-V693 HydrophobicContact CG2-CG2 4.45Å; L690-V693 VanDerWaalsContact O-CB 3.31Å; L690-V693 WeakPolarHBondContact O-CB 3.46Å; L690-V693 VanDerWaalsContact O-CG2 3.28Å; L690-V693 WeakPolarHBondContact O-CG2 3.44Å; L690-V693 PolarHBondContact O-N 3.29Å; I691-V693 PolarHBondContact O-N 3.37Å; I691-V693 VanDerWaalsContact O-N 3.09Å; V693-K695 PolarHBondContact O-N 3.39Å; V693-L696 HydrophobicContact CG1-CD1 4.47Å; V693-L696 VanDerWaalsContact O-CB 3.3Å; V693-L696 WeakPolarHBondContact O-CB 3.33Å; V693-L696 VanDerWaalsContact O-CG 3.3Å; V693-L696 WeakPolarHBondContact O-CG 3.28Å; V693-L696 PolarHBondContact O-N 3.47Å
694	F	88.4	Confident	84.1	Confident	119 Å²	119	55.6 Å²	55.6	52%	0.522	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-71	-13.6	179.2	-66.9	-72	0	0	0	113.4	I652 I691 R692 L696 T697	I652-F694 HydrophobicContact CD1-CB 4.11Å; I652-F694 HydrophobicContact CG1-CB 4.39Å; I652-F694 HydrophobicContact CG2-CB 3.76Å; I691-F694 HydrophobicContact CG2-CD2 4.4Å; I691-F694 PolarHBondContact O-N 3.16Å; R692-F694 VanDerWaalsContact C-N 3.32Å; R692-F694 PolarHBondContact O-N 2.82Å; F694-L696 PolarHBondContact O-N 3.4Å; F694-T697 VanDerWaalsContact O-CB 3.23Å; F694-T697 WeakPolarHBondContact O-CB 3.39Å; F694-T697 WeakPolarHBondContact O-CG2 3.18Å; F694-T697 PolarHBondContact O-N 3.47Å; F694-T697 PolarHBondContact O-OG1 2.9Å
695	K	88.1	Confident	84.6	Confident	5 Å²	5	49.5 Å²	49.5	2%	0.022	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-59.5	-28.7	170.5	-171.4	173.8	175.6	111.8	0	112.1	T584 F627 E630 D653 R692 V693 T697 K698	T584-K695 HydrophobicContact CG2-CB 4.19Å; F627-K695 HydrophobicContact CD1-CD 4.17Å; F627-K695 HydrophobicContact CE1-CD 4.21Å; E630-K695 VanDerWaalsContact CD-NZ 3.33Å; E630-K695 IonicContact OE1-NZ 2.68Å; E630-K695 WeakPolarHBondContact OE2-CE 3.16Å; E630-K695 IonicContact OE2-NZ 3.36Å; E630-K695 PolarHBondContact OE2-NZ 3.3Å; D653-K695 WeakPolarHBondContact OD1-CD 3.31Å; D653-K695 WeakPolarHBondContact OD1-CE 3.2Å; D653-K695 IonicContact OD1-NZ 3.07Å; D653-K695 PolarHBondContact OD1-NZ 2.86Å; R692-K695 VanDerWaalsContact O-CB 3.23Å; R692-K695 WeakPolarHBondContact O-CB 3.33Å; R692-K695 PolarHBondContact O-N 3.49Å; V693-K695 PolarHBondContact O-N 3.39Å; K695-T697 PolarHBondContact O-N 3.18Å; K695-T697 VanDerWaalsContact O-N 3.1Å; K695-K698 WeakPolarHBondContact O-CB 3.18Å; K695-K698 PolarHBondContact O-N 3.22Å
696	L	85.3	Confident	85.1	Confident	31 Å²	31	51.5 Å²	51.5	16%	0.162	27%	0.273	C	S	.	.	H	α-helix	trans	-60.5	-18	172.7	-56.8	177.9	0	0	0	113.3	F581 T584 I588 V693 F694 K698 H699 S700 L703	F581-L696 HydrophobicContact CD2-CD2 3.76Å; F581-L696 HydrophobicContact CE2-CD2 3.68Å; F581-L696 HydrophobicContact CZ-CD2 4.36Å; T584-L696 HydrophobicContact CG2-CD2 3.57Å; T584-L696 HydrophobicContact CG2-CG 3.93Å; I588-L696 HydrophobicContact CD1-CD1 4.21Å; V693-L696 HydrophobicContact CG1-CD1 4.47Å; V693-L696 VanDerWaalsContact O-CB 3.3Å; V693-L696 WeakPolarHBondContact O-CB 3.33Å; V693-L696 VanDerWaalsContact O-CG 3.3Å; V693-L696 WeakPolarHBondContact O-CG 3.28Å; V693-L696 PolarHBondContact O-N 3.47Å; F694-L696 PolarHBondContact O-N 3.4Å; L696-K698 PolarHBondContact O-N 3.45Å; L696-H699 PolarHBondContact O-N 2.88Å; L696-S700 WeakPolarHBondContact O-CB 3.43Å; L696-S700 PolarHBondContact O-N 3.16Å; L696-L703 HydrophobicContact CB-CD1 4.34Å
697	T	84.7	Confident	85.5	Confident	21 Å²	21	50.4 Å²	50.4	13%	0.129	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-30.7	171.5	63.7	0	0	0	0	112.2	F694 K695 H699 L703 Q704	F694-T697 VanDerWaalsContact O-CB 3.23Å; F694-T697 WeakPolarHBondContact O-CB 3.39Å; F694-T697 WeakPolarHBondContact O-CG2 3.18Å; F694-T697 PolarHBondContact O-N 3.47Å; F694-T697 PolarHBondContact O-OG1 2.9Å; K695-T697 PolarHBondContact O-N 3.18Å; K695-T697 VanDerWaalsContact O-N 3.1Å; T697-H699 VanDerWaalsContact C-N 3.34Å; T697-H699 PolarHBondContact O-N 3.1Å; T697-L703 HydrophobicContact CG2-CB 4.1Å; T697-L703 HydrophobicContact CG2-CD1 4.28Å; T697-Q704 WeakPolarHBondContact O-CG 3.5Å; T697-Q704 PolarHBondContact O-NE2 3.49Å
698	K	78.5	Confident	85.7	Confident	39 Å²	39	48.1 Å²	48.1	17%	0.17	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-40.1	176.8	-171.2	166.8	-164.2	140	0	112.2	E565 R634 K695 L696 Q704	E565-K698 WeakPolarHBondContact OE1-CE 3.45Å; E565-K698 IonicContact OE1-NZ 3.72Å; E565-K698 PolarHBondContact OE1-NZ 3.43Å; E565-K698 IonicContact OE2-NZ 2.71Å; E565-K698 PolarHBondContact OE2-NZ 3.28Å; R634-K698 VanDerWaalsContact CZ-NZ 3.26Å; R634-K698 VanDerWaalsContact NE-NZ 3.18Å; K695-K698 WeakPolarHBondContact O-CB 3.18Å; K695-K698 PolarHBondContact O-N 3.22Å; L696-K698 PolarHBondContact O-N 3.45Å; K698-Q704 PolarHBondContact O-NE2 3.44Å; K698-Q704 VanDerWaalsContact O-NE2 3.12Å
699	H	79.5	Confident	85.9	Confident	49 Å²	49	46.2 Å²	46.2	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-89.8	-16.7	-176	-51.2	-81	0	0	0	113.3	S577 F581 L696 T697	S577-H699 PolarHBondContact O-CE1 3.36Å; S577-H699 PolarHBondContact OG-CE1 3.17Å; S577-H699 PolarHBondContact OG-ND1 3.17Å; F581-H699 HydrophobicContact CD2-CB 3.9Å; L696-H699 PolarHBondContact O-N 2.88Å; T697-H699 VanDerWaalsContact C-N 3.34Å; T697-H699 PolarHBondContact O-N 3.1Å
700	S	83.2	Confident	86.1	Confident	44 Å²	44	49.4 Å²	49.4	31%	0.308	27%	0.268	S	S	.	.			trans	-106.3	103.5	-180	-178.5	0	0	0	0	112.3	L696 G702 L703 Q704	L696-S700 WeakPolarHBondContact O-CB 3.43Å; L696-S700 PolarHBondContact O-N 3.16Å; S700-G702 PolarHBondContact O-N 2.84Å; S700-L703 PolarHBondContact O-N 3.36Å; S700-L703 VanDerWaalsContact O-N 3.15Å; S700-L703 PolarHBondContact OG-N 2.67Å; S700-Q704 PolarHBondContact O-N 2.96Å
701	S	78.6	Confident	86.3	Confident	77 Å²	77	51.7 Å²	51.7	54%	0.538	28%	0.275	S	S	.	.	H	α-helix	trans	-54.9	-32.9	174.2	58.4	0	0	0	0	113.1	V705 K809	S701-V705 PolarHBondContact O-N 2.98Å; S701-K809 PolarHBondContact O-NZ 3.09Å
702	G	83.4	Confident	86.3	Confident	29 Å²	29	52.8 Å²	52.8	30%	0.299	28%	0.279	S	S	.	.	H	α-helix	trans	-75.1	-37	177.3	0	0	0	0	0	114.3	S700 Q704 V705 L706	S700-G702 PolarHBondContact O-N 2.84Å; G702-Q704 VanDerWaalsContact C-N 3.28Å; G702-Q704 PolarHBondContact O-N 2.92Å; G702-V705 PolarHBondContact O-N 3.49Å; G702-L706 PolarHBondContact O-N 3.29Å
703	L	85.7	Confident	86.4	Confident	65 Å²	65	52.7 Å²	52.7	34%	0.34	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-34.7	172.6	-73.2	178.7	0	0	0	111.5	L696 T697 S700 L706 V707	L696-L703 HydrophobicContact CB-CD1 4.34Å; T697-L703 HydrophobicContact CG2-CB 4.1Å; T697-L703 HydrophobicContact CG2-CD1 4.28Å; S700-L703 PolarHBondContact O-N 3.36Å; S700-L703 VanDerWaalsContact O-N 3.15Å; S700-L703 PolarHBondContact OG-N 2.67Å; L703-L706 HydrophobicContact CD2-CD2 4.34Å; L703-L706 PolarHBondContact O-N 3.39Å; L703-V707 WeakPolarHBondContact O-CG2 3.37Å; L703-V707 PolarHBondContact O-N 3.28Å
704	Q	85.3	Confident	86.6	Confident	66 Å²	66	55.3 Å²	55.3	31%	0.308	29%	0.289	S	S	.	.	H	α-helix	trans	-65.4	-37.8	173.6	-63.2	165.8	7.3	0	0	112.1	T697 K698 S700 G702 L708	T697-Q704 WeakPolarHBondContact O-CG 3.5Å; T697-Q704 PolarHBondContact O-NE2 3.49Å; K698-Q704 PolarHBondContact O-NE2 3.44Å; K698-Q704 VanDerWaalsContact O-NE2 3.12Å; S700-Q704 PolarHBondContact O-N 2.96Å; G702-Q704 VanDerWaalsContact C-N 3.28Å; G702-Q704 PolarHBondContact O-N 2.92Å; Q704-L708 WeakPolarHBondContact O-CB 3.29Å; Q704-L708 PolarHBondContact O-N 2.85Å; Q704-L708 VanDerWaalsContact O-N 3.1Å
705	V	86.5	Confident	86.7	Confident	4 Å²	4	57 Å²	57	2%	0.024	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-45.8	171.7	172.1	0	0	0	0	109.9	S701 G702 V707 L708 T709 F802 F805 K809	S701-V705 PolarHBondContact O-N 2.98Å; G702-V705 PolarHBondContact O-N 3.49Å; V705-V707 PolarHBondContact O-N 3.44Å; V705-L708 PolarHBondContact O-N 2.68Å; V705-T709 WeakPolarHBondContact O-CB 3.19Å; V705-T709 PolarHBondContact O-N 3.43Å; V705-T709 PolarHBondContact O-OG1 2.99Å; V705-F802 HydrophobicContact CG1-CD2 3.85Å; V705-F802 HydrophobicContact CG1-CE2 3.78Å; V705-F805 HydrophobicContact CG1-CB 3.99Å; V705-K809 HydrophobicContact CG2-CB 4.21Å; V705-K809 HydrophobicContact CG2-CD 3.46Å; V705-K809 VanDerWaalsContact CG2-CD 3.46Å; V705-K809 HydrophobicContact CG2-CG 4.46Å
706	L	89.6	Confident	86.8	Confident	65 Å²	65	57.6 Å²	57.6	34%	0.34	31%	0.306	S	S	.	.	H	α-helix	trans	-59.3	-44.9	179	-174.2	64.5	0	0	0	112.7	G702 L703 T709 F710	G702-L706 PolarHBondContact O-N 3.29Å; L703-L706 HydrophobicContact CD2-CD2 4.34Å; L703-L706 PolarHBondContact O-N 3.39Å; L706-T709 PolarHBondContact O-N 2.89Å; L706-F710 HydrophobicContact CD1-CD2 4.02Å; L706-F710 HydrophobicContact CD1-CE2 3.6Å; L706-F710 HydrophobicContact CD1-CZ 4.46Å; L706-F710 HydrophobicContact CD2-CE2 4.34Å; L706-F710 HydrophobicContact CG-CD2 3.94Å; L706-F710 HydrophobicContact CG-CE2 3.77Å; L706-F710 VanDerWaalsContact O-CD2 3.27Å; L706-F710 WeakPolarHBondContact O-CD2 3.3Å; L706-F710 PolarHBondContact O-N 3.09Å
707	V	87.6	Confident	87.1	Confident	88 Å²	88	58 Å²	58	53%	0.533	31%	0.308	S	S	.	.	H	α-helix	trans	-62.9	-41.2	176.2	170.7	0	0	0	0	111.5	L703 V705 F710 K711	L703-V707 WeakPolarHBondContact O-CG2 3.37Å; L703-V707 PolarHBondContact O-N 3.28Å; V705-V707 PolarHBondContact O-N 3.44Å; V707-F710 PolarHBondContact O-N 3.27Å; V707-K711 WeakPolarHBondContact O-CB 3.4Å; V707-K711 PolarHBondContact O-N 3.21Å
708	L	87.1	Confident	87.5	Confident	38 Å²	38	60.1 Å²	60.1	20%	0.199	32%	0.324	C	S	.	.	H	α-helix	trans	-65.4	-44.9	175.1	-179.6	62.8	0	0	0	111.7	V545 Q704 V705 F710 K711 E712 F805	V545-L708 HydrophobicContact CG2-CD1 4.38Å; V545-L708 HydrophobicContact CG2-CD2 3.54Å; Q704-L708 WeakPolarHBondContact O-CB 3.29Å; Q704-L708 PolarHBondContact O-N 2.85Å; Q704-L708 VanDerWaalsContact O-N 3.1Å; V705-L708 PolarHBondContact O-N 2.68Å; L708-F710 VanDerWaalsContact C-N 3.34Å; L708-F710 PolarHBondContact O-N 3.2Å; L708-K711 PolarHBondContact O-N 3.1Å; L708-E712 HydrophobicContact CD1-CG 4.15Å; L708-E712 WeakPolarHBondContact O-CG 3.38Å; L708-E712 PolarHBondContact O-N 2.9Å; L708-F805 HydrophobicContact CD2-CB 4.12Å; L708-F805 HydrophobicContact CD2-CD1 3.39Å; L708-F805 HydrophobicContact CD2-CD2 4.06Å; L708-F805 HydrophobicContact CD2-CE1 3.75Å; L708-F805 HydrophobicContact CD2-CE2 4.4Å; L708-F805 HydrophobicContact CD2-CG 3.58Å; L708-F805 HydrophobicContact CD2-CZ 4.27Å; L708-F805 HydrophobicContact CG-CD1 4.09Å; L708-F805 HydrophobicContact CG-CD2 3.94Å; L708-F805 HydrophobicContact CG-CE1 4.13Å; L708-F805 HydrophobicContact CG-CE2 4.04Å; L708-F805 HydrophobicContact CG-CG 4.01Å; L708-F805 HydrophobicContact CG-CZ 4.14Å
709	T	91	Very high	88.1	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-56.5	-46.1	174.7	-62.5	0	0	0	0	111.4	V705 L706 S713 I798 N801 F802	V705-T709 WeakPolarHBondContact O-CB 3.19Å; V705-T709 PolarHBondContact O-N 3.43Å; V705-T709 PolarHBondContact O-OG1 2.99Å; L706-T709 PolarHBondContact O-N 2.89Å; T709-S713 WeakPolarHBondContact O-CB 3.46Å; T709-S713 PolarHBondContact O-N 2.86Å; T709-S713 PolarHBondContact O-OG 2.9Å; T709-I798 HydrophobicContact CG2-CG2 4Å; T709-I798 WeakPolarHBondContact CG2-O 3.21Å; T709-N801 HydrophobicContact CG2-CB 3.94Å; T709-F802 HydrophobicContact CG2-CB 4Å; T709-F802 WeakPolarHBondContact OG1-CA 3.4Å
710	F	90.8	Very high	88.7	Confident	94 Å²	94	63 Å²	63	41%	0.412	34%	0.341	S	S	.	.	H	α-helix	trans	-65.3	-39.4	176.3	-83.9	-61.6	0	0	0	113	L706 V707 L708 S713 I714 L717 I798	L706-F710 HydrophobicContact CD1-CD2 4.02Å; L706-F710 HydrophobicContact CD1-CE2 3.6Å; L706-F710 HydrophobicContact CD1-CZ 4.46Å; L706-F710 HydrophobicContact CD2-CE2 4.34Å; L706-F710 HydrophobicContact CG-CD2 3.94Å; L706-F710 HydrophobicContact CG-CE2 3.77Å; L706-F710 VanDerWaalsContact O-CD2 3.27Å; L706-F710 WeakPolarHBondContact O-CD2 3.3Å; L706-F710 PolarHBondContact O-N 3.09Å; V707-F710 PolarHBondContact O-N 3.27Å; L708-F710 VanDerWaalsContact C-N 3.34Å; L708-F710 PolarHBondContact O-N 3.2Å; F710-S713 PolarHBondContact O-N 2.97Å; F710-I714 PolarHBondContact O-N 2.87Å; F710-L717 HydrophobicContact CD1-CD2 4.12Å; F710-L717 HydrophobicContact CE1-CD2 4.35Å; F710-I798 HydrophobicContact CE1-CD1 4.35Å
711	K	90.3	Very high	89.2	Confident	133 Å²	133	64.9 Å²	64.9	58%	0.578	35%	0.347	S	S	*	.	H	α-helix	trans	-60.6	-46.1	176.9	176.2	177	170.6	-85.6	0	112.1	V707 L708 I714	V707-K711 WeakPolarHBondContact O-CB 3.4Å; V707-K711 PolarHBondContact O-N 3.21Å; L708-K711 PolarHBondContact O-N 3.1Å; K711-I714 WeakPolarHBondContact O-CB 3.48Å; K711-I714 WeakPolarHBondContact O-CG2 3.28Å
712	E	89.9	Confident	90	Very high	78 Å²	78	65.4 Å²	65.4	36%	0.364	35%	0.347	S	S	.	.	H	α-helix	trans	-82.7	-21.9	-178.3	-52.3	-62.6	124.3	0	0	112.4	L708 I714 F805	L708-E712 HydrophobicContact CD1-CG 4.15Å; L708-E712 WeakPolarHBondContact O-CG 3.38Å; L708-E712 PolarHBondContact O-N 2.9Å; E712-I714 VanDerWaalsContact C-N 3.31Å; E712-F805 HydrophobicContact CB-CE2 4.1Å; E712-F805 HydrophobicContact CB-CZ 4.4Å; E712-F805 HydrophobicContact CG-CE2 3.84Å; E712-F805 HydrophobicContact CG-CZ 3.79Å
713	S	92.4	Very high	90.4	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.014	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	2	173.2	-50.3	0	0	0	0	113.8	T709 F710 E715 G716 L717 N801	T709-S713 WeakPolarHBondContact O-CB 3.46Å; T709-S713 PolarHBondContact O-N 2.86Å; T709-S713 PolarHBondContact O-OG 2.9Å; F710-S713 PolarHBondContact O-N 2.97Å; S713-E715 VanDerWaalsContact C-N 3.27Å; S713-E715 PolarHBondContact O-N 3.3Å; S713-G716 PolarHBondContact O-N 2.92Å; S713-L717 VanDerWaalsContact O-CB 3.3Å; S713-L717 WeakPolarHBondContact O-CB 3.31Å; S713-L717 PolarHBondContact O-N 3.13Å; S713-N801 PolarHBondContact OG-ND2 2.87Å
714	I	92.7	Very high	90.9	Very high	114 Å²	114	63.9 Å²	63.9	59%	0.585	34%	0.337	S	S	*	.	H	α-helix	trans	-61.4	-32.6	-170.4	-163.1	170.5	0	0	0	113.3	F710 K711 E712 S718	F710-I714 PolarHBondContact O-N 2.87Å; K711-I714 WeakPolarHBondContact O-CB 3.48Å; K711-I714 WeakPolarHBondContact O-CG2 3.28Å; E712-I714 VanDerWaalsContact C-N 3.31Å; I714-S718 WeakPolarHBondContact O-CB 3.31Å; I714-S718 PolarHBondContact O-N 3.2Å
715	E	90.7	Very high	91.4	Very high	156 Å²	156	65.3 Å²	65.3	73%	0.729	35%	0.345	S	S	*	.	H	α-helix	trans	-67	-53.6	178.3	-173.6	171.3	-176.4	0	0	111.4	S713 L717 S718 L719	S713-E715 VanDerWaalsContact C-N 3.27Å; S713-E715 PolarHBondContact O-N 3.3Å; E715-L717 VanDerWaalsContact C-N 3.34Å; E715-L717 PolarHBondContact O-N 2.9Å; E715-S718 WeakPolarHBondContact O-CB 3.44Å; E715-S718 PolarHBondContact O-N 3.49Å; E715-L719 PolarHBondContact O-N 3.14Å; E715-L719 VanDerWaalsContact O-N 3.15Å
716	G	90.2	Very high	91.9	Very high	16 Å²	16	68.9 Å²	68.9	17%	0.165	37%	0.367	C	S	.	.	H	α-helix	trans	-64.6	-35.7	175.6	0	0	0	0	0	113.4	S713 L719 F720	S713-G716 PolarHBondContact O-N 2.92Å; G716-L719 PolarHBondContact O-N 3.36Å; G716-F720 PolarHBondContact O-N 3.46Å; G716-F720 VanDerWaalsContact O-N 3.11Å
717	L	91.9	Very high	92.2	Very high	41 Å²	41	67.1 Å²	67.1	22%	0.215	36%	0.36	C	S	.	.	H	α-helix	trans	-67.7	-37	175	-175.4	63.1	0	0	0	111.9	F710 S713 E715 F720 L721 I798	F710-L717 HydrophobicContact CD1-CD2 4.12Å; F710-L717 HydrophobicContact CE1-CD2 4.35Å; S713-L717 VanDerWaalsContact O-CB 3.3Å; S713-L717 WeakPolarHBondContact O-CB 3.31Å; S713-L717 PolarHBondContact O-N 3.13Å; E715-L717 VanDerWaalsContact C-N 3.34Å; E715-L717 PolarHBondContact O-N 2.9Å; L717-F720 HydrophobicContact CD1-CD1 3.99Å; L717-F720 PolarHBondContact O-N 3.05Å; L717-L721 HydrophobicContact CG-CD1 4.31Å; L717-L721 WeakPolarHBondContact O-CG 3.27Å; L717-L721 PolarHBondContact O-N 3.2Å; L717-I798 HydrophobicContact CD1-CD1 4.49Å
718	S	91.7	Very high	92.6	Very high	64 Å²	64	64 Å²	64	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-43.8	175.2	-171.2	0	0	0	0	111.6	I714 E715 F720 L721 V722	I714-S718 WeakPolarHBondContact O-CB 3.31Å; I714-S718 PolarHBondContact O-N 3.2Å; E715-S718 WeakPolarHBondContact O-CB 3.44Å; E715-S718 PolarHBondContact O-N 3.49Å; S718-F720 PolarHBondContact O-N 3.49Å; S718-L721 PolarHBondContact O-N 2.9Å; S718-V722 WeakPolarHBondContact O-CG2 3.33Å; S718-V722 PolarHBondContact O-N 3.21Å
719	L	91.2	Very high	93.1	Very high	125 Å²	125	66 Å²	66	65%	0.654	35%	0.35	S	S	*	.	H	α-helix	trans	-60.6	-44	174.7	-68.1	174.2	0	0	0	112	E715 G716 V722 A723	E715-L719 PolarHBondContact O-N 3.14Å; E715-L719 VanDerWaalsContact O-N 3.15Å; G716-L719 PolarHBondContact O-N 3.36Å; L719-V722 PolarHBondContact O-N 3.12Å; L719-A723 PolarHBondContact O-N 2.95Å
720	F	93.8	Very high	93.4	Very high	23 Å²	23	69.7 Å²	69.7	10%	0.101	37%	0.373	C	S	.	.	H	α-helix	trans	-59.3	-46.8	173	160.9	-100	0	0	0	112.1	G716 L717 S718 V722 A723 F724 T790 L791 P794	G716-F720 PolarHBondContact O-N 3.46Å; G716-F720 VanDerWaalsContact O-N 3.11Å; L717-F720 HydrophobicContact CD1-CD1 3.99Å; L717-F720 PolarHBondContact O-N 3.05Å; S718-F720 PolarHBondContact O-N 3.49Å; F720-V722 VanDerWaalsContact C-N 3.35Å; F720-V722 PolarHBondContact O-N 2.71Å; F720-A723 PolarHBondContact O-N 3.5Å; F720-F724 HydrophobicContact CE2-CB 4.24Å; F720-F724 HydrophobicContact CE2-CD2 4.01Å; F720-F724 HydrophobicContact CE2-CG 4.34Å; F720-F724 HydrophobicContact CZ-CB 4.19Å; F720-F724 AromaticContact CZ-CD2 3.94Å; F720-F724 HydrophobicContact CZ-CD2 3.94Å; F720-F724 HydrophobicContact CZ-CG 4.05Å; F720-F724 VanDerWaalsContact O-CB 3.29Å; F720-F724 WeakPolarHBondContact O-CB 3.48Å; F720-F724 PolarHBondContact O-N 2.97Å; F720-T790 HydrophobicContact CD2-CG2 4.06Å; F720-T790 WeakPolarHBondContact CD2-O 3.37Å; F720-T790 HydrophobicContact CE2-CG2 3.94Å; F720-L791 HydrophobicContact CE2-CD2 3.91Å; F720-L791 HydrophobicContact CZ-CD2 3.69Å; F720-P794 HydrophobicContact CB-CB 4.07Å; F720-P794 HydrophobicContact CB-CG 4.26Å; F720-P794 HydrophobicContact CD1-CB 4.2Å; F720-P794 HydrophobicContact CD1-CG 4.01Å; F720-P794 HydrophobicContact CD2-CB 4.29Å; F720-P794 VanDerWaalsContact CD2-CD 3.45Å; F720-P794 HydrophobicContact CD2-CG 3.54Å; F720-P794 HydrophobicContact CE1-CG 4.27Å; F720-P794 HydrophobicContact CE2-CG 3.82Å; F720-P794 HydrophobicContact CG-CB 3.9Å; F720-P794 HydrophobicContact CG-CG 3.63Å; F720-P794 HydrophobicContact CZ-CG 4.19Å
721	L	93.7	Very high	93.8	Very high	85 Å²	85	66.4 Å²	66.4	45%	0.445	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-39.7	-179	-72.9	171.8	0	0	0	112.1	L717 S718 F724 I725	L717-L721 HydrophobicContact CG-CD1 4.31Å; L717-L721 WeakPolarHBondContact O-CG 3.27Å; L717-L721 PolarHBondContact O-N 3.2Å; S718-L721 PolarHBondContact O-N 2.9Å; L721-F724 PolarHBondContact O-N 3.03Å; L721-I725 WeakPolarHBondContact O-CB 3.41Å; L721-I725 WeakPolarHBondContact O-CD1 3.35Å; L721-I725 VanDerWaalsContact O-CG1 3.25Å; L721-I725 WeakPolarHBondContact O-CG1 3.3Å; L721-I725 PolarHBondContact O-N 3.02Å
722	V	94.1	Very high	94.1	Very high	88 Å²	88	60 Å²	60	53%	0.533	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-48.3	174.1	171.6	0	0	0	0	110.9	S718 L719 F720 F724 I725 V726	S718-V722 WeakPolarHBondContact O-CG2 3.33Å; S718-V722 PolarHBondContact O-N 3.21Å; L719-V722 PolarHBondContact O-N 3.12Å; F720-V722 VanDerWaalsContact C-N 3.35Å; F720-V722 PolarHBondContact O-N 2.71Å; V722-F724 VanDerWaalsContact C-N 3.35Å; V722-F724 PolarHBondContact O-N 2.9Å; V722-I725 PolarHBondContact O-N 3.33Å; V722-V726 WeakPolarHBondContact O-CG2 3.41Å; V722-V726 PolarHBondContact O-N 2.71Å
723	A	92.5	Very high	94.4	Very high	39 Å²	39	58.1 Å²	58.1	32%	0.322	33%	0.326	S	S	.	.	H	α-helix	trans	-60.7	-43.2	177.4	0	0	0	0	0	112.1	L719 F720 I725 V726 C727 T790	L719-A723 PolarHBondContact O-N 2.95Å; F720-A723 PolarHBondContact O-N 3.5Å; A723-I725 PolarHBondContact O-N 3.47Å; A723-V726 PolarHBondContact O-N 3.31Å; A723-C727 PolarHBondContact O-N 2.94Å; A723-C727 PolarHBondContact O-SG 3.5Å; A723-C727 VanDerWaalsContact O-SG 3.38Å; A723-T790 HydrophobicContact CB-CG2 4.48Å
724	F	95.5	Very high	94.7	Very high	23 Å²	23	60.8 Å²	60.8	10%	0.101	34%	0.342	C	S	.	.	H	α-helix	trans	-63.3	-41.5	179	-164.3	-106.4	0	0	0	112	F720 L721 V722 C727 I728 M761 T790 L791	F720-F724 HydrophobicContact CE2-CB 4.24Å; F720-F724 HydrophobicContact CE2-CD2 4.01Å; F720-F724 HydrophobicContact CE2-CG 4.34Å; F720-F724 HydrophobicContact CZ-CB 4.19Å; F720-F724 AromaticContact CZ-CD2 3.94Å; F720-F724 HydrophobicContact CZ-CD2 3.94Å; F720-F724 HydrophobicContact CZ-CG 4.05Å; F720-F724 VanDerWaalsContact O-CB 3.29Å; F720-F724 WeakPolarHBondContact O-CB 3.48Å; F720-F724 PolarHBondContact O-N 2.97Å; L721-F724 PolarHBondContact O-N 3.03Å; V722-F724 VanDerWaalsContact C-N 3.35Å; V722-F724 PolarHBondContact O-N 2.9Å; F724-C727 PolarHBondContact O-N 3.3Å; F724-I728 HydrophobicContact CD1-CD1 3.64Å; F724-I728 HydrophobicContact CD1-CG1 4.47Å; F724-I728 HydrophobicContact CE1-CD1 3.66Å; F724-I728 HydrophobicContact CE1-CG1 4.41Å; F724-I728 HydrophobicContact CG-CD1 4.5Å; F724-I728 WeakPolarHBondContact O-CD1 3.47Å; F724-I728 VanDerWaalsContact O-CG1 3.29Å; F724-I728 WeakPolarHBondContact O-CG1 3.45Å; F724-I728 PolarHBondContact O-N 3.41Å; F724-M761 HydrophobicContact CD2-CE 3.61Å; F724-M761 HydrophobicContact CE2-CB 3.9Å; F724-M761 HydrophobicContact CE2-CE 3.63Å; F724-M761 HydrophobicContact CE2-SD 4.21Å; F724-M761 HydrophobicContact CZ-CB 4.15Å; F724-T790 HydrophobicContact CB-CG2 4.46Å; F724-T790 HydrophobicContact CD2-CG2 4.14Å; F724-L791 HydrophobicContact CE2-CD2 4.43Å
725	I	96.4	Very high	94.9	Very high	95 Å²	95	55.3 Å²	55.3	49%	0.487	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-43.2	173.8	-70.5	164.7	0	0	0	111.4	L721 V722 A723 I728 L729	L721-I725 WeakPolarHBondContact O-CB 3.41Å; L721-I725 WeakPolarHBondContact O-CD1 3.35Å; L721-I725 VanDerWaalsContact O-CG1 3.25Å; L721-I725 WeakPolarHBondContact O-CG1 3.3Å; L721-I725 PolarHBondContact O-N 3.02Å; V722-I725 PolarHBondContact O-N 3.33Å; A723-I725 PolarHBondContact O-N 3.47Å; I725-I728 PolarHBondContact O-N 3.42Å; I725-L729 HydrophobicContact CG2-CD1 4.03Å; I725-L729 HydrophobicContact CG2-CG 4.46Å; I725-L729 WeakPolarHBondContact O-CG 3.18Å; I725-L729 PolarHBondContact O-N 3.44Å
726	V	96.1	Very high	95.1	Very high	79 Å²	79	50.5 Å²	50.5	48%	0.479	29%	0.29	S	S	.	.	H	α-helix	trans	-61.5	-45	176.3	171.5	0	0	0	0	111.1	V722 A723 I728 L729 V730	V722-V726 WeakPolarHBondContact O-CG2 3.41Å; V722-V726 PolarHBondContact O-N 2.71Å; A723-V726 PolarHBondContact O-N 3.31Å; V726-I728 PolarHBondContact O-N 3.31Å; V726-L729 PolarHBondContact O-N 3.35Å; V726-V730 HydrophobicContact CG1-CG2 4.46Å; V726-V730 WeakPolarHBondContact O-CG2 3.41Å; V726-V730 PolarHBondContact O-N 3.11Å
727	C	96.1	Very high	95.4	Very high	29 Å²	29	57.3 Å²	57.3	20%	0.196	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-42.9	175.7	-69.3	0	0	0	0	112.6	A723 F724 V730 F731 M761	A723-C727 PolarHBondContact O-N 2.94Å; A723-C727 PolarHBondContact O-SG 3.5Å; A723-C727 VanDerWaalsContact O-SG 3.38Å; F724-C727 PolarHBondContact O-N 3.3Å; C727-V730 PolarHBondContact O-N 2.98Å; C727-F731 HydrophobicContact CB-CD2 4.27Å; C727-F731 HydrophobicContact CB-CE2 4.26Å; C727-F731 WeakPolarHBondContact O-CD2 3.29Å; C727-F731 PolarHBondContact O-N 3.01Å; C727-M761 HydrophobicContact CB-CE 3.35Å; C727-M761 HydrophobicContact CB-SD 3.68Å
728	I	97.4	Very high	95.6	Very high	21 Å²	21	57.4 Å²	57.4	11%	0.108	31%	0.314	C	S	.	.	H	α-helix	trans	-57.4	-51.4	174.2	-69.6	160.3	0	0	0	110.2	F724 I725 V726 V730 S732 F754 A757 V758 M761	F724-I728 HydrophobicContact CD1-CD1 3.64Å; F724-I728 HydrophobicContact CD1-CG1 4.47Å; F724-I728 HydrophobicContact CE1-CD1 3.66Å; F724-I728 HydrophobicContact CE1-CG1 4.41Å; F724-I728 HydrophobicContact CG-CD1 4.5Å; F724-I728 WeakPolarHBondContact O-CD1 3.47Å; F724-I728 VanDerWaalsContact O-CG1 3.29Å; F724-I728 WeakPolarHBondContact O-CG1 3.45Å; F724-I728 PolarHBondContact O-N 3.41Å; I725-I728 PolarHBondContact O-N 3.42Å; V726-I728 PolarHBondContact O-N 3.31Å; I728-V730 VanDerWaalsContact C-N 3.33Å; I728-V730 PolarHBondContact O-N 3.43Å; I728-S732 WeakPolarHBondContact O-CB 3.39Å; I728-S732 PolarHBondContact O-N 3.34Å; I728-S732 PolarHBondContact O-OG 3.04Å; I728-F754 HydrophobicContact CG2-CB 3.98Å; I728-F754 HydrophobicContact CG2-CD1 3.59Å; I728-F754 HydrophobicContact CG2-CE1 4.34Å; I728-F754 HydrophobicContact CG2-CG 3.96Å; I728-A757 HydrophobicContact CG2-CB 4.42Å; I728-V758 HydrophobicContact CD1-CG2 3.56Å; I728-V758 HydrophobicContact CG1-CG2 3.97Å; I728-M761 HydrophobicContact CG1-SD 4.23Å
729	L	97.5	Very high	95.7	Very high	81 Å²	81	54.4 Å²	54.4	42%	0.424	29%	0.292	S	S	.	.	H	α-helix	trans	-58.1	-44.5	-179.3	-71.5	169.2	0	0	0	111.9	I725 V726 S733 F754	I725-L729 HydrophobicContact CG2-CD1 4.03Å; I725-L729 HydrophobicContact CG2-CG 4.46Å; I725-L729 WeakPolarHBondContact O-CG 3.18Å; I725-L729 PolarHBondContact O-N 3.44Å; V726-L729 PolarHBondContact O-N 3.35Å; L729-S733 VanDerWaalsContact O-CB 3.3Å; L729-S733 WeakPolarHBondContact O-CB 3.45Å; L729-S733 PolarHBondContact O-N 2.91Å; L729-S733 VanDerWaalsContact O-N 3.12Å; L729-S733 PolarHBondContact O-OG 3.47Å; L729-F754 HydrophobicContact CD2-CE1 3.83Å; L729-F754 HydrophobicContact CD2-CZ 3.77Å
730	V	97.6	Very high	95.7	Very high	77 Å²	77	52.2 Å²	52.2	47%	0.467	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-58.3	178.6	171.6	0	0	0	0	111.1	V726 C727 I728 S732 S733 T734	V726-V730 HydrophobicContact CG1-CG2 4.46Å; V726-V730 WeakPolarHBondContact O-CG2 3.41Å; V726-V730 PolarHBondContact O-N 3.11Å; C727-V730 PolarHBondContact O-N 2.98Å; I728-V730 VanDerWaalsContact C-N 3.33Å; I728-V730 PolarHBondContact O-N 3.43Å; V730-S732 VanDerWaalsContact C-N 3.31Å; V730-S732 PolarHBondContact O-N 2.9Å; V730-S733 PolarHBondContact O-N 2.93Å; V730-T734 PolarHBondContact O-N 3.29Å; V730-T734 PolarHBondContact O-OG1 2.73Å
731	F	97.4	Very high	95.4	Very high	25 Å²	25	58.5 Å²	58.5	11%	0.11	32%	0.315	C	S	.	.	H	α-helix	trans	-65.4	-34.4	-175.1	-70.5	-58.3	0	0	0	113	C727 T734 I735 M761 V779 V782 C783 A786	C727-F731 HydrophobicContact CB-CD2 4.27Å; C727-F731 HydrophobicContact CB-CE2 4.26Å; C727-F731 WeakPolarHBondContact O-CD2 3.29Å; C727-F731 PolarHBondContact O-N 3.01Å; F731-T734 PolarHBondContact O-N 3.32Å; F731-I735 WeakPolarHBondContact O-CB 3.21Å; F731-I735 WeakPolarHBondContact O-CG2 3.3Å; F731-I735 PolarHBondContact O-N 3.29Å; F731-M761 HydrophobicContact CD2-SD 4.28Å; F731-V779 HydrophobicContact CD1-CG1 4.44Å; F731-V782 HydrophobicContact CE1-CB 4.48Å; F731-V782 HydrophobicContact CE1-CG1 3.95Å; F731-V782 HydrophobicContact CZ-CG1 4.22Å; F731-C783 HydrophobicContact CB-CB 4.33Å; F731-C783 HydrophobicContact CD1-CB 3.77Å; F731-C783 HydrophobicContact CD2-CB 4.15Å; F731-C783 HydrophobicContact CE1-CB 4.1Å; F731-C783 HydrophobicContact CE2-CB 4.46Å; F731-C783 HydrophobicContact CG-CB 3.82Å; F731-C783 HydrophobicContact CZ-CB 4.44Å; F731-A786 HydrophobicContact CE2-CB 3.61Å; F731-A786 HydrophobicContact CZ-CB 3.55Å
732	S	97.5	Very high	95.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-70.7	-36.3	177.6	-54.8	0	0	0	0	112.4	I728 V730 I735 Y736 A753 F754 A757	I728-S732 WeakPolarHBondContact O-CB 3.39Å; I728-S732 PolarHBondContact O-N 3.34Å; I728-S732 PolarHBondContact O-OG 3.04Å; V730-S732 VanDerWaalsContact C-N 3.31Å; V730-S732 PolarHBondContact O-N 2.9Å; S732-I735 WeakPolarHBondContact O-CG2 3.09Å; S732-Y736 VanDerWaalsContact O-CB 3.28Å; S732-Y736 WeakPolarHBondContact O-CB 3.44Å; S732-Y736 PolarHBondContact O-N 3.42Å; S732-A753 WeakPolarHBondContact O-CB 3Å; S732-A753 PolarHBondContact OG-O 3.05Å; S732-F754 WeakPolarHBondContact OG-CA 3.46Å; S732-F754 WeakPolarHBondContact OG-CD1 3.47Å; S732-F754 PolarHBondContact OG-N 3.11Å; S732-A757 WeakPolarHBondContact OG-CB 3.31Å
733	S	97.3	Very high	94.6	Very high	38 Å²	38	65.6 Å²	65.6	27%	0.266	33%	0.332	S	S	.	.	H	α-helix	trans	-68.8	-46.9	172.5	-56.5	0	0	0	0	110.9	L729 V730 I735 Y736 Y737	L729-S733 VanDerWaalsContact O-CB 3.3Å; L729-S733 WeakPolarHBondContact O-CB 3.45Å; L729-S733 PolarHBondContact O-N 2.91Å; L729-S733 VanDerWaalsContact O-N 3.12Å; L729-S733 PolarHBondContact O-OG 3.47Å; V730-S733 PolarHBondContact O-N 2.93Å; S733-I735 PolarHBondContact O-N 3.19Å; S733-Y736 PolarHBondContact O-N 2.99Å; S733-Y737 WeakPolarHBondContact O-CD2 3.45Å; S733-Y737 PolarHBondContact O-N 2.9Å
734	T	96.8	Very high	94.4	Very high	57 Å²	57	66.1 Å²	66.1	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-60.9	-45.3	179.3	-53.5	0	0	0	0	112.1	V730 F731 V738 V779	V730-T734 PolarHBondContact O-N 3.29Å; V730-T734 PolarHBondContact O-OG1 2.73Å; F731-T734 PolarHBondContact O-N 3.32Å; T734-V738 WeakPolarHBondContact O-CB 3.28Å; T734-V738 WeakPolarHBondContact O-CG2 3.47Å; T734-V738 PolarHBondContact O-N 2.96Å; T734-V738 VanDerWaalsContact O-N 3.17Å; T734-V779 HydrophobicContact CG2-CG1 3.9Å; T734-V779 HydrophobicContact CG2-CG2 3.77Å
735	I	96.7	Very high	94	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-69.1	-35.5	-178.3	-156.5	68.2	0	0	0	112.3	F731 S732 S733 V738 E739 I747 A753 W756 P771 G776 V779	F731-I735 WeakPolarHBondContact O-CB 3.21Å; F731-I735 WeakPolarHBondContact O-CG2 3.3Å; F731-I735 PolarHBondContact O-N 3.29Å; S732-I735 WeakPolarHBondContact O-CG2 3.09Å; S733-I735 PolarHBondContact O-N 3.19Å; I735-V738 PolarHBondContact O-N 3.03Å; I735-E739 HydrophobicContact CG1-CG 4.48Å; I735-E739 PolarHBondContact O-N 3.27Å; I735-I747 HydrophobicContact CB-CD1 4.38Å; I735-I747 HydrophobicContact CG1-CD1 3.63Å; I735-I747 HydrophobicContact CG2-CD1 3.86Å; I735-A753 HydrophobicContact CG2-CB 3.86Å; I735-W756 HydrophobicContact CB-CE3 4.1Å; I735-W756 HydrophobicContact CB-CH2 4.1Å; I735-W756 HydrophobicContact CB-CZ3 3.63Å; I735-W756 HydrophobicContact CD1-CH2 3.73Å; I735-W756 HydrophobicContact CD1-CZ2 4.18Å; I735-W756 HydrophobicContact CD1-CZ3 4.17Å; I735-W756 HydrophobicContact CG1-CE3 4.1Å; I735-W756 HydrophobicContact CG1-CH2 3.76Å; I735-W756 HydrophobicContact CG1-CZ2 4.21Å; I735-W756 HydrophobicContact CG1-CZ3 3.71Å; I735-W756 HydrophobicContact CG2-CE3 3.66Å; I735-W756 HydrophobicContact CG2-CZ3 3.68Å; I735-P771 HydrophobicContact CD1-CB 3.96Å; I735-P771 HydrophobicContact CD1-CG 4.39Å; I735-G776 WeakPolarHBondContact CD1-O 3.41Å; I735-V779 HydrophobicContact CB-CG1 4.37Å; I735-V779 HydrophobicContact CD1-CB 3.88Å; I735-V779 HydrophobicContact CD1-CG1 3.82Å
736	Y	96.4	Very high	93.8	Very high	55 Å²	55	64.7 Å²	64.7	22%	0.216	34%	0.337	C	S	.	.	H	α-helix	trans	-60.2	-54.1	176	174.2	-106.9	0	0	0	110.8	S732 S733 V738 E739 I740 I747 I750	S732-Y736 VanDerWaalsContact O-CB 3.28Å; S732-Y736 WeakPolarHBondContact O-CB 3.44Å; S732-Y736 PolarHBondContact O-N 3.42Å; S733-Y736 PolarHBondContact O-N 2.99Å; Y736-V738 PolarHBondContact O-N 2.95Å; Y736-E739 PolarHBondContact O-N 3.49Å; Y736-I740 HydrophobicContact CE1-CD1 4.11Å; Y736-I740 HydrophobicContact CE2-CD1 4.46Å; Y736-I740 WeakPolarHBondContact O-CB 3.22Å; Y736-I740 PolarHBondContact O-N 3.49Å; Y736-I747 HydrophobicContact CD2-CG2 4.48Å; Y736-I750 HydrophobicContact CD1-CD1 4.08Å; Y736-I750 HydrophobicContact CD1-CG1 3.63Å; Y736-I750 HydrophobicContact CD2-CG1 4.47Å; Y736-I750 HydrophobicContact CE1-CD1 4.45Å; Y736-I750 HydrophobicContact CE1-CG1 4.16Å; Y736-I750 HydrophobicContact CG-CG1 3.8Å
737	Y	95.8	Very high	93.6	Very high	159 Å²	159	61.2 Å²	61.2	62%	0.624	32%	0.316	S	S	*	.	H	α-helix	trans	-64.4	-20.8	177.8	-71.8	-62.6	0	0	0	114.3	S733	S733-Y737 WeakPolarHBondContact O-CD2 3.45Å; S733-Y737 PolarHBondContact O-N 2.9Å
738	V	95.7	Very high	93.4	Very high	42 Å²	42	67.5 Å²	67.5	26%	0.255	34%	0.342	S	S	.	.	H	α-helix	trans	-87.5	-26.4	179.1	166.9	0	0	0	0	113.3	T734 I735 Y736 L775 V779	T734-V738 WeakPolarHBondContact O-CB 3.28Å; T734-V738 WeakPolarHBondContact O-CG2 3.47Å; T734-V738 PolarHBondContact O-N 2.96Å; T734-V738 VanDerWaalsContact O-N 3.17Å; I735-V738 PolarHBondContact O-N 3.03Å; Y736-V738 PolarHBondContact O-N 2.95Å; V738-L775 HydrophobicContact CG1-CB 3.55Å; V738-V779 HydrophobicContact CG2-CG2 4.48Å
739	E	93.6	Very high	93.3	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-106.3	-10.5	179.7	-61.8	-73.9	130.1	0	0	114	I735 Y736 D741 R742 S745 P771 K772 G773	I735-E739 HydrophobicContact CG1-CG 4.48Å; I735-E739 PolarHBondContact O-N 3.27Å; Y736-E739 PolarHBondContact O-N 3.49Å; E739-D741 PolarHBondContact O-N 3.45Å; E739-R742 VanDerWaalsContact O-CB 3.31Å; E739-R742 WeakPolarHBondContact O-CB 3.37Å; E739-R742 PolarHBondContact O-N 3.29Å; E739-R742 IonicContact OE2-NE 2.87Å; E739-S745 WeakPolarHBondContact O-CB 3.41Å; E739-P771 HydrophobicContact CG-CB 4.23Å; E739-K772 PolarHBondContact OE2-N 2.68Å; E739-G773 VanDerWaalsContact OE1-CA 3.24Å; E739-G773 WeakPolarHBondContact OE1-CA 3.45Å; E739-G773 PolarHBondContact OE1-N 3.37Å; E739-G773 PolarHBondContact OE2-N 2.93Å
740	I	92.8	Very high	93.2	Very high	79 Å²	79	67.2 Å²	67.2	41%	0.405	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-48.1	-174.9	-169.6	172	0	0	0	114.4	Y736 R742	Y736-I740 HydrophobicContact CE1-CD1 4.11Å; Y736-I740 HydrophobicContact CE2-CD1 4.46Å; Y736-I740 WeakPolarHBondContact O-CB 3.22Å; Y736-I740 PolarHBondContact O-N 3.49Å; I740-R742 VanDerWaalsContact C-N 3.25Å; I740-R742 PolarHBondContact O-N 3.4Å
741	D	87.1	Confident	93.1	Very high	155 Å²	155	67.6 Å²	67.6	83%	0.829	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-0.5	-179	-63.6	-51	0	0	0	113.7	E739 K743	E739-D741 PolarHBondContact O-N 3.45Å; D741-K743 PolarHBondContact O-N 2.84Å
742	R	87	Confident	93.1	Very high	107 Å²	107	68.1 Å²	68.1	40%	0.404	35%	0.352	S	S	.	.	S	Bend	trans	-88.2	113.3	-173.5	-59.5	-169.9	64.3	80.8	2.1	110.9	E739 I740 G744 S745	E739-R742 VanDerWaalsContact O-CB 3.31Å; E739-R742 WeakPolarHBondContact O-CB 3.37Å; E739-R742 PolarHBondContact O-N 3.29Å; E739-R742 IonicContact OE2-NE 2.87Å; I740-R742 VanDerWaalsContact C-N 3.25Å; I740-R742 PolarHBondContact O-N 3.4Å; R742-G744 PolarHBondContact O-N 3.37Å; R742-G744 VanDerWaalsContact O-N 3.08Å; R742-S745 WeakPolarHBondContact O-CB 3.43Å; R742-S745 PolarHBondContact O-N 2.9Å
743	K	83.7	Confident	93	Very high	215 Å²	215	68.1 Å²	68.1	94%	0.935	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	117.6	172.7	-67.2	-171.6	178.6	-176.4	0	110.7	D741	D741-K743 PolarHBondContact O-N 2.84Å
744	G	87.4	Confident	93	Very high	50 Å²	50	69.7 Å²	69.7	52%	0.515	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	19.9	-177.3	0	0	0	0	0	115.4	R742 K772	R742-G744 PolarHBondContact O-N 3.37Å; R742-G744 VanDerWaalsContact O-N 3.08Å; G744-K772 VanDerWaalsContact O-CD 3.29Å; G744-K772 WeakPolarHBondContact O-CD 3.44Å; G744-K772 WeakPolarHBondContact O-CE 3.37Å; G744-K772 PolarHBondContact O-NZ 3.46Å
745	S	88.3	Confident	93	Very high	32 Å²	32	72.4 Å²	72.4	22%	0.224	36%	0.359	C	S	.	.			trans	-46.9	148.8	161	178.7	0	0	0	0	111	E739 R742 I747	E739-S745 WeakPolarHBondContact O-CB 3.41Å; R742-S745 WeakPolarHBondContact O-CB 3.43Å; R742-S745 PolarHBondContact O-N 2.9Å; S745-I747 PolarHBondContact OG-N 3.15Å; S745-I747 VanDerWaalsContact OG-N 3.13Å; S745-I747 PolarHBondContact OG-O 2.86Å
746	Q	91	Very high	93.1	Very high	56 Å²	56	72.8 Å²	72.8	26%	0.262	36%	0.36	S	S	.	.	S	Bend	trans	-107.3	4.9	173.9	-61.4	179.5	-81.2	0	0	112.4	D768 K769 V770	Q746-D768 PolarHBondContact NE2-O 2.87Å; Q746-K769 HydrophobicContact CB-CB 4.4Å; Q746-K769 HydrophobicContact CB-CG 4.25Å; Q746-K769 WeakPolarHBondContact O-CD 3.49Å; Q746-K769 PolarHBondContact O-NZ 2.89Å; Q746-V770 PolarHBondContact OE1-O 2.98Å
747	I	92.8	Very high	93.1	Very high	7 Å²	7	70.2 Å²	70.2	4%	0.036	35%	0.35	C	S	.	.			trans	-114.7	104.4	-174.4	-58.1	178.2	0	0	0	106.7	I735 Y736 S745 D752 A753	I735-I747 HydrophobicContact CB-CD1 4.38Å; I735-I747 HydrophobicContact CG1-CD1 3.63Å; I735-I747 HydrophobicContact CG2-CD1 3.86Å; Y736-I747 HydrophobicContact CD2-CG2 4.48Å; S745-I747 PolarHBondContact OG-N 3.15Å; S745-I747 VanDerWaalsContact OG-N 3.13Å; S745-I747 PolarHBondContact OG-O 2.86Å; I747-D752 WeakPolarHBondContact CA-OD2 3.01Å; I747-A753 HydrophobicContact CG2-CB 3.65Å
748	E	91.5	Very high	93.2	Very high	160 Å²	160	65 Å²	65	75%	0.748	33%	0.334	S	S	*	.			trans	-95.1	-25.9	-168.8	-65.3	177.8	-173.7	0	0	112.8	D752	E748-D752 PolarHBondContact N-OD2 3.15Å
749	S	94.6	Very high	93.2	Very high	47 Å²	47	63.3 Å²	63.3	33%	0.329	32%	0.324	S	S	.	.	S	Bend	trans	-155.2	168.1	-178.3	67.8	0	0	0	0	111.9	D752 A753	S749-D752 WeakPolarHBondContact O-CB 3.46Å; S749-D752 PolarHBondContact O-N 3.01Å; S749-D752 VanDerWaalsContact OG-CB 3.31Å; S749-D752 WeakPolarHBondContact OG-CB 3.47Å; S749-D752 PolarHBondContact OG-N 3.3Å; S749-A753 PolarHBondContact O-N 3.09Å
750	I	96.1	Very high	93.4	Very high	49 Å²	49	64.4 Å²	64.4	25%	0.251	33%	0.331	S	S	.	.	H	α-helix	trans	-64.7	-41.7	177	-58.5	174.1	0	0	0	112.2	Y736 D752 A753 F754	Y736-I750 HydrophobicContact CD1-CD1 4.08Å; Y736-I750 HydrophobicContact CD1-CG1 3.63Å; Y736-I750 HydrophobicContact CD2-CG1 4.47Å; Y736-I750 HydrophobicContact CE1-CD1 4.45Å; Y736-I750 HydrophobicContact CE1-CG1 4.16Å; Y736-I750 HydrophobicContact CG-CG1 3.8Å; I750-D752 VanDerWaalsContact C-N 3.3Å; I750-D752 PolarHBondContact O-N 3.4Å; I750-A753 WeakPolarHBondContact O-CB 3.45Å; I750-A753 PolarHBondContact O-N 3.02Å; I750-A753 VanDerWaalsContact O-N 3.16Å; I750-F754 HydrophobicContact CG2-CD1 4.46Å; I750-F754 HydrophobicContact CG2-CE1 3.69Å; I750-F754 HydrophobicContact CG2-CZ 4.1Å; I750-F754 WeakPolarHBondContact O-CD1 3.5Å; I750-F754 PolarHBondContact O-N 3.25Å; I750-F754 VanDerWaalsContact O-N 3.08Å
751	P	96.4	Very high	93.6	Very high	86 Å²	86	60.6 Å²	60.6	56%	0.558	31%	0.311	S	S	*	.	H	α-helix	trans	-62	-34.7	172.4	-25.8	36.3	0	0	0	114	F754	P751-F754 HydrophobicContact CB-CD2 4.3Å; P751-F754 HydrophobicContact CB-CE2 4.34Å; P751-F754 VanDerWaalsContact O-CB 3.31Å; P751-F754 WeakPolarHBondContact O-CB 3.48Å; P751-F754 PolarHBondContact O-N 3.26Å
752	D	95.6	Very high	94	Very high	36 Å²	36	55.3 Å²	55.3	19%	0.193	29%	0.286	C	S	.	.	H	α-helix	trans	-68.2	-36.6	173.4	-179.6	55.8	0	0	0	111.7	I747 E748 S749 I750 F754 W755 K769	I747-D752 WeakPolarHBondContact CA-OD2 3.01Å; E748-D752 PolarHBondContact N-OD2 3.15Å; S749-D752 WeakPolarHBondContact O-CB 3.46Å; S749-D752 PolarHBondContact O-N 3.01Å; S749-D752 VanDerWaalsContact OG-CB 3.31Å; S749-D752 WeakPolarHBondContact OG-CB 3.47Å; S749-D752 PolarHBondContact OG-N 3.3Å; I750-D752 VanDerWaalsContact C-N 3.3Å; I750-D752 PolarHBondContact O-N 3.4Å; D752-F754 VanDerWaalsContact C-N 3.27Å; D752-F754 PolarHBondContact O-N 3.36Å; D752-W755 PolarHBondContact O-N 2.03Å; D752-K769 WeakPolarHBondContact OD1-CE 3.49Å; D752-K769 IonicContact OD1-NZ 3.85Å; D752-K769 PolarHBondContact OD1-NZ 3.04Å; D752-K769 IonicContact OD2-NZ 3.64Å; D752-K769 PolarHBondContact OD2-NZ 3.38Å
753	A	96.7	Very high	94.4	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.8	-24	171.5	0	0	0	0	0	113.5	S732 I735 I747 S749 I750 W755 W756 A757	S732-A753 WeakPolarHBondContact O-CB 3Å; S732-A753 PolarHBondContact OG-O 3.05Å; I735-A753 HydrophobicContact CG2-CB 3.86Å; I747-A753 HydrophobicContact CG2-CB 3.65Å; S749-A753 PolarHBondContact O-N 3.09Å; I750-A753 WeakPolarHBondContact O-CB 3.45Å; I750-A753 PolarHBondContact O-N 3.02Å; I750-A753 VanDerWaalsContact O-N 3.16Å; A753-W755 VanDerWaalsContact C-N 3.3Å; A753-W755 PolarHBondContact O-N 2.69Å; A753-W756 PolarHBondContact O-N 3.07Å; A753-A757 PolarHBondContact O-N 3.27Å
754	F	97.4	Very high	95.1	Very high	70 Å²	70	48.2 Å²	48.2	31%	0.307	27%	0.272	S	S	.	.	H	α-helix	trans	-60.2	-40.1	173.6	-61.4	-22.6	0	0	0	111.8	I728 L729 S732 I750 P751 D752 A757 V758	I728-F754 HydrophobicContact CG2-CB 3.98Å; I728-F754 HydrophobicContact CG2-CD1 3.59Å; I728-F754 HydrophobicContact CG2-CE1 4.34Å; I728-F754 HydrophobicContact CG2-CG 3.96Å; L729-F754 HydrophobicContact CD2-CE1 3.83Å; L729-F754 HydrophobicContact CD2-CZ 3.77Å; S732-F754 WeakPolarHBondContact OG-CA 3.46Å; S732-F754 WeakPolarHBondContact OG-CD1 3.47Å; S732-F754 PolarHBondContact OG-N 3.11Å; I750-F754 HydrophobicContact CG2-CD1 4.46Å; I750-F754 HydrophobicContact CG2-CE1 3.69Å; I750-F754 HydrophobicContact CG2-CZ 4.1Å; I750-F754 WeakPolarHBondContact O-CD1 3.5Å; I750-F754 PolarHBondContact O-N 3.25Å; I750-F754 VanDerWaalsContact O-N 3.08Å; P751-F754 HydrophobicContact CB-CD2 4.3Å; P751-F754 HydrophobicContact CB-CE2 4.34Å; P751-F754 VanDerWaalsContact O-CB 3.31Å; P751-F754 WeakPolarHBondContact O-CB 3.48Å; P751-F754 PolarHBondContact O-N 3.26Å; D752-F754 VanDerWaalsContact C-N 3.27Å; D752-F754 PolarHBondContact O-N 3.36Å; F754-A757 PolarHBondContact O-N 2.95Å; F754-V758 WeakPolarHBondContact O-CB 3.34Å; F754-V758 VanDerWaalsContact O-CG2 3.29Å; F754-V758 WeakPolarHBondContact O-CG2 3.48Å; F754-V758 PolarHBondContact O-N 3.42Å
755	W	97.2	Very high	95.4	Very high	115 Å²	115	48.3 Å²	48.3	44%	0.436	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-49.8	176.5	169.8	-112.8	0	0	0	110.9	D752 A753 A757 V758 I759 Y766 D768	D752-W755 PolarHBondContact O-N 2.03Å; A753-W755 VanDerWaalsContact C-N 3.3Å; A753-W755 PolarHBondContact O-N 2.69Å; W755-A757 PolarHBondContact O-N 3.04Å; W755-V758 PolarHBondContact O-N 3.45Å; W755-I759 HydrophobicContact CD2-CG2 4.06Å; W755-I759 HydrophobicContact CE3-CG2 4.01Å; W755-I759 HydrophobicContact CH2-CG2 3.94Å; W755-I759 HydrophobicContact CZ2-CG2 3.97Å; W755-I759 HydrophobicContact CZ3-CG2 3.95Å; W755-I759 WeakPolarHBondContact O-CG1 3.25Å; W755-I759 PolarHBondContact O-N 2.96Å; W755-Y766 AromaticContact CH2-CD2 3.97Å; W755-Y766 HydrophobicContact CH2-CD2 3.97Å; W755-Y766 AromaticContact CH2-CE2 3.58Å; W755-Y766 HydrophobicContact CH2-CE2 3.58Å; W755-Y766 AromaticContact CZ2-CD2 3.61Å; W755-Y766 HydrophobicContact CZ2-CD2 3.61Å; W755-Y766 AromaticContact CZ2-CE2 3.75Å; W755-Y766 HydrophobicContact CZ2-CE2 3.75Å; W755-D768 PolarHBondContact NE1-OD2 3.35Å
756	W	97.1	Very high	95.8	Very high	8 Å²	8	54.3 Å²	54.3	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-44.7	176.2	173.3	77.5	0	0	0	112.7	I735 A753 I759 T760 K769 P771 C783	I735-W756 HydrophobicContact CB-CE3 4.1Å; I735-W756 HydrophobicContact CB-CH2 4.1Å; I735-W756 HydrophobicContact CB-CZ3 3.63Å; I735-W756 HydrophobicContact CD1-CH2 3.73Å; I735-W756 HydrophobicContact CD1-CZ2 4.18Å; I735-W756 HydrophobicContact CD1-CZ3 4.17Å; I735-W756 HydrophobicContact CG1-CE3 4.1Å; I735-W756 HydrophobicContact CG1-CH2 3.76Å; I735-W756 HydrophobicContact CG1-CZ2 4.21Å; I735-W756 HydrophobicContact CG1-CZ3 3.71Å; I735-W756 HydrophobicContact CG2-CE3 3.66Å; I735-W756 HydrophobicContact CG2-CZ3 3.68Å; A753-W756 PolarHBondContact O-N 3.07Å; W756-I759 WeakPolarHBondContact O-CG1 3.4Å; W756-T760 HydrophobicContact CZ2-CG2 4.47Å; W756-T760 PolarHBondContact NE1-OG1 3.12Å; W756-T760 VanDerWaalsContact O-CB 3.22Å; W756-T760 WeakPolarHBondContact O-CB 3.39Å; W756-T760 PolarHBondContact O-N 3.38Å; W756-T760 PolarHBondContact O-OG1 3.36Å; W756-K769 VanDerWaalsContact CD1-O 3.27Å; W756-P771 HydrophobicContact CZ2-CG 4.23Å; W756-C783 HydrophobicContact CH2-CB 4.2Å
757	A	97.3	Very high	96	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-44.2	179.5	0	0	0	0	0	111.7	I728 S732 A753 F754 W755 T760 M761	I728-A757 HydrophobicContact CG2-CB 4.42Å; S732-A757 WeakPolarHBondContact OG-CB 3.31Å; A753-A757 PolarHBondContact O-N 3.27Å; F754-A757 PolarHBondContact O-N 2.95Å; W755-A757 PolarHBondContact O-N 3.04Å; A757-T760 PolarHBondContact O-N 3.44Å; A757-M761 VanDerWaalsContact O-CB 3.31Å; A757-M761 WeakPolarHBondContact O-CB 3.33Å; A757-M761 WeakPolarHBondContact O-CG 3.46Å; A757-M761 PolarHBondContact O-N 3.09Å
758	V	97.1	Very high	96.1	Very high	49 Å²	49	56.8 Å²	56.8	30%	0.297	32%	0.318	S	S	.	.	H	α-helix	trans	-60.1	-51	177	169.4	0	0	0	0	111.3	I728 F754 W755 T760 M761 C762	I728-V758 HydrophobicContact CD1-CG2 3.56Å; I728-V758 HydrophobicContact CG1-CG2 3.97Å; F754-V758 WeakPolarHBondContact O-CB 3.34Å; F754-V758 VanDerWaalsContact O-CG2 3.29Å; F754-V758 WeakPolarHBondContact O-CG2 3.48Å; F754-V758 PolarHBondContact O-N 3.42Å; W755-V758 PolarHBondContact O-N 3.45Å; V758-T760 VanDerWaalsContact C-N 3.27Å; V758-T760 PolarHBondContact O-N 2.85Å; V758-M761 PolarHBondContact O-N 3.35Å; V758-C762 VanDerWaalsContact O-CB 3.28Å; V758-C762 WeakPolarHBondContact O-CB 3.46Å; V758-C762 PolarHBondContact O-N 3.01Å
759	I	96.9	Very high	96.2	Very high	7 Å²	7	50.9 Å²	50.9	4%	0.036	29%	0.29	C	S	.	.	H	α-helix	trans	-69.7	-26.1	-177.6	70	178.9	0	0	0	112.7	W755 W756 T763 V764 G765 Y766 D768	W755-I759 HydrophobicContact CD2-CG2 4.06Å; W755-I759 HydrophobicContact CE3-CG2 4.01Å; W755-I759 HydrophobicContact CH2-CG2 3.94Å; W755-I759 HydrophobicContact CZ2-CG2 3.97Å; W755-I759 HydrophobicContact CZ3-CG2 3.95Å; W755-I759 WeakPolarHBondContact O-CG1 3.25Å; W755-I759 PolarHBondContact O-N 2.96Å; W756-I759 WeakPolarHBondContact O-CG1 3.4Å; I759-T763 PolarHBondContact O-N 3.26Å; I759-V764 HydrophobicContact CB-CB 4.37Å; I759-V764 PolarHBondContact O-N 3.5Å; I759-G765 PolarHBondContact O-N 2.71Å; I759-Y766 HydrophobicContact CB-CD2 4.31Å; I759-Y766 HydrophobicContact CD1-CD2 4.12Å; I759-Y766 HydrophobicContact CG2-CD2 3.85Å; I759-Y766 HydrophobicContact CG2-CE2 3.92Å; I759-D768 WeakPolarHBondContact CD1-OD1 3.31Å
760	T	96.9	Very high	96.2	Very high	24 Å²	24	51.9 Å²	51.9	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-76.5	-48.8	174.8	-58.7	0	0	0	0	111.1	W756 A757 V758 C762 T763 C783 A784	W756-T760 HydrophobicContact CZ2-CG2 4.47Å; W756-T760 PolarHBondContact NE1-OG1 3.12Å; W756-T760 VanDerWaalsContact O-CB 3.22Å; W756-T760 WeakPolarHBondContact O-CB 3.39Å; W756-T760 PolarHBondContact O-N 3.38Å; W756-T760 PolarHBondContact O-OG1 3.36Å; A757-T760 PolarHBondContact O-N 3.44Å; V758-T760 VanDerWaalsContact C-N 3.27Å; V758-T760 PolarHBondContact O-N 2.85Å; T760-C762 PolarHBondContact O-N 3.24Å; T760-T763 PolarHBondContact O-N 3.23Å; T760-C783 HydrophobicContact CG2-CB 4.22Å; T760-A784 HydrophobicContact CG2-CB 4.15Å
761	M	96.3	Very high	96.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-39.5	178.3	-74.5	-174.9	70.7	0	0	112.3	F724 C727 I728 F731 A757 V758 T763 G787 L791	F724-M761 HydrophobicContact CD2-CE 3.61Å; F724-M761 HydrophobicContact CE2-CB 3.9Å; F724-M761 HydrophobicContact CE2-CE 3.63Å; F724-M761 HydrophobicContact CE2-SD 4.21Å; F724-M761 HydrophobicContact CZ-CB 4.15Å; C727-M761 HydrophobicContact CB-CE 3.35Å; C727-M761 HydrophobicContact CB-SD 3.68Å; I728-M761 HydrophobicContact CG1-SD 4.23Å; F731-M761 HydrophobicContact CD2-SD 4.28Å; A757-M761 VanDerWaalsContact O-CB 3.31Å; A757-M761 WeakPolarHBondContact O-CB 3.33Å; A757-M761 WeakPolarHBondContact O-CG 3.46Å; A757-M761 PolarHBondContact O-N 3.09Å; V758-M761 PolarHBondContact O-N 3.35Å; M761-T763 PolarHBondContact O-N 3.01Å; M761-G787 CarbonylContact O-C 3.48Å; M761-L791 WeakPolarHBondContact O-CD1 3.39Å
762	C	96.1	Very high	95.9	Very high	44 Å²	44	50.7 Å²	50.7	30%	0.297	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	3.1	173.6	-70.2	0	0	0	0	114.1	V758 T760 V764	V758-C762 VanDerWaalsContact O-CB 3.28Å; V758-C762 WeakPolarHBondContact O-CB 3.46Å; V758-C762 PolarHBondContact O-N 3.01Å; T760-C762 PolarHBondContact O-N 3.24Å; C762-V764 HydrophobicContact CB-CG2 3.88Å; C762-V764 PolarHBondContact O-N 3.29Å; C762-V764 VanDerWaalsContact O-N 3.11Å
763	T	96.4	Very high	95.8	Very high	99 Å²	99	49 Å²	49	61%	0.607	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	21.2	-178.4	65	0	0	0	0	115	I759 T760 M761 V788	I759-T763 PolarHBondContact O-N 3.26Å; T760-T763 PolarHBondContact O-N 3.23Å; M761-T763 PolarHBondContact O-N 3.01Å; T763-V788 HydrophobicContact CG2-CG2 3.59Å
764	V	97	Very high	95.6	Very high	74 Å²	74	53.4 Å²	53.4	45%	0.448	30%	0.299	S	S	.	.			trans	-78.9	-43.9	-179.7	178	0	0	0	0	111	I759 C762 Y766	I759-V764 HydrophobicContact CB-CB 4.37Å; I759-V764 PolarHBondContact O-N 3.5Å; C762-V764 HydrophobicContact CB-CG2 3.88Å; C762-V764 PolarHBondContact O-N 3.29Å; C762-V764 VanDerWaalsContact O-N 3.11Å; V764-Y766 HydrophobicContact CG1-CD1 4.09Å; V764-Y766 HydrophobicContact CG1-CD2 4.03Å; V764-Y766 HydrophobicContact CG1-CE1 3.68Å; V764-Y766 HydrophobicContact CG1-CE2 3.61Å; V764-Y766 HydrophobicContact CG1-CG 4.25Å; V764-Y766 VanDerWaalsContact CG1-CZ 3.42Å; V764-Y766 PolarHBondContact O-N 3.48Å
765	G	95	Very high	95.4	Very high	51 Å²	51	55.9 Å²	55.9	53%	0.526	32%	0.315	S	S	.	.			trans	52.5	50.7	165.8	0	0	0	0	0	116.5	I759 G767	I759-G765 PolarHBondContact O-N 2.71Å; G765-G767 PolarHBondContact O-N 2.87Å
766	Y	96.2	Very high	95.3	Very high	158 Å²	158	50.4 Å²	50.4	62%	0.62	29%	0.294	S	S	*	.			trans	-54	-26.4	-179	-65.3	-62.4	0	0	0	114.9	W755 I759 V764 D768	W755-Y766 AromaticContact CH2-CD2 3.97Å; W755-Y766 HydrophobicContact CH2-CD2 3.97Å; W755-Y766 AromaticContact CH2-CE2 3.58Å; W755-Y766 HydrophobicContact CH2-CE2 3.58Å; W755-Y766 AromaticContact CZ2-CD2 3.61Å; W755-Y766 HydrophobicContact CZ2-CD2 3.61Å; W755-Y766 AromaticContact CZ2-CE2 3.75Å; W755-Y766 HydrophobicContact CZ2-CE2 3.75Å; I759-Y766 HydrophobicContact CB-CD2 4.31Å; I759-Y766 HydrophobicContact CD1-CD2 4.12Å; I759-Y766 HydrophobicContact CG2-CD2 3.85Å; I759-Y766 HydrophobicContact CG2-CE2 3.92Å; V764-Y766 HydrophobicContact CG1-CD1 4.09Å; V764-Y766 HydrophobicContact CG1-CD2 4.03Å; V764-Y766 HydrophobicContact CG1-CE1 3.68Å; V764-Y766 HydrophobicContact CG1-CE2 3.61Å; V764-Y766 HydrophobicContact CG1-CG 4.25Å; V764-Y766 VanDerWaalsContact CG1-CZ 3.42Å; V764-Y766 PolarHBondContact O-N 3.48Å; Y766-D768 VanDerWaalsContact C-N 3.3Å; Y766-D768 PolarHBondContact O-N 3.49Å
767	G	94.4	Very high	95.3	Very high	46 Å²	46	55.9 Å²	55.9	47%	0.474	32%	0.318	S	S	.	.	S	Bend	trans	80.9	5.9	176.5	0	0	0	0	0	114.9	G765	G765-G767 PolarHBondContact O-N 2.87Å
768	D	95.5	Very high	95.3	Very high	69 Å²	69	60.2 Å²	60.2	37%	0.369	34%	0.344	S	S	.	.	S	Bend	trans	-64.5	-38.3	173.3	63.9	-48.9	0	0	0	112.2	Q746 W755 I759 Y766	Q746-D768 PolarHBondContact NE2-O 2.87Å; W755-D768 PolarHBondContact NE1-OD2 3.35Å; I759-D768 WeakPolarHBondContact CD1-OD1 3.31Å; Y766-D768 VanDerWaalsContact C-N 3.3Å; Y766-D768 PolarHBondContact O-N 3.49Å
769	K	93.6	Very high	95.2	Very high	37 Å²	37	59 Å²	59	16%	0.161	34%	0.337	C	S	.	.	S	Bend	trans	-123.2	125.1	171.9	-64.7	-176.9	-179.2	-108.2	0	110.1	Q746 D752 W756	Q746-K769 HydrophobicContact CB-CB 4.4Å; Q746-K769 HydrophobicContact CB-CG 4.25Å; Q746-K769 WeakPolarHBondContact O-CD 3.49Å; Q746-K769 PolarHBondContact O-NZ 2.89Å; D752-K769 WeakPolarHBondContact OD1-CE 3.49Å; D752-K769 IonicContact OD1-NZ 3.85Å; D752-K769 PolarHBondContact OD1-NZ 3.04Å; D752-K769 IonicContact OD2-NZ 3.64Å; D752-K769 PolarHBondContact OD2-NZ 3.38Å; W756-K769 VanDerWaalsContact CD1-O 3.27Å
770	V	95	Very high	95.2	Very high	67 Å²	67	59.2 Å²	59.2	41%	0.406	34%	0.341	S	S	.	.			trans	-137.5	143.1	176.5	-65.8	0	0	0	0	111.7	Q746	Q746-V770 PolarHBondContact OE1-O 2.98Å
771	P	94.3	Very high	95.2	Very high	14 Å²	14	61.8 Å²	61.8	9%	0.091	36%	0.36	C	S	.	.			trans	-69.9	132.8	173.6	27.4	-33	0	0	0	111.3	I735 E739 W756 G776 K777	I735-P771 HydrophobicContact CD1-CB 3.96Å; I735-P771 HydrophobicContact CD1-CG 4.39Å; E739-P771 HydrophobicContact CG-CB 4.23Å; W756-P771 HydrophobicContact CZ2-CG 4.23Å; P771-G776 VanDerWaalsContact CB-C 3.45Å; P771-G776 WeakPolarHBondContact CG-O 3.41Å; P771-K777 HydrophobicContact CG-CG 4.38Å; P771-K777 WeakPolarHBondContact O-CE 3.35Å
772	K	92.6	Very high	95.2	Very high	97 Å²	97	65.6 Å²	65.6	42%	0.422	38%	0.383	S	S	.	.			trans	-97.1	-21	-177	-65.7	-178.5	-177.5	174.5	0	111.9	E739 G744	E739-K772 PolarHBondContact OE2-N 2.68Å; G744-K772 VanDerWaalsContact O-CD 3.29Å; G744-K772 WeakPolarHBondContact O-CD 3.44Å; G744-K772 WeakPolarHBondContact O-CE 3.37Å; G744-K772 PolarHBondContact O-NZ 3.46Å
773	G	91.7	Very high	95.3	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.01	37%	0.369	C	S	.	.	S	Bend	trans	-77	154.6	175.2	0	0	0	0	0	114.4	E739 L775 G776 K777	E739-G773 VanDerWaalsContact OE1-CA 3.24Å; E739-G773 WeakPolarHBondContact OE1-CA 3.45Å; E739-G773 PolarHBondContact OE1-N 3.37Å; E739-G773 PolarHBondContact OE2-N 2.93Å; G773-L775 VanDerWaalsContact C-N 3.34Å; G773-G776 PolarHBondContact O-N 3.42Å; G773-K777 VanDerWaalsContact O-CG 3.32Å; G773-K777 WeakPolarHBondContact O-CG 3.47Å; G773-K777 PolarHBondContact O-N 3.33Å
774	P	93.3	Very high	95.3	Very high	92 Å²	92	60.5 Å²	60.5	60%	0.597	35%	0.354	S	S	*	.	H	α-helix	trans	-64.2	-41.3	171.7	26.9	-32.7	0	0	0	110.8	K777 V778	P774-K777 PolarHBondContact O-N 3.45Å; P774-V778 WeakPolarHBondContact O-CG2 3.31Å; P774-V778 PolarHBondContact O-N 2.86Å
775	L	94.3	Very high	95.3	Very high	121 Å²	121	61.5 Å²	61.5	63%	0.634	36%	0.36	S	S	*	.	H	α-helix	trans	-61.9	-45.4	173.5	-65.5	178.1	0	0	0	111.5	V738 G773 K777 V778 V779	V738-L775 HydrophobicContact CG1-CB 3.55Å; G773-L775 VanDerWaalsContact C-N 3.34Å; L775-K777 VanDerWaalsContact C-N 3.27Å; L775-K777 PolarHBondContact O-N 2.99Å; L775-V778 WeakPolarHBondContact O-CB 3.43Å; L775-V778 PolarHBondContact O-N 2.88Å; L775-V778 VanDerWaalsContact O-N 3.09Å; L775-V779 WeakPolarHBondContact O-CG2 3.24Å; L775-V779 PolarHBondContact O-N 2.79Å
776	G	95.2	Very high	95.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.2	-34.2	178.2	0	0	0	0	0	112.5	I735 P771 G773 V779 G780	I735-G776 WeakPolarHBondContact CD1-O 3.41Å; P771-G776 VanDerWaalsContact CB-C 3.45Å; P771-G776 WeakPolarHBondContact CG-O 3.41Å; G773-G776 PolarHBondContact O-N 3.42Å; G776-V779 PolarHBondContact O-N 2.77Å; G776-G780 PolarHBondContact O-N 3.36Å
777	K	95.5	Very high	95.3	Very high	124 Å²	124	52.6 Å²	52.6	54%	0.539	31%	0.314	S	S	.	.	H	α-helix	trans	-66.7	-40.1	171.5	-73.1	170.1	-178.6	179	0	112.7	P771 G773 P774 L775 G780 S781	P771-K777 HydrophobicContact CG-CG 4.38Å; P771-K777 WeakPolarHBondContact O-CE 3.35Å; G773-K777 VanDerWaalsContact O-CG 3.32Å; G773-K777 WeakPolarHBondContact O-CG 3.47Å; G773-K777 PolarHBondContact O-N 3.33Å; P774-K777 PolarHBondContact O-N 3.45Å; L775-K777 VanDerWaalsContact C-N 3.27Å; L775-K777 PolarHBondContact O-N 2.99Å; K777-G780 PolarHBondContact O-N 3.13Å; K777-S781 PolarHBondContact O-N 2.97Å; K777-S781 PolarHBondContact O-OG 3.29Å; K777-S781 VanDerWaalsContact O-OG 3.1Å
778	V	97.1	Very high	95.3	Very high	91 Å²	91	54.2 Å²	54.2	55%	0.552	32%	0.315	S	S	*	.	H	α-helix	trans	-62.1	-46.6	172.7	172.2	0	0	0	0	110.9	P774 L775 G780 S781 V782	P774-V778 WeakPolarHBondContact O-CG2 3.31Å; P774-V778 PolarHBondContact O-N 2.86Å; L775-V778 WeakPolarHBondContact O-CB 3.43Å; L775-V778 PolarHBondContact O-N 2.88Å; L775-V778 VanDerWaalsContact O-N 3.09Å; V778-G780 VanDerWaalsContact C-N 3.3Å; V778-G780 PolarHBondContact O-N 3.04Å; V778-S781 WeakPolarHBondContact O-CB 3.38Å; V778-S781 PolarHBondContact O-N 3.45Å; V778-S781 VanDerWaalsContact O-N 3.15Å; V778-V782 WeakPolarHBondContact O-CG2 3.37Å; V778-V782 PolarHBondContact O-N 3.4Å
779	V	96.8	Very high	95.3	Very high	22 Å²	22	56.5 Å²	56.5	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-41.6	174.7	175.7	0	0	0	0	110.9	F731 T734 I735 V738 L775 G776 V782 C783	F731-V779 HydrophobicContact CD1-CG1 4.44Å; T734-V779 HydrophobicContact CG2-CG1 3.9Å; T734-V779 HydrophobicContact CG2-CG2 3.77Å; I735-V779 HydrophobicContact CB-CG1 4.37Å; I735-V779 HydrophobicContact CD1-CB 3.88Å; I735-V779 HydrophobicContact CD1-CG1 3.82Å; V738-V779 HydrophobicContact CG2-CG2 4.48Å; L775-V779 WeakPolarHBondContact O-CG2 3.24Å; L775-V779 PolarHBondContact O-N 2.79Å; G776-V779 PolarHBondContact O-N 2.77Å; V779-V782 PolarHBondContact O-N 2.77Å; V779-C783 WeakPolarHBondContact O-CB 3.37Å; V779-C783 PolarHBondContact O-N 3.24Å
780	G	96.2	Very high	95.3	Very high	12 Å²	12	55.4 Å²	55.4	12%	0.124	32%	0.323	C	S	.	.	H	α-helix	trans	-61.9	-40.5	173.4	0	0	0	0	0	114	G776 K777 V778 C783 A784	G776-G780 PolarHBondContact O-N 3.36Å; K777-G780 PolarHBondContact O-N 3.13Å; V778-G780 VanDerWaalsContact C-N 3.3Å; V778-G780 PolarHBondContact O-N 3.04Å; G780-C783 PolarHBondContact O-N 3.34Å; G780-A784 WeakPolarHBondContact O-CB 3.32Å; G780-A784 PolarHBondContact O-N 2.99Å
781	S	96	Very high	95.2	Very high	78 Å²	78	54.7 Å²	54.7	55%	0.545	32%	0.317	S	S	.	.	H	α-helix	trans	-63.9	-43.8	174.2	-60.6	0	0	0	0	112.1	K777 V778 A784 V785	K777-S781 PolarHBondContact O-N 2.97Å; K777-S781 PolarHBondContact O-OG 3.29Å; K777-S781 VanDerWaalsContact O-OG 3.1Å; V778-S781 WeakPolarHBondContact O-CB 3.38Å; V778-S781 PolarHBondContact O-N 3.45Å; V778-S781 VanDerWaalsContact O-N 3.15Å; S781-A784 PolarHBondContact O-N 3.32Å; S781-V785 WeakPolarHBondContact O-CG2 3.47Å; S781-V785 PolarHBondContact O-N 3.1Å; S781-V785 VanDerWaalsContact O-N 3.17Å
782	V	97.1	Very high	95.2	Very high	81 Å²	81	56.9 Å²	56.9	49%	0.491	34%	0.336	S	S	.	.	H	α-helix	trans	-66.4	-42.1	176.3	178.4	0	0	0	0	111	F731 V778 V779 A784 V785 A786	F731-V782 HydrophobicContact CE1-CB 4.48Å; F731-V782 HydrophobicContact CE1-CG1 3.95Å; F731-V782 HydrophobicContact CZ-CG1 4.22Å; V778-V782 WeakPolarHBondContact O-CG2 3.37Å; V778-V782 PolarHBondContact O-N 3.4Å; V779-V782 PolarHBondContact O-N 2.77Å; V782-A784 PolarHBondContact O-N 3.34Å; V782-V785 PolarHBondContact O-N 3.18Å; V782-A786 VanDerWaalsContact O-CB 3.29Å; V782-A786 WeakPolarHBondContact O-CB 3.38Å; V782-A786 PolarHBondContact O-N 3.15Å
783	C	97.4	Very high	95.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.3	-45.5	175.7	-179.3	0	0	0	0	112.2	F731 W756 T760 V779 G780 A786 G787	F731-C783 HydrophobicContact CB-CB 4.33Å; F731-C783 HydrophobicContact CD1-CB 3.77Å; F731-C783 HydrophobicContact CD2-CB 4.15Å; F731-C783 HydrophobicContact CE1-CB 4.1Å; F731-C783 HydrophobicContact CE2-CB 4.46Å; F731-C783 HydrophobicContact CG-CB 3.82Å; F731-C783 HydrophobicContact CZ-CB 4.44Å; W756-C783 HydrophobicContact CH2-CB 4.2Å; T760-C783 HydrophobicContact CG2-CB 4.22Å; V779-C783 WeakPolarHBondContact O-CB 3.37Å; V779-C783 PolarHBondContact O-N 3.24Å; G780-C783 PolarHBondContact O-N 3.34Å; C783-A786 PolarHBondContact O-N 2.81Å; C783-G787 PolarHBondContact O-N 2.8Å
784	A	96.9	Very high	95.2	Very high	36 Å²	36	57.2 Å²	57.2	30%	0.298	34%	0.341	S	S	.	.	H	α-helix	trans	-63.8	-44.6	177.7	0	0	0	0	0	112.4	T760 G780 S781 V782 G787 V788	T760-A784 HydrophobicContact CG2-CB 4.15Å; G780-A784 WeakPolarHBondContact O-CB 3.32Å; G780-A784 PolarHBondContact O-N 2.99Å; S781-A784 PolarHBondContact O-N 3.32Å; V782-A784 PolarHBondContact O-N 3.34Å; A784-G787 PolarHBondContact O-N 2.65Å; A784-V788 WeakPolarHBondContact O-CG2 3.12Å; A784-V788 PolarHBondContact O-N 2.97Å; A784-V788 VanDerWaalsContact O-N 3.16Å
785	V	96.7	Very high	95.2	Very high	94 Å²	94	57 Å²	57	57%	0.57	34%	0.339	S	S	*	.	H	α-helix	trans	-64.4	-46.4	176.8	172.8	0	0	0	0	111	S781 V782 G787 V788 L789	S781-V785 WeakPolarHBondContact O-CG2 3.47Å; S781-V785 PolarHBondContact O-N 3.1Å; S781-V785 VanDerWaalsContact O-N 3.17Å; V782-V785 PolarHBondContact O-N 3.18Å; V785-G787 VanDerWaalsContact C-N 3.34Å; V785-G787 PolarHBondContact O-N 3.34Å; V785-V788 PolarHBondContact O-N 2.99Å; V785-L789 HydrophobicContact CG1-CD1 4.04Å; V785-L789 WeakPolarHBondContact O-CG 3.42Å; V785-L789 PolarHBondContact O-N 3.19Å; V785-L789 VanDerWaalsContact O-N 3.1Å
786	A	96	Very high	95.1	Very high	22 Å²	22	55 Å²	55	18%	0.182	33%	0.333	C	S	.	.	H	α-helix	trans	-61.2	-41.7	177.5	0	0	0	0	0	112	F731 V782 C783 L789 T790	F731-A786 HydrophobicContact CE2-CB 3.61Å; F731-A786 HydrophobicContact CZ-CB 3.55Å; V782-A786 VanDerWaalsContact O-CB 3.29Å; V782-A786 WeakPolarHBondContact O-CB 3.38Å; V782-A786 PolarHBondContact O-N 3.15Å; C783-A786 PolarHBondContact O-N 2.81Å; A786-L789 PolarHBondContact O-N 3.31Å; A786-T790 PolarHBondContact O-N 3.08Å; A786-T790 PolarHBondContact O-OG1 2.99Å
787	G	95.7	Very high	95	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-47.7	176.4	0	0	0	0	0	113.5	M761 C783 A784 V785 L789 T790 L791	M761-G787 CarbonylContact O-C 3.48Å; C783-G787 PolarHBondContact O-N 2.8Å; A784-G787 PolarHBondContact O-N 2.65Å; V785-G787 VanDerWaalsContact C-N 3.34Å; V785-G787 PolarHBondContact O-N 3.34Å; G787-L789 VanDerWaalsContact C-N 3.34Å; G787-L789 PolarHBondContact O-N 3.24Å; G787-T790 PolarHBondContact O-N 2.85Å; G787-L791 WeakPolarHBondContact O-CB 3.45Å; G787-L791 WeakPolarHBondContact O-CG 3.46Å; G787-L791 PolarHBondContact O-N 3.44Å
788	V	95.5	Very high	94.9	Very high	81 Å²	81	54 Å²	54	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-60.5	-43	175.6	173.3	0	0	0	0	111.2	T763 A784 V785 L791 A792	T763-V788 HydrophobicContact CG2-CG2 3.59Å; A784-V788 WeakPolarHBondContact O-CG2 3.12Å; A784-V788 PolarHBondContact O-N 2.97Å; A784-V788 VanDerWaalsContact O-N 3.16Å; V785-V788 PolarHBondContact O-N 2.99Å; V788-L791 PolarHBondContact O-N 2.84Å; V788-A792 PolarHBondContact O-N 3.07Å; V788-A792 VanDerWaalsContact O-N 3.11Å
789	L	94.9	Very high	94.7	Very high	117 Å²	117	52.7 Å²	52.7	61%	0.613	33%	0.325	S	S	*	.	H	α-helix	trans	-64.6	-40.5	176.6	-68.2	171	0	0	0	112.4	V785 A786 G787 A792	V785-L789 HydrophobicContact CG1-CD1 4.04Å; V785-L789 WeakPolarHBondContact O-CG 3.42Å; V785-L789 PolarHBondContact O-N 3.19Å; V785-L789 VanDerWaalsContact O-N 3.1Å; A786-L789 PolarHBondContact O-N 3.31Å; G787-L789 VanDerWaalsContact C-N 3.34Å; G787-L789 PolarHBondContact O-N 3.24Å; L789-A792 PolarHBondContact O-N 3.49Å
790	T	92.6	Very high	94.5	Very high	14 Å²	14	56.3 Å²	56.3	9%	0.086	34%	0.34	C	S	.	.	H	α-helix	trans	-66.8	-39.2	176.7	-49.8	0	0	0	0	111.7	F720 A723 F724 A786 G787 A792 I793 P794	F720-T790 HydrophobicContact CD2-CG2 4.06Å; F720-T790 WeakPolarHBondContact CD2-O 3.37Å; F720-T790 HydrophobicContact CE2-CG2 3.94Å; A723-T790 HydrophobicContact CB-CG2 4.48Å; F724-T790 HydrophobicContact CB-CG2 4.46Å; F724-T790 HydrophobicContact CD2-CG2 4.14Å; A786-T790 PolarHBondContact O-N 3.08Å; A786-T790 PolarHBondContact O-OG1 2.99Å; G787-T790 PolarHBondContact O-N 2.85Å; T790-A792 VanDerWaalsContact C-N 3.3Å; T790-A792 PolarHBondContact O-N 3.03Å; T790-I793 PolarHBondContact O-N 2.74Å; T790-P794 WeakPolarHBondContact O-CD 3.39Å
791	L	93.3	Very high	94.2	Very high	52 Å²	52	56.7 Å²	56.7	27%	0.272	34%	0.339	S	S	.	.	H	α-helix	trans	-73	-18.8	179.1	-71.9	165.2	0	0	0	113.7	F720 F724 M761 G787 V788 I793 P794	F720-L791 HydrophobicContact CE2-CD2 3.91Å; F720-L791 HydrophobicContact CZ-CD2 3.69Å; F724-L791 HydrophobicContact CE2-CD2 4.43Å; M761-L791 WeakPolarHBondContact O-CD1 3.39Å; G787-L791 WeakPolarHBondContact O-CB 3.45Å; G787-L791 WeakPolarHBondContact O-CG 3.46Å; G787-L791 PolarHBondContact O-N 3.44Å; V788-L791 PolarHBondContact O-N 2.84Å; L791-I793 PolarHBondContact O-N 3.37Å; L791-P794 WeakPolarHBondContact O-CD 3.39Å
792	A	93.7	Very high	94	Very high	60 Å²	60	56.2 Å²	56.2	50%	0.496	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.5	172.7	0	0	0	0	0	113.5	V788 L789 T790 P796	V788-A792 PolarHBondContact O-N 3.07Å; V788-A792 VanDerWaalsContact O-N 3.11Å; L789-A792 PolarHBondContact O-N 3.49Å; T790-A792 VanDerWaalsContact C-N 3.3Å; T790-A792 PolarHBondContact O-N 3.03Å; A792-P796 WeakPolarHBondContact O-CD 3.27Å; A792-P796 WeakPolarHBondContact O-CG 3.28Å
793	I	92	Very high	93.6	Very high	95 Å²	95	56.7 Å²	56.7	49%	0.487	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-53	-175.9	-58.8	171.2	0	0	0	113.6	T790 L791 V795	T790-I793 PolarHBondContact O-N 2.74Å; L791-I793 PolarHBondContact O-N 3.37Å; I793-V795 PolarHBondContact O-N 2.9Å
794	P	92.9	Very high	93	Very high	9 Å²	9	60.4 Å²	60.4	6%	0.058	34%	0.343	C	S	.	.	H	α-helix	trans	-73.9	-26.5	-174.9	29.2	-38.2	0	0	0	113.8	F720 T790 L791 I797 I798	F720-P794 HydrophobicContact CB-CB 4.07Å; F720-P794 HydrophobicContact CB-CG 4.26Å; F720-P794 HydrophobicContact CD1-CB 4.2Å; F720-P794 HydrophobicContact CD1-CG 4.01Å; F720-P794 HydrophobicContact CD2-CB 4.29Å; F720-P794 VanDerWaalsContact CD2-CD 3.45Å; F720-P794 HydrophobicContact CD2-CG 3.54Å; F720-P794 HydrophobicContact CE1-CG 4.27Å; F720-P794 HydrophobicContact CE2-CG 3.82Å; F720-P794 HydrophobicContact CG-CB 3.9Å; F720-P794 HydrophobicContact CG-CG 3.63Å; F720-P794 HydrophobicContact CZ-CG 4.19Å; T790-P794 WeakPolarHBondContact O-CD 3.39Å; L791-P794 WeakPolarHBondContact O-CD 3.39Å; P794-I797 PolarHBondContact O-N 2.94Å; P794-I798 HydrophobicContact CB-CD1 4.38Å; P794-I798 WeakPolarHBondContact O-CG1 3.35Å; P794-I798 PolarHBondContact O-N 3.24Å
795	V	92.7	Very high	92.5	Very high	89 Å²	89	59.4 Å²	59.4	54%	0.539	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-46.4	-171.9	175.1	0	0	0	0	112.8	I793 I797 T799	I793-V795 PolarHBondContact O-N 2.9Å; V795-I797 PolarHBondContact O-N 2.82Å; V795-T799 VanDerWaalsContact O-CB 3.26Å; V795-T799 WeakPolarHBondContact O-CB 3.31Å; V795-T799 PolarHBondContact O-N 2.94Å; V795-T799 PolarHBondContact O-OG1 3.07Å
796	P	94	Very high	92	Very high	79 Å²	79	59.3 Å²	59.3	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-59.4	-44	172.7	-26.1	35.6	0	0	0	113.3	A792 I798 T799 E800	A792-P796 WeakPolarHBondContact O-CD 3.27Å; A792-P796 WeakPolarHBondContact O-CG 3.28Å; P796-I798 PolarHBondContact O-N 3.36Å; P796-T799 PolarHBondContact O-N 3.26Å; P796-T799 VanDerWaalsContact O-N 3.13Å; P796-E800 PolarHBondContact O-N 3.28Å
797	I	93	Very high	91.3	Very high	60 Å²	60	59.9 Å²	59.9	31%	0.308	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-47.7	-178	-57.6	172.4	0	0	0	110.7	P794 V795 T799 N801	P794-I797 PolarHBondContact O-N 2.94Å; V795-I797 PolarHBondContact O-N 2.82Å; I797-T799 VanDerWaalsContact C-N 3.33Å; I797-T799 PolarHBondContact O-N 3.39Å; I797-N801 PolarHBondContact O-N 3.34Å
798	I	93.6	Very high	90.4	Very high	41 Å²	41	62 Å²	62	21%	0.21	34%	0.337	C	S	.	.	H	α-helix	trans	-65.3	-38.8	176.6	-66	168.1	0	0	0	110.5	T709 F710 L717 P794 P796 F802	T709-I798 HydrophobicContact CG2-CG2 4Å; T709-I798 WeakPolarHBondContact CG2-O 3.21Å; F710-I798 HydrophobicContact CE1-CD1 4.35Å; L717-I798 HydrophobicContact CD1-CD1 4.49Å; P794-I798 HydrophobicContact CB-CD1 4.38Å; P794-I798 WeakPolarHBondContact O-CG1 3.35Å; P794-I798 PolarHBondContact O-N 3.24Å; P796-I798 PolarHBondContact O-N 3.36Å; I798-F802 VanDerWaalsContact O-CB 3.22Å; I798-F802 WeakPolarHBondContact O-CB 3.44Å; I798-F802 PolarHBondContact O-N 2.98Å
799	T	93	Very high	89.5	Confident	65 Å²	65	62.6 Å²	62.6	40%	0.399	33%	0.333	S	S	.	.	H	α-helix	trans	-68.4	-40.6	-178.3	-58.9	0	0	0	0	112.3	V795 P796 I797 F802 N803	V795-T799 VanDerWaalsContact O-CB 3.26Å; V795-T799 WeakPolarHBondContact O-CB 3.31Å; V795-T799 PolarHBondContact O-N 2.94Å; V795-T799 PolarHBondContact O-OG1 3.07Å; P796-T799 PolarHBondContact O-N 3.26Å; P796-T799 VanDerWaalsContact O-N 3.13Å; I797-T799 VanDerWaalsContact C-N 3.33Å; I797-T799 PolarHBondContact O-N 3.39Å; T799-F802 PolarHBondContact O-N 2.72Å; T799-N803 WeakPolarHBondContact O-CB 3.29Å; T799-N803 VanDerWaalsContact O-CG 3.23Å; T799-N803 PolarHBondContact O-N 3.45Å; T799-N803 PolarHBondContact O-ND2 3.39Å
800	E	91.2	Very high	88.6	Confident	98 Å²	98	59.7 Å²	59.7	46%	0.458	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-52.5	175.9	-176	177.6	-152.5	0	0	111	Y164 P796 F802 N803 K804	Y164-E800 WeakPolarHBondContact CE2-OE1 3.29Å; Y164-E800 WeakPolarHBondContact CE2-OE2 3.4Å; Y164-E800 PolarHBondContact OH-OE2 2.8Å; P796-E800 PolarHBondContact O-N 3.28Å; E800-F802 VanDerWaalsContact C-N 3.27Å; E800-F802 PolarHBondContact O-N 3.08Å; E800-N803 PolarHBondContact O-N 3.1Å; E800-K804 WeakPolarHBondContact O-CB 3.39Å; E800-K804 PolarHBondContact O-N 3.46Å
801	N	90.1	Very high	87.4	Confident	19 Å²	19	60 Å²	60	10%	0.102	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-37.2	176.9	-81.6	-35.4	0	0	0	111.9	T709 S713 I797 F805	T709-N801 HydrophobicContact CG2-CB 3.94Å; S713-N801 PolarHBondContact OG-ND2 2.87Å; I797-N801 PolarHBondContact O-N 3.34Å; N801-F805 WeakPolarHBondContact O-CD2 3.5Å; N801-F805 PolarHBondContact O-N 2.84Å
802	F	91.2	Very high	85.6	Confident	69 Å²	69	65.3 Å²	65.3	30%	0.303	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-51.3	173.3	-176.1	-98	0	0	0	111.8	V705 T709 I798 T799 E800 K804 F805 Y806	V705-F802 HydrophobicContact CG1-CD2 3.85Å; V705-F802 HydrophobicContact CG1-CE2 3.78Å; T709-F802 HydrophobicContact CG2-CB 4Å; T709-F802 WeakPolarHBondContact OG1-CA 3.4Å; I798-F802 VanDerWaalsContact O-CB 3.22Å; I798-F802 WeakPolarHBondContact O-CB 3.44Å; I798-F802 PolarHBondContact O-N 2.98Å; T799-F802 PolarHBondContact O-N 2.72Å; E800-F802 VanDerWaalsContact C-N 3.27Å; E800-F802 PolarHBondContact O-N 3.08Å; F802-K804 VanDerWaalsContact C-N 3.32Å; F802-K804 PolarHBondContact O-N 3.46Å; F802-F805 PolarHBondContact O-N 3.48Å; F802-Y806 HydrophobicContact CE1-CD2 4.43Å; F802-Y806 HydrophobicContact CE1-CG 4.14Å; F802-Y806 HydrophobicContact CZ-CD2 4.14Å; F802-Y806 HydrophobicContact CZ-CG 4.28Å; F802-Y806 WeakPolarHBondContact O-CB 3.38Å; F802-Y806 PolarHBondContact O-N 3Å
803	N	89.8	Confident	83.4	Confident	91 Å²	91	64.2 Å²	64.2	49%	0.487	34%	0.337	S	S	.	.	H	α-helix	trans	-59.5	-43	-179.1	-75.9	-26.8	0	0	0	111.8	T799 E800 Y806 A807	T799-N803 WeakPolarHBondContact O-CB 3.29Å; T799-N803 VanDerWaalsContact O-CG 3.23Å; T799-N803 PolarHBondContact O-N 3.45Å; T799-N803 PolarHBondContact O-ND2 3.39Å; E800-N803 PolarHBondContact O-N 3.1Å; N803-Y806 PolarHBondContact O-N 3.33Å; N803-A807 WeakPolarHBondContact O-CB 3.19Å; N803-A807 PolarHBondContact O-N 3.14Å
804	K	84.8	Confident	81.2	Confident	77 Å²	77	66 Å²	66	34%	0.335	34%	0.338	S	S	.	.	H	α-helix	trans	-54.9	-59.3	175.6	-177.5	178.2	-176.3	174.3	0	112.3	N541 E542 E800 F802 Y806 A807 H808	N541-K804 WeakPolarHBondContact O-CE 3.27Å; N541-K804 PolarHBondContact O-NZ 3.33Å; E542-K804 WeakPolarHBondContact O-CE 3.49Å; E542-K804 WeakPolarHBondContact O-CG 3.31Å; E800-K804 WeakPolarHBondContact O-CB 3.39Å; E800-K804 PolarHBondContact O-N 3.46Å; F802-K804 VanDerWaalsContact C-N 3.32Å; F802-K804 PolarHBondContact O-N 3.46Å; K804-Y806 PolarHBondContact O-N 3.33Å; K804-A807 PolarHBondContact O-N 3.2Å; K804-H808 PolarHBondContact O-N 3.44Å
805	F	85.8	Confident	78.3	Confident	15 Å²	15	77.7 Å²	77.7	7%	0.066	38%	0.381	C	S	.	.	H	α-helix	trans	-69.8	-31.4	-178.5	-66.2	-58.3	0	0	0	113.1	V705 L708 E712 N801 F802 K809	V705-F805 HydrophobicContact CG1-CB 3.99Å; L708-F805 HydrophobicContact CD2-CB 4.12Å; L708-F805 HydrophobicContact CD2-CD1 3.39Å; L708-F805 HydrophobicContact CD2-CD2 4.06Å; L708-F805 HydrophobicContact CD2-CE1 3.75Å; L708-F805 HydrophobicContact CD2-CE2 4.4Å; L708-F805 HydrophobicContact CD2-CG 3.58Å; L708-F805 HydrophobicContact CD2-CZ 4.27Å; L708-F805 HydrophobicContact CG-CD1 4.09Å; L708-F805 HydrophobicContact CG-CD2 3.94Å; L708-F805 HydrophobicContact CG-CE1 4.13Å; L708-F805 HydrophobicContact CG-CE2 4.04Å; L708-F805 HydrophobicContact CG-CG 4.01Å; L708-F805 HydrophobicContact CG-CZ 4.14Å; E712-F805 HydrophobicContact CB-CE2 4.1Å; E712-F805 HydrophobicContact CB-CZ 4.4Å; E712-F805 HydrophobicContact CG-CE2 3.84Å; E712-F805 HydrophobicContact CG-CZ 3.79Å; N801-F805 WeakPolarHBondContact O-CD2 3.5Å; N801-F805 PolarHBondContact O-N 2.84Å; F802-F805 PolarHBondContact O-N 3.48Å; F805-K809 VanDerWaalsContact O-CB 3.31Å; F805-K809 WeakPolarHBondContact O-CB 3.41Å; F805-K809 PolarHBondContact O-N 3.08Å
806	Y	86.2	Confident	77.6	Confident	93 Å²	93	77.1 Å²	77.1	37%	0.365	37%	0.373	S	S	.	.	H	α-helix	trans	-71.7	-38	176.1	-172.9	-108.6	0	0	0	112.8	F802 N803 K804 K809 T810	F802-Y806 HydrophobicContact CE1-CD2 4.43Å; F802-Y806 HydrophobicContact CE1-CG 4.14Å; F802-Y806 HydrophobicContact CZ-CD2 4.14Å; F802-Y806 HydrophobicContact CZ-CG 4.28Å; F802-Y806 WeakPolarHBondContact O-CB 3.38Å; F802-Y806 PolarHBondContact O-N 3Å; N803-Y806 PolarHBondContact O-N 3.33Å; K804-Y806 PolarHBondContact O-N 3.33Å; Y806-K809 PolarHBondContact O-N 2.85Å; Y806-T810 HydrophobicContact CD1-CG2 4.37Å; Y806-T810 HydrophobicContact CD2-CG2 3.95Å; Y806-T810 HydrophobicContact CE1-CG2 4.05Å; Y806-T810 HydrophobicContact CE2-CG2 3.57Å; Y806-T810 HydrophobicContact CG-CG2 4.33Å; Y806-T810 WeakPolarHBondContact O-CB 3.34Å; Y806-T810 WeakPolarHBondContact O-CG2 3.29Å; Y806-T810 PolarHBondContact O-N 3.1Å; Y806-T810 PolarHBondContact O-OG1 3.03Å
807	A	82.3	Confident	76.7	Confident	34 Å²	34	77 Å²	77	28%	0.281	37%	0.365	S	S	.	.	H	α-helix	trans	-64.4	-45.4	177	0	0	0	0	0	111.6	N803 K804 G811 R812 G813	N803-A807 WeakPolarHBondContact O-CB 3.19Å; N803-A807 PolarHBondContact O-N 3.14Å; K804-A807 PolarHBondContact O-N 3.2Å; A807-G811 PolarHBondContact O-N 3.02Å; A807-R812 PolarHBondContact O-N 3.26Å; A807-G813 PolarHBondContact O-N 3.35Å
808	H	76.6	Confident	75.8	Confident	44 Å²	44	77.9 Å²	77.9	20%	0.204	37%	0.368	C	S	.	.	H	α-helix	trans	-63.4	-49.4	174.5	177.4	-116.4	0	0	0	111.5	G543 Y544 K804 T810 G811 R814	G543-H808 PolarHBondContact O-ND1 3.43Å; Y544-H808 AromaticContact CD1-CD2 3.99Å; Y544-H808 AromaticContact CD1-CE1 3.76Å; Y544-H808 AromaticContact CD1-NE2 3.28Å; Y544-H808 VanDerWaalsContact CD1-NE2 3.28Å; Y544-H808 WeakPolarHBondContact CD1-NE2 3.48Å; Y544-H808 AromaticContact CE1-CD2 3.8Å; Y544-H808 AromaticContact CE1-NE2 3.3Å; Y544-H808 VanDerWaalsContact CE1-NE2 3.3Å; Y544-H808 WeakPolarHBondContact CE1-NE2 3.4Å; Y544-H808 AromaticContact CG-NE2 3.81Å; Y544-H808 AromaticContact CZ-CD2 3.82Å; Y544-H808 AromaticContact CZ-NE2 3.84Å; K804-H808 PolarHBondContact O-N 3.44Å; H808-T810 PolarHBondContact O-N 2.84Å; H808-G811 PolarHBondContact O-N 3.44Å; H808-G811 VanDerWaalsContact O-N 3.09Å; H808-R814 PolarHBondContact NE2-NH2 3.16Å
809	K	75.9	Confident	74.8	Confident	93 Å²	93	80.1 Å²	80.1	40%	0.404	38%	0.378	S	S	.	.	H	α-helix	trans	-69.5	-29.6	-176	-161.4	173.6	-165.2	170.4	0	114.4	S701 V705 F805 Y806 G811	S701-K809 PolarHBondContact O-NZ 3.09Å; V705-K809 HydrophobicContact CG2-CB 4.21Å; V705-K809 HydrophobicContact CG2-CD 3.46Å; V705-K809 VanDerWaalsContact CG2-CD 3.46Å; V705-K809 HydrophobicContact CG2-CG 4.46Å; F805-K809 VanDerWaalsContact O-CB 3.31Å; F805-K809 WeakPolarHBondContact O-CB 3.41Å; F805-K809 PolarHBondContact O-N 3.08Å; Y806-K809 PolarHBondContact O-N 2.85Å; K809-G811 VanDerWaalsContact C-N 3.32Å
810	T	76.1	Confident	73.7	Confident	57 Å²	57	81.1 Å²	81.1	35%	0.35	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.1	173	60.2	0	0	0	0	113.7	Y806 H808 R812	Y806-T810 HydrophobicContact CD1-CG2 4.37Å; Y806-T810 HydrophobicContact CD2-CG2 3.95Å; Y806-T810 HydrophobicContact CE1-CG2 4.05Å; Y806-T810 HydrophobicContact CE2-CG2 3.57Å; Y806-T810 HydrophobicContact CG-CG2 4.33Å; Y806-T810 WeakPolarHBondContact O-CB 3.34Å; Y806-T810 WeakPolarHBondContact O-CG2 3.29Å; Y806-T810 PolarHBondContact O-N 3.1Å; Y806-T810 PolarHBondContact O-OG1 3.03Å; H808-T810 PolarHBondContact O-N 2.84Å; T810-R812 PolarHBondContact O-N 3.44Å; T810-R812 PolarHBondContact OG1-NH1 3.45Å
811	G	67.2	Low	72.5	Confident	21 Å²	21	79.9 Å²	79.9	22%	0.216	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	15.5	-176.3	0	0	0	0	0	114	A807 H808 K809 G813 R814	A807-G811 PolarHBondContact O-N 3.02Å; H808-G811 PolarHBondContact O-N 3.44Å; H808-G811 VanDerWaalsContact O-N 3.09Å; K809-G811 VanDerWaalsContact C-N 3.32Å; G811-G813 VanDerWaalsContact C-N 3.27Å; G811-G813 PolarHBondContact O-N 3.09Å; G811-R814 PolarHBondContact O-N 3.18Å; G811-R814 VanDerWaalsContact O-N 3.11Å
812	R	55.3	Low	71.2	Confident	162 Å²	162	84.3 Å²	84.3	61%	0.611	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-24.9	179.4	-85.4	-173.8	170	84.3	-2.3	113.1	A807 T810 R814	A807-R812 PolarHBondContact O-N 3.26Å; T810-R812 PolarHBondContact O-N 3.44Å; T810-R812 PolarHBondContact OG1-NH1 3.45Å; R812-R814 PolarHBondContact O-N 3.1Å
813	G	48.6	Very low	69.7	Low	37 Å²	37	85.5 Å²	85.5	38%	0.381	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	10.6	169.8	0	0	0	0	0	114.9	A807 G811	A807-G813 PolarHBondContact O-N 3.35Å; G811-G813 VanDerWaalsContact C-N 3.27Å; G811-G813 PolarHBondContact O-N 3.09Å
814	R	45.5	Very low	68	Low	134 Å²	134	85 Å²	85	51%	0.506	39%	0.389	S	S	.	.			trans	-119.1	37.3	177.3	-56.1	-177.8	-175	135.1	6.1	111.4	H808 G811 R812	H808-R814 PolarHBondContact NE2-NH2 3.16Å; G811-R814 PolarHBondContact O-N 3.18Å; G811-R814 VanDerWaalsContact O-N 3.11Å; R812-R814 PolarHBondContact O-N 3.1Å
815	R	31.9	Very low	66.5	Low	253 Å²	253	85.7 Å²	85.7	96%	0.955	39%	0.394	S	S	*	.			trans	-150.7	0	177.7	-76.3	-167.2	179.3	-168.3	0.9	109.5

Retrieved 815 of 815 residues in 151.7 ms (Link to these results)

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