A0A077YXH1_TRITR Loading...

Conserved oligomeric Golgi complex subunit 1

AlphaFold DB , UniProt , Accession A0A077YXH1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 814 aa.

						>A0A077YXH1_TRITR|A0A077YXH1
MQADESENEASLPAEVDVHCKVSFSDDLFVKHSVEHVREVEKEIRHNTELKREELRLMVGRRYRDIIEAADDLHTMHNIAEDALGQLQALRSGISRLQQYPVIPKVSLPLGAQLRSNVLATFLADLCDMFSALSVQADWATLGWLFSLAVYVDSALIEFHGETPNMVRTIWRDVYASRCKLTEKCEQAFSPRLDADEVCQMLCCLMLMEKRPLDQLPSMFYSWCFKIFKGALLSTDLSFTEQIGECVTTWFRTIMLAHEIFYTDLNRVSLLVSTLNSFHTCKPAEIDQYIAVQRRAHRQCLEELLASFRPVDSVSPSDALIVDALHRETAAFLTKSLDAYTEDVGKTLQSLNDLKSLVERRESIQNALACVATNPKWTKACEELFGSDKERVMSIFYMPISQRAEQVVKAIVQRVFEAASDFDSIPNDLDCLQATWAASNDQSELHIAQRLLSMPSEVLEKCQFVDGEYKTMLDALDAFCTAYESSSQLLQEPLVTATVAAVQQFAERCQHVGSQRGNVTAAVHCAKFCQGLLTCCDHFKSAFFVRSKHTSAWHKITTVLNQLSEHKYSEWILAVAADVGSEVKENLHTQCDVRTQMENLLRYESVTIEDDQGVKNSSSKMLIPCSLSRWAFRLLHRMSRIGAAVGIHSVPRHLVKQLTHTAISSVVEAMDVLLESEDKPSQLLVVQLLFDLQVLTTLLLDDQSTKMKKRCRQTISTLKGRVDAFDLELMTPRLKANVKQQTLRLVTLFDAIVADGKYVTRQLNGTKYQPDDQSQMLMLNSQGCRFAKLPICDDWKMTIVAGNKEGETNSPDFH
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.1	Very low	39.5	Very low	241 Å²	241	157.5 Å²	157.5	100%	1.187	87%	0.868	S	S	*	*				0	102.1	0	-80.1	169.8	69.4	0	0	106.9
2	Q	39.8	Very low	39.5	Very low	199 Å²	199	158.5 Å²	158.5	93%	0.93	87%	0.87	S	S	*	*			trans	-70.2	121	161.8	-75.9	165.5	-43.8	0	0	105.7
3	A	42	Very low	39.5	Very low	95 Å²	95	155.9 Å²	155.9	79%	0.785	87%	0.865	S	S	*	*			trans	-104.7	120.3	173	0	0	0	0	0	106.9	E5	A3-E5 PolarHBondContact O-N 2.98Å
4	D	39.3	Very low	39.7	Very low	155 Å²	155	151.4 Å²	151.4	83%	0.829	86%	0.858	S	S	*	*			trans	-61.7	120.3	176.5	-70.2	-51.7	0	0	0	111.1	S6	D4-S6 PolarHBondContact O-N 3.3Å
5	E	41.9	Very low	39.8	Very low	200 Å²	200	154.3 Å²	154.3	94%	0.935	86%	0.862	S	S	*	*			trans	-91.1	90.2	158.8	-75.8	-177.2	165.3	0	0	107.6	A3	A3-E5 PolarHBondContact O-N 2.98Å
6	S	39	Very low	40.1	Very low	98 Å²	98	153.2 Å²	153.2	69%	0.685	86%	0.86	S	S	*	*			trans	-85.4	109.9	171.3	57.5	0	0	0	0	110	D4 N8	D4-S6 PolarHBondContact O-N 3.3Å; S6-N8 PolarHBondContact O-N 2.99Å
7	E	40.5	Very low	40.2	Very low	186 Å²	186	152 Å²	152	87%	0.869	85%	0.851	S	S	*	*			trans	-60.7	117.3	164.7	-68.2	176	150.2	0	0	109.6
8	N	37	Very low	40.8	Very low	158 Å²	158	150.5 Å²	150.5	85%	0.845	85%	0.846	S	S	*	*			trans	-105.9	89.4	175.5	-125.6	-8.2	0	0	0	107.9	S6 A10	S6-N8 PolarHBondContact O-N 2.99Å; N8-A10 PolarHBondContact O-N 2.63Å; N8-A10 VanDerWaalsContact O-N 3.11Å
9	E	35.8	Very low	41.2	Very low	189 Å²	189	150.9 Å²	150.9	88%	0.883	84%	0.84	S	S	*	*			trans	-67.5	97.2	169.5	-72.5	-176.3	146.1	0	0	109.8	S11	E9-S11 PolarHBondContact O-N 3.24Å
10	A	39.7	Very low	41.6	Very low	97 Å²	97	148.5 Å²	148.5	80%	0.802	83%	0.833	S	S	*	*			trans	-86.1	108.8	170.2	0	0	0	0	0	110.4	N8	N8-A10 PolarHBondContact O-N 2.63Å; N8-A10 VanDerWaalsContact O-N 3.11Å
11	S	38.7	Very low	41.9	Very low	114 Å²	114	149.7 Å²	149.7	80%	0.797	83%	0.829	S	S	*	*			trans	-32	130.3	171.2	53.2	0	0	0	0	117.5	E9	E9-S11 PolarHBondContact O-N 3.24Å
12	L	39.7	Very low	42.4	Very low	170 Å²	170	142.7 Å²	142.7	89%	0.89	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.8	139.9	168.1	-79.7	146	0	0	0	112.1
13	P	39.3	Very low	43.1	Very low	125 Å²	125	136.7 Å²	136.7	81%	0.812	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-78.9	144.1	179.8	-4.4	21.8	0	0	0	113.1
14	A	42	Very low	43.8	Very low	93 Å²	93	139.5 Å²	139.5	77%	0.769	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-58.4	144.4	-173.6	0	0	0	0	0	116	V16	A14-V16 PolarHBondContact O-N 3.43Å
15	E	41.2	Very low	44.7	Very low	194 Å²	194	135 Å²	135	91%	0.907	76%	0.755	S	S	*	*			trans	-54.4	113.5	175.7	-63.9	172.2	150.5	0	0	111.9	D17	E15-D17 PolarHBondContact O-N 2.74Å
16	V	44.5	Very low	45.6	Very low	137 Å²	137	130.6 Å²	130.6	83%	0.83	74%	0.738	S	S	*	*			trans	-84.4	111.5	171.9	177.8	0	0	0	0	109	A14 V18	A14-V16 PolarHBondContact O-N 3.43Å; V16-V18 PolarHBondContact O-N 3.24Å
17	D	41.8	Very low	46.7	Very low	133 Å²	133	129.9 Å²	129.9	71%	0.711	73%	0.726	S	S	*	*			trans	-29.7	114.3	176.5	-93.2	-48.2	0	0	0	116	E15 H19	E15-D17 PolarHBondContact O-N 2.74Å; D17-H19 PolarHBondContact O-N 3.16Å
18	V	51.3	Low	47.7	Very low	125 Å²	125	122.8 Å²	122.8	76%	0.758	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-70.3	-14.1	174.3	179.5	0	0	0	0	112	V16 C20	V16-V18 PolarHBondContact O-N 3.24Å; V18-C20 VanDerWaalsContact C-N 3.33Å; V18-C20 PolarHBondContact O-N 2.97Å
19	H	49.1	Very low	48.9	Very low	158 Å²	158	121.6 Å²	121.6	73%	0.731	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-69.6	-20.1	-171.7	-101.8	-65.2	0	0	0	115.5	D17 K21	D17-H19 PolarHBondContact O-N 3.16Å; H19-K21 VanDerWaalsContact C-N 3.29Å; H19-K21 PolarHBondContact O-N 2.8Å
20	C	48.5	Very low	50.4	Low	103 Å²	103	118.6 Å²	118.6	70%	0.696	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-76.9	-12.4	-176.8	-151.8	0	0	0	0	113.8	V18 S23	V18-C20 VanDerWaalsContact C-N 3.33Å; V18-C20 PolarHBondContact O-N 2.97Å; C20-S23 PolarHBondContact O-OG 3.08Å
21	K	47.8	Very low	51.5	Low	173 Å²	173	120.9 Å²	120.9	75%	0.752	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-79.5	-22.9	-178.4	-80.1	-177.7	177.8	173.9	0	114.5	H19 S23 F24	H19-K21 VanDerWaalsContact C-N 3.29Å; H19-K21 PolarHBondContact O-N 2.8Å; K21-S23 PolarHBondContact O-N 3.01Å; K21-F24 PolarHBondContact O-N 2.99Å
22	V	52.1	Low	52.9	Low	94 Å²	94	119.4 Å²	119.4	57%	0.57	65%	0.648	S	S	*	*	H	α-helix	trans	-68	-37.9	-174.9	-174.4	0	0	0	0	111.1	F24 S25	V22-F24 VanDerWaalsContact C-N 3.29Å; V22-F24 PolarHBondContact O-N 3.41Å; V22-S25 PolarHBondContact O-N 3.47Å
23	S	53.4	Low	54.5	Low	73 Å²	73	114.8 Å²	114.8	51%	0.51	63%	0.63	S	S	.	*	H	α-helix	trans	-67.5	-27.2	-179.1	59.2	0	0	0	0	113.8	C20 K21 S25 D27	C20-S23 PolarHBondContact O-OG 3.08Å; K21-S23 PolarHBondContact O-N 3.01Å; S23-S25 VanDerWaalsContact C-N 3.27Å; S23-S25 PolarHBondContact O-N 3.03Å; S23-D27 PolarHBondContact O-N 3.23Å
24	F	57.8	Low	56.1	Low	155 Å²	155	113.9 Å²	113.9	68%	0.68	62%	0.622	S	S	*	*	H	α-helix	trans	-68.5	-29.5	179.4	-156.3	-88.7	0	0	0	112.2	K21 V22 L28	K21-F24 PolarHBondContact O-N 2.99Å; V22-F24 VanDerWaalsContact C-N 3.29Å; V22-F24 PolarHBondContact O-N 3.41Å; F24-L28 HydrophobicContact CE1-CD1 4.41Å; F24-L28 PolarHBondContact O-N 3.01Å
25	S	57.7	Low	57.6	Low	61 Å²	61	116.7 Å²	116.7	43%	0.427	62%	0.619	S	S	.	*	H	α-helix	trans	-70	-47.3	179.2	-170.2	0	0	0	0	111.1	V22 S23 D27 L28 F29	V22-S25 PolarHBondContact O-N 3.47Å; S23-S25 VanDerWaalsContact C-N 3.27Å; S23-S25 PolarHBondContact O-N 3.03Å; S25-D27 PolarHBondContact O-N 2.76Å; S25-L28 PolarHBondContact O-N 2.79Å; S25-F29 WeakPolarHBondContact O-CD2 3.43Å
26	D	60.1	Low	59.4	Low	107 Å²	107	111.4 Å²	111.4	57%	0.572	60%	0.595	S	S	*	*	H	α-helix	trans	-66.1	-40.2	-177.1	-70.2	-12.8	0	0	0	111.8	L28 F29 V30	D26-L28 VanDerWaalsContact C-N 3.29Å; D26-L28 PolarHBondContact O-N 2.77Å; D26-F29 PolarHBondContact O-N 3.09Å; D26-V30 WeakPolarHBondContact O-CG2 3.45Å; D26-V30 PolarHBondContact O-N 3.38Å
27	D	62.3	Low	60.9	Low	83 Å²	83	105.8 Å²	105.8	44%	0.444	56%	0.561	S	S	.	*	H	α-helix	trans	-63.6	-32.2	177.7	-103	31	0	0	0	113.2	S23 S25 K31	S23-D27 PolarHBondContact O-N 3.23Å; S25-D27 PolarHBondContact O-N 2.76Å; D27-K31 PolarHBondContact O-N 3.42Å; D27-K31 IonicContact OD2-NZ 2.71Å; D27-K31 PolarHBondContact OD2-NZ 2.85Å
28	L	61.7	Low	62.8	Low	36 Å²	36	107 Å²	107	19%	0.188	56%	0.555	C	S	.	*	H	α-helix	trans	-69.1	-41.9	-178.8	-159.7	83.5	0	0	0	111.4	F24 S25 D26 V30 H32 V37 V40	F24-L28 HydrophobicContact CE1-CD1 4.41Å; F24-L28 PolarHBondContact O-N 3.01Å; S25-L28 PolarHBondContact O-N 2.79Å; D26-L28 VanDerWaalsContact C-N 3.29Å; D26-L28 PolarHBondContact O-N 2.77Å; L28-V30 VanDerWaalsContact C-N 3.35Å; L28-V30 PolarHBondContact O-N 2.83Å; L28-H32 WeakPolarHBondContact O-CB 3.41Å; L28-H32 PolarHBondContact O-N 3.46Å; L28-V37 HydrophobicContact CD2-CG1 4.27Å; L28-V37 HydrophobicContact CD2-CG2 4.36Å; L28-V37 HydrophobicContact CG-CG2 4.43Å; L28-V40 HydrophobicContact CD2-CG1 4.21Å
29	F	62.7	Low	64.3	Low	133 Å²	133	106.8 Å²	106.8	58%	0.583	55%	0.546	S	S	*	.	H	α-helix	trans	-70.8	-27.9	-179.8	-74.1	-75.2	0	0	0	113.2	S25 D26 V37	S25-F29 WeakPolarHBondContact O-CD2 3.43Å; D26-F29 PolarHBondContact O-N 3.09Å; F29-V37 HydrophobicContact CD1-CG1 4.26Å; F29-V37 HydrophobicContact CD1-CG2 4.43Å; F29-V37 HydrophobicContact CE1-CG1 3.75Å; F29-V37 HydrophobicContact CZ-CG1 4.16Å
30	V	66.5	Low	65.8	Low	126 Å²	126	101.4 Å²	101.4	76%	0.764	52%	0.524	S	S	*	.	H	α-helix	trans	-81.1	-36.6	179.8	177	0	0	0	0	111.9	D26 L28	D26-V30 WeakPolarHBondContact O-CG2 3.45Å; D26-V30 PolarHBondContact O-N 3.38Å; L28-V30 VanDerWaalsContact C-N 3.35Å; L28-V30 PolarHBondContact O-N 2.83Å
31	K	63.6	Low	67.6	Low	146 Å²	146	100.2 Å²	100.2	64%	0.635	51%	0.508	S	S	*	.	H	α-helix	trans	-89.4	-25.5	-173.7	-70.9	171.3	-179.9	157.2	0	114.1	D27	D27-K31 PolarHBondContact O-N 3.42Å; D27-K31 IonicContact OD2-NZ 2.71Å; D27-K31 PolarHBondContact OD2-NZ 2.85Å
32	H	67.5	Low	69.4	Low	82 Å²	82	99.3 Å²	99.3	38%	0.38	50%	0.504	S	S	.	.	S	Bend	trans	-116.7	146.7	-171.5	-66.3	-74.2	0	0	0	112.6	L28 H36 V37	L28-H32 WeakPolarHBondContact O-CB 3.41Å; L28-H32 PolarHBondContact O-N 3.46Å; H32-H36 HydrophobicContact CB-CB 4.22Å; H32-H36 AromaticContact CG-CD2 3.94Å; H32-H36 AromaticContact ND1-CD2 3.38Å; H32-H36 PolarHBondContact ND1-CD2 2.85Å; H32-V37 HydrophobicContact CB-CG2 4.13Å
33	S	73.7	Confident	71.2	Confident	74 Å²	74	100.9 Å²	100.9	52%	0.517	51%	0.505	S	S	.	.			trans	-65.1	155.5	173.7	69.3	0	0	0	0	111	E35 H36 V37	S33-E35 PolarHBondContact O-N 3.46Å; S33-E35 VanDerWaalsContact O-N 3.13Å; S33-H36 PolarHBondContact O-N 3.06Å; S33-V37 PolarHBondContact O-N 2.74Å; S33-V37 VanDerWaalsContact O-N 3.09Å
34	V	73.1	Confident	72.8	Confident	106 Å²	106	102.1 Å²	102.1	64%	0.642	51%	0.505	S	S	*	.	H	α-helix	trans	-55.9	-31.7	179.6	-179	0	0	0	0	112.2	R38	V34-R38 WeakPolarHBondContact O-CG 3.39Å; V34-R38 PolarHBondContact O-N 2.78Å
35	E	74.4	Confident	74.3	Confident	152 Å²	152	102 Å²	102	71%	0.71	50%	0.5	S	S	*	.	H	α-helix	trans	-66.6	-44.9	175.4	-72.7	-178.3	157.6	0	0	112	S33 V37 R38 E39	S33-E35 PolarHBondContact O-N 3.46Å; S33-E35 VanDerWaalsContact O-N 3.13Å; E35-V37 PolarHBondContact O-N 3.06Å; E35-R38 WeakPolarHBondContact O-CB 3.41Å; E35-R38 PolarHBondContact O-N 3.49Å; E35-E39 PolarHBondContact O-N 3.31Å
36	H	77.3	Confident	75.9	Confident	83 Å²	83	104.7 Å²	104.7	38%	0.384	51%	0.506	S	S	.	.	H	α-helix	trans	-68.3	-36.6	-179.6	-149.9	65.3	0	0	0	111.8	H32 S33 R38 E39 V40	H32-H36 HydrophobicContact CB-CB 4.22Å; H32-H36 AromaticContact CG-CD2 3.94Å; H32-H36 AromaticContact ND1-CD2 3.38Å; H32-H36 PolarHBondContact ND1-CD2 2.85Å; S33-H36 PolarHBondContact O-N 3.06Å; H36-R38 VanDerWaalsContact C-N 3.32Å; H36-R38 PolarHBondContact O-N 3.41Å; H36-E39 IonicContact ND1-OE2 2.98Å; H36-E39 PolarHBondContact ND1-OE2 2.93Å; H36-E39 WeakPolarHBondContact O-CB 3.32Å; H36-E39 PolarHBondContact O-N 3.14Å; H36-V40 WeakPolarHBondContact O-CG2 3.27Å; H36-V40 PolarHBondContact O-N 3.42Å
37	V	76.5	Confident	77.4	Confident	19 Å²	19	102.9 Å²	102.9	12%	0.115	50%	0.496	C	S	.	.	H	α-helix	trans	-63.5	-37.1	173.4	177.8	0	0	0	0	111.6	L28 F29 H32 S33 E35 V40 E41	L28-V37 HydrophobicContact CD2-CG1 4.27Å; L28-V37 HydrophobicContact CD2-CG2 4.36Å; L28-V37 HydrophobicContact CG-CG2 4.43Å; F29-V37 HydrophobicContact CD1-CG1 4.26Å; F29-V37 HydrophobicContact CD1-CG2 4.43Å; F29-V37 HydrophobicContact CE1-CG1 3.75Å; F29-V37 HydrophobicContact CZ-CG1 4.16Å; H32-V37 HydrophobicContact CB-CG2 4.13Å; S33-V37 PolarHBondContact O-N 2.74Å; S33-V37 VanDerWaalsContact O-N 3.09Å; E35-V37 PolarHBondContact O-N 3.06Å; V37-V40 PolarHBondContact O-N 3.43Å; V37-E41 WeakPolarHBondContact O-CB 3.44Å; V37-E41 PolarHBondContact O-N 2.89Å
38	R	81	Confident	78.7	Confident	159 Å²	159	102.7 Å²	102.7	60%	0.6	50%	0.498	S	S	*	.	H	α-helix	trans	-68.8	-33.9	174.4	-75.9	179.7	-179.4	175.2	1.7	112.8	V34 E35 H36 K42	V34-R38 WeakPolarHBondContact O-CG 3.39Å; V34-R38 PolarHBondContact O-N 2.78Å; E35-R38 WeakPolarHBondContact O-CB 3.41Å; E35-R38 PolarHBondContact O-N 3.49Å; H36-R38 VanDerWaalsContact C-N 3.32Å; H36-R38 PolarHBondContact O-N 3.41Å; R38-K42 WeakPolarHBondContact O-CB 3.28Å; R38-K42 WeakPolarHBondContact O-CG 3.44Å; R38-K42 PolarHBondContact O-N 3.19Å
39	E	83.2	Confident	80	Confident	120 Å²	120	106 Å²	106	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-64.4	-47.8	171.9	-76.1	178.4	158.2	0	0	110.8	E35 H36 E41 K42 E43	E35-E39 PolarHBondContact O-N 3.31Å; H36-E39 IonicContact ND1-OE2 2.98Å; H36-E39 PolarHBondContact ND1-OE2 2.93Å; H36-E39 WeakPolarHBondContact O-CB 3.32Å; H36-E39 PolarHBondContact O-N 3.14Å; E39-E41 VanDerWaalsContact C-N 3.34Å; E39-E41 PolarHBondContact O-N 3.45Å; E39-K42 PolarHBondContact O-N 2.66Å; E39-E43 WeakPolarHBondContact O-CB 3.43Å; E39-E43 PolarHBondContact O-N 2.96Å
40	V	81.6	Confident	81.4	Confident	44 Å²	44	103.8 Å²	103.8	27%	0.267	51%	0.506	S	S	.	.	H	α-helix	trans	-61	-41.4	175.2	174.8	0	0	0	0	111.3	L28 H36 V37 E43 I44	L28-V40 HydrophobicContact CD2-CG1 4.21Å; H36-V40 WeakPolarHBondContact O-CG2 3.27Å; H36-V40 PolarHBondContact O-N 3.42Å; V37-V40 PolarHBondContact O-N 3.43Å; V40-E43 PolarHBondContact O-N 3.18Å; V40-I44 HydrophobicContact CG1-CD1 3.69Å; V40-I44 HydrophobicContact CG1-CG1 4.26Å; V40-I44 WeakPolarHBondContact O-CB 3.49Å; V40-I44 VanDerWaalsContact O-CG1 3.23Å; V40-I44 WeakPolarHBondContact O-CG1 3.46Å; V40-I44 PolarHBondContact O-N 3.43Å
41	E	84.6	Confident	82.5	Confident	79 Å²	79	104.1 Å²	104.1	37%	0.369	50%	0.497	S	S	.	.	H	α-helix	trans	-60.5	-45.9	174.7	-173.4	-151.7	167.6	0	0	111.4	V37 E39 I44 R45	V37-E41 WeakPolarHBondContact O-CB 3.44Å; V37-E41 PolarHBondContact O-N 2.89Å; E39-E41 VanDerWaalsContact C-N 3.34Å; E39-E41 PolarHBondContact O-N 3.45Å; E41-I44 PolarHBondContact O-N 3.12Å; E41-R45 WeakPolarHBondContact O-CB 3.14Å; E41-R45 PolarHBondContact O-N 3.23Å; E41-R45 IonicContact OE1-CZ 3.01Å; E41-R45 IonicContact OE1-NH1 2.72Å; E41-R45 PolarHBondContact OE1-NH1 3.23Å; E41-R45 IonicContact OE1-NH2 2.72Å; E41-R45 PolarHBondContact OE1-NH2 3.1Å
42	K	87.6	Confident	83.6	Confident	154 Å²	154	105 Å²	105	67%	0.67	50%	0.497	S	S	*	.	H	α-helix	trans	-62.6	-42.7	176.7	-82.9	-177.6	179	178.5	0	111.6	R38 E39 R45 H46	R38-K42 WeakPolarHBondContact O-CB 3.28Å; R38-K42 WeakPolarHBondContact O-CG 3.44Å; R38-K42 PolarHBondContact O-N 3.19Å; E39-K42 PolarHBondContact O-N 2.66Å; K42-R45 PolarHBondContact O-N 3.02Å; K42-H46 WeakPolarHBondContact O-CB 3.34Å; K42-H46 PolarHBondContact O-N 2.82Å
43	E	88.5	Confident	84.6	Confident	127 Å²	127	104.9 Å²	104.9	59%	0.593	50%	0.496	S	S	*	.	H	α-helix	trans	-66.5	-42.4	177.9	-176.1	167.7	173.2	0	0	111.8	E39 V40 H46 N47	E39-E43 WeakPolarHBondContact O-CB 3.43Å; E39-E43 PolarHBondContact O-N 2.96Å; V40-E43 PolarHBondContact O-N 3.18Å; E43-H46 PolarHBondContact O-N 2.95Å; E43-N47 VanDerWaalsContact O-CB 3.32Å; E43-N47 WeakPolarHBondContact O-CB 3.4Å; E43-N47 PolarHBondContact O-N 2.72Å; E43-N47 PolarHBondContact O-ND2 3.39Å
44	I	87.7	Confident	85.4	Confident	99 Å²	99	107.3 Å²	107.3	51%	0.508	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-45.3	173.4	-69.4	169.4	0	0	0	110.1	V40 E41 H46 N47 T48	V40-I44 HydrophobicContact CG1-CD1 3.69Å; V40-I44 HydrophobicContact CG1-CG1 4.26Å; V40-I44 WeakPolarHBondContact O-CB 3.49Å; V40-I44 VanDerWaalsContact O-CG1 3.23Å; V40-I44 WeakPolarHBondContact O-CG1 3.46Å; V40-I44 PolarHBondContact O-N 3.43Å; E41-I44 PolarHBondContact O-N 3.12Å; I44-H46 VanDerWaalsContact C-N 3.32Å; I44-H46 PolarHBondContact O-N 3.31Å; I44-N47 CarbonylContact O-C 3.59Å; I44-N47 PolarHBondContact O-N 3.06Å; I44-T48 HydrophobicContact CG2-CG2 4.46Å; I44-T48 PolarHBondContact O-N 2.99Å; I44-T48 PolarHBondContact O-OG1 3.46Å
45	R	89.8	Confident	86.2	Confident	152 Å²	152	107.3 Å²	107.3	57%	0.574	50%	0.495	S	S	*	.	H	α-helix	trans	-58.5	-46.3	175.9	-96.5	-157.5	-164.6	102.5	13	111.4	E41 K42 T48 E49	E41-R45 WeakPolarHBondContact O-CB 3.14Å; E41-R45 PolarHBondContact O-N 3.23Å; E41-R45 IonicContact OE1-CZ 3.01Å; E41-R45 IonicContact OE1-NH1 2.72Å; E41-R45 PolarHBondContact OE1-NH1 3.23Å; E41-R45 IonicContact OE1-NH2 2.72Å; E41-R45 PolarHBondContact OE1-NH2 3.1Å; K42-R45 PolarHBondContact O-N 3.02Å; R45-T48 VanDerWaalsContact C-OG1 3.28Å; R45-T48 WeakPolarHBondContact CA-OG1 3.43Å; R45-T48 PolarHBondContact O-N 3.4Å; R45-T48 PolarHBondContact O-OG1 3.49Å; R45-E49 PolarHBondContact O-N 2.95Å
46	H	91.5	Very high	86.8	Confident	118 Å²	118	108 Å²	108	55%	0.546	49%	0.491	S	S	.	.	H	α-helix	trans	-60.9	-46.9	177.8	-175.8	59.7	0	0	0	111.1	K42 E43 I44 T48 E49 L50	K42-H46 WeakPolarHBondContact O-CB 3.34Å; K42-H46 PolarHBondContact O-N 2.82Å; E43-H46 PolarHBondContact O-N 2.95Å; I44-H46 VanDerWaalsContact C-N 3.32Å; I44-H46 PolarHBondContact O-N 3.31Å; H46-T48 PolarHBondContact O-N 2.83Å; H46-E49 PolarHBondContact O-N 2.9Å; H46-L50 WeakPolarHBondContact O-CG 3.38Å; H46-L50 PolarHBondContact O-N 3.1Å
47	N	91	Very high	87.3	Confident	69 Å²	69	108 Å²	108	37%	0.369	49%	0.494	S	S	.	.	H	α-helix	trans	-63.9	-36.7	175.8	-80.7	-32.7	0	0	0	112.9	E43 I44 K51	E43-N47 VanDerWaalsContact O-CB 3.32Å; E43-N47 WeakPolarHBondContact O-CB 3.4Å; E43-N47 PolarHBondContact O-N 2.72Å; E43-N47 PolarHBondContact O-ND2 3.39Å; I44-N47 CarbonylContact O-C 3.59Å; I44-N47 PolarHBondContact O-N 3.06Å; N47-K51 WeakPolarHBondContact O-CB 3.38Å; N47-K51 WeakPolarHBondContact O-CG 3.19Å; N47-K51 PolarHBondContact O-N 3.5Å
48	T	89	Confident	87.8	Confident	78 Å²	78	112.5 Å²	112.5	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-67.5	-38.1	173.7	41.8	0	0	0	0	111.8	I44 R45 H46 K51 R52	I44-T48 HydrophobicContact CG2-CG2 4.46Å; I44-T48 PolarHBondContact O-N 2.99Å; I44-T48 PolarHBondContact O-OG1 3.46Å; R45-T48 VanDerWaalsContact C-OG1 3.28Å; R45-T48 WeakPolarHBondContact CA-OG1 3.43Å; R45-T48 PolarHBondContact O-N 3.4Å; R45-T48 PolarHBondContact O-OG1 3.49Å; H46-T48 PolarHBondContact O-N 2.83Å; T48-K51 PolarHBondContact O-N 2.96Å; T48-R52 WeakPolarHBondContact O-CB 3.38Å; T48-R52 PolarHBondContact O-N 3.25Å
49	E	89.7	Confident	88.2	Confident	107 Å²	107	108 Å²	108	50%	0.5	51%	0.505	S	S	.	.	H	α-helix	trans	-69.7	-41.8	177.7	-162.4	61.3	-153.3	0	0	110.9	R45 H46 R52 E53	R45-E49 PolarHBondContact O-N 2.95Å; H46-E49 PolarHBondContact O-N 2.9Å; E49-R52 WeakPolarHBondContact O-CB 3.34Å; E49-R52 PolarHBondContact O-N 3.49Å; E49-E53 PolarHBondContact O-N 2.76Å
50	L	91.6	Very high	88.5	Confident	85 Å²	85	103.8 Å²	103.8	45%	0.445	49%	0.493	S	S	.	.	H	α-helix	trans	-58.4	-49.4	171.8	-74.7	175	0	0	0	111.6	H46 R52 E53 E54	H46-L50 WeakPolarHBondContact O-CG 3.38Å; H46-L50 PolarHBondContact O-N 3.1Å; L50-R52 VanDerWaalsContact C-N 3.28Å; L50-R52 PolarHBondContact O-N 2.9Å; L50-E53 PolarHBondContact O-N 3.44Å; L50-E54 WeakPolarHBondContact O-CG 3.42Å; L50-E54 PolarHBondContact O-N 3.45Å
51	K	89.7	Confident	88.8	Confident	133 Å²	133	108.6 Å²	108.6	58%	0.578	51%	0.507	S	S	*	.	H	α-helix	trans	-63.5	-34.6	176.7	-77.6	-179.9	-179.9	-179.7	0	112.6	N47 T48 E53 E54 L55	N47-K51 WeakPolarHBondContact O-CB 3.38Å; N47-K51 WeakPolarHBondContact O-CG 3.19Å; N47-K51 PolarHBondContact O-N 3.5Å; T48-K51 PolarHBondContact O-N 2.96Å; K51-E53 VanDerWaalsContact C-N 3.35Å; K51-E54 PolarHBondContact O-N 3.46Å; K51-L55 WeakPolarHBondContact O-CB 3.45Å; K51-L55 PolarHBondContact O-N 3.46Å
52	R	87.1	Confident	88.9	Confident	165 Å²	165	113.2 Å²	113.2	62%	0.623	52%	0.521	S	S	*	.	H	α-helix	trans	-65.8	-41.5	176.1	-167	180	-167.7	167.9	3.7	110.6	T48 E49 L50 L55 R56	T48-R52 WeakPolarHBondContact O-CB 3.38Å; T48-R52 PolarHBondContact O-N 3.25Å; E49-R52 WeakPolarHBondContact O-CB 3.34Å; E49-R52 PolarHBondContact O-N 3.49Å; L50-R52 VanDerWaalsContact C-N 3.28Å; L50-R52 PolarHBondContact O-N 2.9Å; R52-L55 PolarHBondContact O-N 3.08Å; R52-R56 WeakPolarHBondContact O-CG 3.19Å; R52-R56 PolarHBondContact O-N 3.37Å
53	E	87.3	Confident	88.9	Confident	80 Å²	80	113.3 Å²	113.3	37%	0.374	52%	0.518	S	S	.	.	H	α-helix	trans	-69.5	-40.9	175.3	-169.6	56.6	-154.1	0	0	111.9	E49 L50 K51 L55 R56 L57	E49-E53 PolarHBondContact O-N 2.76Å; L50-E53 PolarHBondContact O-N 3.44Å; K51-E53 VanDerWaalsContact C-N 3.35Å; E53-L55 VanDerWaalsContact C-N 3.32Å; E53-L55 PolarHBondContact O-N 3.13Å; E53-R56 PolarHBondContact O-N 3.44Å; E53-R56 IonicContact OE2-NH1 3.38Å; E53-R56 PolarHBondContact OE2-NH1 2.98Å; E53-L57 WeakPolarHBondContact O-CG 3.31Å; E53-L57 PolarHBondContact O-N 3.41Å
54	E	91.6	Very high	89	Confident	125 Å²	125	114.7 Å²	114.7	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-58.1	-42.9	170.9	-76.6	-178.3	162.5	0	0	112	L50 K51 L57 M58	L50-E54 WeakPolarHBondContact O-CG 3.42Å; L50-E54 PolarHBondContact O-N 3.45Å; K51-E54 PolarHBondContact O-N 3.46Å; E54-L57 PolarHBondContact O-N 3.1Å; E54-M58 WeakPolarHBondContact O-CB 3.34Å; E54-M58 PolarHBondContact O-N 2.93Å
55	L	89.3	Confident	89.2	Confident	105 Å²	105	114.4 Å²	114.4	55%	0.55	52%	0.517	S	S	.	.	H	α-helix	trans	-62	-43.1	174.9	-109.7	145.7	0	0	0	111.6	K51 R52 E53 L57 M58 V59	K51-L55 WeakPolarHBondContact O-CB 3.45Å; K51-L55 PolarHBondContact O-N 3.46Å; R52-L55 PolarHBondContact O-N 3.08Å; E53-L55 VanDerWaalsContact C-N 3.32Å; E53-L55 PolarHBondContact O-N 3.13Å; L55-L57 VanDerWaalsContact C-N 3.33Å; L55-L57 PolarHBondContact O-N 2.89Å; L55-M58 PolarHBondContact O-N 2.94Å; L55-V59 HydrophobicContact CD2-CG2 4.38Å; L55-V59 VanDerWaalsContact O-CB 3.31Å; L55-V59 WeakPolarHBondContact O-CB 3.16Å; L55-V59 WeakPolarHBondContact O-CG2 3.29Å; L55-V59 PolarHBondContact O-N 3.49Å
56	R	87.4	Confident	89.3	Confident	166 Å²	166	112.4 Å²	112.4	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-62.1	-42	175.5	-71.3	172.5	98.3	-155.9	7.7	111.5	R52 E53 G60	R52-R56 WeakPolarHBondContact O-CG 3.19Å; R52-R56 PolarHBondContact O-N 3.37Å; E53-R56 PolarHBondContact O-N 3.44Å; E53-R56 IonicContact OE2-NH1 3.38Å; E53-R56 PolarHBondContact OE2-NH1 2.98Å; R56-G60 PolarHBondContact O-N 3.47Å
57	L	88.9	Confident	89.2	Confident	83 Å²	83	111.4 Å²	111.4	44%	0.435	51%	0.514	S	S	.	.	H	α-helix	trans	-67.1	-38.8	175.8	-72.2	170.2	0	0	0	112.5	E53 E54 L55 R61	E53-L57 WeakPolarHBondContact O-CG 3.31Å; E53-L57 PolarHBondContact O-N 3.41Å; E54-L57 PolarHBondContact O-N 3.1Å; L55-L57 VanDerWaalsContact C-N 3.33Å; L55-L57 PolarHBondContact O-N 2.89Å; L57-R61 WeakPolarHBondContact O-CB 3.25Å; L57-R61 WeakPolarHBondContact O-CG 3.45Å; L57-R61 PolarHBondContact O-N 3.39Å
58	M	86.7	Confident	89.3	Confident	114 Å²	114	113.8 Å²	113.8	56%	0.562	52%	0.523	S	S	*	.	H	α-helix	trans	-69.3	-44.3	178.1	-168	-166.3	-62.1	0	0	111.2	E54 L55 R61 R62	E54-M58 WeakPolarHBondContact O-CB 3.34Å; E54-M58 PolarHBondContact O-N 2.93Å; L55-M58 PolarHBondContact O-N 2.94Å; M58-R61 PolarHBondContact O-N 3.32Å; M58-R62 WeakPolarHBondContact O-CB 3.37Å; M58-R62 WeakPolarHBondContact O-CG 3.4Å; M58-R62 PolarHBondContact O-N 2.83Å
59	V	88.1	Confident	89.5	Confident	66 Å²	66	112.4 Å²	112.4	40%	0.4	52%	0.52	S	S	.	.	H	α-helix	trans	-65.5	-44.1	175.8	171.5	0	0	0	0	110.4	L55 R61 R62 Y63	L55-V59 HydrophobicContact CD2-CG2 4.38Å; L55-V59 VanDerWaalsContact O-CB 3.31Å; L55-V59 WeakPolarHBondContact O-CB 3.16Å; L55-V59 WeakPolarHBondContact O-CG2 3.29Å; L55-V59 PolarHBondContact O-N 3.49Å; V59-R61 VanDerWaalsContact C-N 3.28Å; V59-R61 PolarHBondContact O-N 3.45Å; V59-R62 PolarHBondContact O-N 2.83Å; V59-Y63 HydrophobicContact CG1-CD2 3.5Å; V59-Y63 HydrophobicContact CG1-CE2 3.52Å; V59-Y63 WeakPolarHBondContact O-CB 3.23Å; V59-Y63 WeakPolarHBondContact O-CD2 3.41Å; V59-Y63 PolarHBondContact O-N 3.33Å
60	G	89.1	Confident	89.6	Confident	30 Å²	30	109.7 Å²	109.7	31%	0.309	52%	0.516	S	S	.	.	H	α-helix	trans	-66.5	-26.2	175.8	0	0	0	0	0	114.1	R56 R64	R56-G60 PolarHBondContact O-N 3.47Å; G60-R64 PolarHBondContact O-N 3.4Å; G60-R64 PolarHBondContact O-NE 3.18Å
61	R	89	Confident	89.7	Confident	146 Å²	146	110.1 Å²	110.1	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-72.7	-52.8	167.8	-84.4	-173.8	-96.6	-139.8	0.6	111	L57 M58 V59 Y63 R64 D65	L57-R61 WeakPolarHBondContact O-CB 3.25Å; L57-R61 WeakPolarHBondContact O-CG 3.45Å; L57-R61 PolarHBondContact O-N 3.39Å; M58-R61 PolarHBondContact O-N 3.32Å; V59-R61 VanDerWaalsContact C-N 3.28Å; V59-R61 PolarHBondContact O-N 3.45Å; R61-Y63 VanDerWaalsContact C-N 3.31Å; R61-Y63 PolarHBondContact O-N 3.14Å; R61-R64 WeakPolarHBondContact O-CA 3.3Å; R61-R64 WeakPolarHBondContact O-CB 3.22Å; R61-R64 PolarHBondContact O-N 3.13Å; R61-D65 VanDerWaalsContact O-CG 3.23Å; R61-D65 PolarHBondContact O-N 2.67Å
62	R	86.2	Confident	89.9	Confident	176 Å²	176	108.2 Å²	108.2	66%	0.664	52%	0.515	S	S	*	.	H	α-helix	trans	-54	-42.8	176.7	-75.9	-104.6	177.4	164.9	-3.3	113.1	M58 V59 D65 I66	M58-R62 WeakPolarHBondContact O-CB 3.37Å; M58-R62 WeakPolarHBondContact O-CG 3.4Å; M58-R62 PolarHBondContact O-N 2.83Å; V59-R62 PolarHBondContact O-N 2.83Å; R62-D65 PolarHBondContact O-N 3.11Å; R62-I66 WeakPolarHBondContact O-CB 3.36Å; R62-I66 WeakPolarHBondContact O-CD1 3.41Å; R62-I66 WeakPolarHBondContact O-CG1 3.48Å; R62-I66 PolarHBondContact O-N 2.81Å
63	Y	88.3	Confident	90.1	Very high	156 Å²	156	106 Å²	106	61%	0.612	52%	0.515	S	S	*	.	H	α-helix	trans	-65.5	-40	175.8	-90.9	-72.2	0	0	0	112.4	V59 R61 I66 I67	V59-Y63 HydrophobicContact CG1-CD2 3.5Å; V59-Y63 HydrophobicContact CG1-CE2 3.52Å; V59-Y63 WeakPolarHBondContact O-CB 3.23Å; V59-Y63 WeakPolarHBondContact O-CD2 3.41Å; V59-Y63 PolarHBondContact O-N 3.33Å; R61-Y63 VanDerWaalsContact C-N 3.31Å; R61-Y63 PolarHBondContact O-N 3.14Å; Y63-I66 PolarHBondContact O-N 3.28Å; Y63-I67 WeakPolarHBondContact O-CD1 3.48Å; Y63-I67 VanDerWaalsContact O-CG1 3.23Å; Y63-I67 WeakPolarHBondContact O-CG1 3.2Å; Y63-I67 PolarHBondContact O-N 3.44Å
64	R	90.1	Very high	90.3	Very high	155 Å²	155	107.4 Å²	107.4	59%	0.585	52%	0.521	S	S	*	.	H	α-helix	trans	-65.7	-45.8	174.6	-91.3	-177.5	-70.1	161.6	-4.5	111.7	G60 R61 I66 I67 E68	G60-R64 PolarHBondContact O-N 3.4Å; G60-R64 PolarHBondContact O-NE 3.18Å; R61-R64 WeakPolarHBondContact O-CA 3.3Å; R61-R64 WeakPolarHBondContact O-CB 3.22Å; R61-R64 PolarHBondContact O-N 3.13Å; R64-I66 PolarHBondContact O-N 3.47Å; R64-I67 PolarHBondContact O-N 2.77Å; R64-I67 VanDerWaalsContact O-N 3.11Å; R64-E68 WeakPolarHBondContact O-CB 3.43Å; R64-E68 PolarHBondContact O-N 2.78Å
65	D	92.1	Very high	90.4	Very high	93 Å²	93	104.8 Å²	104.8	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-60.2	-37.5	177.8	-58.8	-15.9	0	0	0	111	R61 R62 A69	R61-D65 VanDerWaalsContact O-CG 3.23Å; R61-D65 PolarHBondContact O-N 2.67Å; R62-D65 PolarHBondContact O-N 3.11Å; D65-A69 VanDerWaalsContact O-CB 3.24Å; D65-A69 WeakPolarHBondContact O-CB 3.47Å; D65-A69 PolarHBondContact O-N 3.44Å
66	I	91.3	Very high	90.6	Very high	110 Å²	110	106 Å²	106	56%	0.564	52%	0.518	S	S	*	.	H	α-helix	trans	-68.3	-41	175.3	-71.3	164.9	0	0	0	111.7	R62 Y63 R64 A70	R62-I66 WeakPolarHBondContact O-CB 3.36Å; R62-I66 WeakPolarHBondContact O-CD1 3.41Å; R62-I66 WeakPolarHBondContact O-CG1 3.48Å; R62-I66 PolarHBondContact O-N 2.81Å; Y63-I66 PolarHBondContact O-N 3.28Å; R64-I66 PolarHBondContact O-N 3.47Å; I66-A70 WeakPolarHBondContact O-CB 3.41Å; I66-A70 PolarHBondContact O-N 3.12Å
67	I	89.8	Confident	91	Very high	97 Å²	97	103.1 Å²	103.1	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-67	-45.5	177.2	-68.8	164.4	0	0	0	110.1	Y63 R64 A69 A70 D71	Y63-I67 WeakPolarHBondContact O-CD1 3.48Å; Y63-I67 VanDerWaalsContact O-CG1 3.23Å; Y63-I67 WeakPolarHBondContact O-CG1 3.2Å; Y63-I67 PolarHBondContact O-N 3.44Å; R64-I67 PolarHBondContact O-N 2.77Å; R64-I67 VanDerWaalsContact O-N 3.11Å; I67-A69 VanDerWaalsContact C-N 3.34Å; I67-A69 PolarHBondContact O-N 3.26Å; I67-A70 CarbonylContact O-C 3.58Å; I67-A70 WeakPolarHBondContact O-CA 3.37Å; I67-A70 WeakPolarHBondContact O-CB 3.48Å; I67-A70 PolarHBondContact O-N 3.43Å; I67-D71 PolarHBondContact O-N 3.28Å
68	E	92.7	Very high	91.2	Very high	119 Å²	119	102.3 Å²	102.3	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-60.2	-44.6	176.7	-171.4	171.1	-171.2	0	0	110.8	R64 A70 D71 D72	R64-E68 WeakPolarHBondContact O-CB 3.43Å; R64-E68 PolarHBondContact O-N 2.78Å; E68-A70 VanDerWaalsContact C-N 3.3Å; E68-A70 PolarHBondContact O-N 3Å; E68-D71 PolarHBondContact O-N 3.26Å; E68-D72 WeakPolarHBondContact O-CB 2.78Å; E68-D72 VanDerWaalsContact O-CG 3.27Å; E68-D72 PolarHBondContact O-N 3.05Å
69	A	93.6	Very high	91.5	Very high	49 Å²	49	102.3 Å²	102.3	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-33.7	173.3	0	0	0	0	0	113.2	D65 I67 L73	D65-A69 VanDerWaalsContact O-CB 3.24Å; D65-A69 WeakPolarHBondContact O-CB 3.47Å; D65-A69 PolarHBondContact O-N 3.44Å; I67-A69 VanDerWaalsContact C-N 3.34Å; I67-A69 PolarHBondContact O-N 3.26Å; A69-L73 WeakPolarHBondContact O-CB 3.17Å; A69-L73 WeakPolarHBondContact O-CG 3.29Å; A69-L73 PolarHBondContact O-N 3.37Å
70	A	92.6	Very high	91.8	Very high	50 Å²	50	101.9 Å²	101.9	41%	0.413	51%	0.512	S	S	.	.	H	α-helix	trans	-71.6	-39.1	175.7	0	0	0	0	0	112	I66 I67 E68 L73 H74	I66-A70 WeakPolarHBondContact O-CB 3.41Å; I66-A70 PolarHBondContact O-N 3.12Å; I67-A70 CarbonylContact O-C 3.58Å; I67-A70 WeakPolarHBondContact O-CA 3.37Å; I67-A70 WeakPolarHBondContact O-CB 3.48Å; I67-A70 PolarHBondContact O-N 3.43Å; E68-A70 VanDerWaalsContact C-N 3.3Å; E68-A70 PolarHBondContact O-N 3Å; A70-L73 PolarHBondContact O-N 2.67Å; A70-H74 WeakPolarHBondContact O-CB 3.29Å; A70-H74 PolarHBondContact O-N 3.38Å
71	D	93.3	Very high	92	Very high	95 Å²	95	106.4 Å²	106.4	51%	0.508	53%	0.525	S	S	.	.	H	α-helix	trans	-66	-40.1	173.2	-72.6	-22.7	0	0	0	110.7	I67 E68 L73 H74 T75	I67-D71 PolarHBondContact O-N 3.28Å; E68-D71 PolarHBondContact O-N 3.26Å; D71-L73 PolarHBondContact O-N 3.12Å; D71-H74 PolarHBondContact O-N 3.44Å; D71-T75 WeakPolarHBondContact O-CG2 3Å; D71-T75 PolarHBondContact O-N 2.87Å; D71-T75 PolarHBondContact O-OG1 3.19Å
72	D	93.6	Very high	92.1	Very high	92 Å²	92	104.9 Å²	104.9	49%	0.492	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-41.5	172.5	-74.6	-17.9	0	0	0	111.6	E68 H74 T75 M76	E68-D72 WeakPolarHBondContact O-CB 2.78Å; E68-D72 VanDerWaalsContact O-CG 3.27Å; E68-D72 PolarHBondContact O-N 3.05Å; D72-H74 VanDerWaalsContact C-N 3.33Å; D72-H74 PolarHBondContact O-N 2.9Å; D72-T75 WeakPolarHBondContact CA-OG1 3.46Å; D72-T75 PolarHBondContact O-N 3.44Å; D72-T75 PolarHBondContact O-OG1 3.24Å; D72-M76 WeakPolarHBondContact O-CB 3.48Å; D72-M76 WeakPolarHBondContact O-CG 3.21Å; D72-M76 PolarHBondContact O-N 3.22Å
73	L	91.3	Very high	92.3	Very high	120 Å²	120	98.5 Å²	98.5	63%	0.628	51%	0.513	S	S	*	.	H	α-helix	trans	-63.9	-38.9	173.1	-79.7	167.7	0	0	0	111.9	A69 A70 D71 M76 H77	A69-L73 WeakPolarHBondContact O-CB 3.17Å; A69-L73 WeakPolarHBondContact O-CG 3.29Å; A69-L73 PolarHBondContact O-N 3.37Å; A70-L73 PolarHBondContact O-N 2.67Å; D71-L73 PolarHBondContact O-N 3.12Å; L73-M76 PolarHBondContact O-N 2.88Å; L73-H77 WeakPolarHBondContact O-CB 3.38Å; L73-H77 PolarHBondContact O-N 3.43Å
74	H	92	Very high	92.5	Very high	109 Å²	109	95.8 Å²	95.8	51%	0.505	51%	0.509	S	S	.	.	H	α-helix	trans	-69.4	-41	177.8	-168.5	63.5	0	0	0	111.9	A70 D71 D72 H77 N78	A70-H74 WeakPolarHBondContact O-CB 3.29Å; A70-H74 PolarHBondContact O-N 3.38Å; D71-H74 PolarHBondContact O-N 3.44Å; D72-H74 VanDerWaalsContact C-N 3.33Å; D72-H74 PolarHBondContact O-N 2.9Å; H74-H77 WeakPolarHBondContact O-CB 3.43Å; H74-H77 PolarHBondContact O-N 2.82Å; H74-N78 PolarHBondContact NE2-ND2 3.31Å; H74-N78 VanDerWaalsContact O-CG 3.26Å; H74-N78 PolarHBondContact O-N 2.99Å; H74-N78 PolarHBondContact O-ND2 2.64Å
75	T	93.6	Very high	92.5	Very high	69 Å²	69	90.1 Å²	90.1	42%	0.423	50%	0.499	S	S	.	.	H	α-helix	trans	-65.9	-40.8	173.7	57.8	0	0	0	0	111.6	D71 D72 H77 N78 I79	D71-T75 WeakPolarHBondContact O-CG2 3Å; D71-T75 PolarHBondContact O-N 2.87Å; D71-T75 PolarHBondContact O-OG1 3.19Å; D72-T75 WeakPolarHBondContact CA-OG1 3.46Å; D72-T75 PolarHBondContact O-N 3.44Å; D72-T75 PolarHBondContact O-OG1 3.24Å; T75-H77 VanDerWaalsContact C-N 3.31Å; T75-H77 PolarHBondContact O-N 3.48Å; T75-N78 PolarHBondContact O-N 2.96Å; T75-I79 WeakPolarHBondContact O-CB 3.49Å; T75-I79 WeakPolarHBondContact O-CD1 3.43Å; T75-I79 WeakPolarHBondContact O-CG1 3.03Å; T75-I79 PolarHBondContact O-N 2.92Å
76	M	93	Very high	92.3	Very high	132 Å²	132	92.1 Å²	92.1	65%	0.65	51%	0.505	S	S	*	.	H	α-helix	trans	-58.6	-42.4	171.1	-84.9	-167.6	159	0	0	112.1	D72 L73 I79 A80	D72-M76 WeakPolarHBondContact O-CB 3.48Å; D72-M76 WeakPolarHBondContact O-CG 3.21Å; D72-M76 PolarHBondContact O-N 3.22Å; L73-M76 PolarHBondContact O-N 2.88Å; M76-I79 PolarHBondContact O-N 3.4Å; M76-A80 WeakPolarHBondContact O-CB 3.13Å; M76-A80 PolarHBondContact O-N 3.01Å
77	H	95.1	Very high	91.9	Very high	104 Å²	104	92.2 Å²	92.2	48%	0.481	51%	0.506	S	S	.	.	H	α-helix	trans	-61.1	-47.5	176.7	-179.1	53.2	0	0	0	111.6	L73 H74 T75 I79 A80 E81	L73-H77 WeakPolarHBondContact O-CB 3.38Å; L73-H77 PolarHBondContact O-N 3.43Å; H74-H77 WeakPolarHBondContact O-CB 3.43Å; H74-H77 PolarHBondContact O-N 2.82Å; T75-H77 VanDerWaalsContact C-N 3.31Å; T75-H77 PolarHBondContact O-N 3.48Å; H77-I79 PolarHBondContact O-N 3.18Å; H77-A80 PolarHBondContact O-N 3.41Å; H77-E81 PolarHBondContact O-N 3.39Å
78	N	93.3	Very high	91.4	Very high	66 Å²	66	93.5 Å²	93.5	35%	0.353	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-42.8	178.4	-65.6	-22.4	0	0	0	111.8	H74 T75 A80 E81 D82	H74-N78 PolarHBondContact NE2-ND2 3.31Å; H74-N78 VanDerWaalsContact O-CG 3.26Å; H74-N78 PolarHBondContact O-N 2.99Å; H74-N78 PolarHBondContact O-ND2 2.64Å; T75-N78 PolarHBondContact O-N 2.96Å; N78-A80 VanDerWaalsContact C-N 3.29Å; N78-A80 PolarHBondContact O-N 3.32Å; N78-E81 PolarHBondContact O-N 2.97Å; N78-D82 WeakPolarHBondContact O-CB 3.32Å; N78-D82 PolarHBondContact O-N 3.17Å
79	I	94.1	Very high	90.7	Very high	114 Å²	114	90.5 Å²	90.5	59%	0.585	51%	0.506	S	S	*	.	H	α-helix	trans	-63.2	-37.7	176.1	-66.6	164	0	0	0	110.9	T75 M76 H77 A83	T75-I79 WeakPolarHBondContact O-CB 3.49Å; T75-I79 WeakPolarHBondContact O-CD1 3.43Å; T75-I79 WeakPolarHBondContact O-CG1 3.03Å; T75-I79 PolarHBondContact O-N 2.92Å; M76-I79 PolarHBondContact O-N 3.4Å; H77-I79 PolarHBondContact O-N 3.18Å; I79-A83 VanDerWaalsContact O-CB 3.28Å; I79-A83 WeakPolarHBondContact O-CB 3.45Å; I79-A83 PolarHBondContact O-N 3.43Å
80	A	93.4	Very high	89.9	Confident	58 Å²	58	93 Å²	93	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-69	-40.7	177.2	0	0	0	0	0	112.5	M76 H77 N78 A83 L84	M76-A80 WeakPolarHBondContact O-CB 3.13Å; M76-A80 PolarHBondContact O-N 3.01Å; H77-A80 PolarHBondContact O-N 3.41Å; N78-A80 VanDerWaalsContact C-N 3.29Å; N78-A80 PolarHBondContact O-N 3.32Å; A80-A83 PolarHBondContact O-N 3.02Å; A80-L84 WeakPolarHBondContact O-CB 3.35Å; A80-L84 PolarHBondContact O-N 3.5Å
81	E	92.6	Very high	89.1	Confident	125 Å²	125	99.8 Å²	99.8	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-62.4	-46.1	172.2	-94.2	-154.7	148.4	0	0	111.8	H77 N78 A83 L84 G85	H77-E81 PolarHBondContact O-N 3.39Å; N78-E81 PolarHBondContact O-N 2.97Å; E81-A83 VanDerWaalsContact C-N 3.32Å; E81-A83 PolarHBondContact O-N 3.46Å; E81-L84 WeakPolarHBondContact O-CB 3.46Å; E81-L84 PolarHBondContact O-N 3.07Å; E81-G85 PolarHBondContact O-N 3.32Å
82	D	92.8	Very high	87.8	Confident	113 Å²	113	97.7 Å²	97.7	60%	0.604	52%	0.519	S	S	*	.	H	α-helix	trans	-60.1	-43.4	176.4	-90.6	-5.7	0	0	0	111.1	N78 L84 G85 Q86	N78-D82 WeakPolarHBondContact O-CB 3.32Å; N78-D82 PolarHBondContact O-N 3.17Å; D82-L84 PolarHBondContact O-N 3.08Å; D82-G85 PolarHBondContact O-N 3.34Å; D82-Q86 WeakPolarHBondContact O-CB 3.49Å; D82-Q86 VanDerWaalsContact O-CG 3.25Å; D82-Q86 WeakPolarHBondContact O-CG 3.28Å; D82-Q86 PolarHBondContact O-N 3.5Å
83	A	89.8	Confident	86.5	Confident	43 Å²	43	94.4 Å²	94.4	36%	0.355	51%	0.507	S	S	.	.	H	α-helix	trans	-63.5	-39.6	176	0	0	0	0	0	112.2	I79 A80 E81 Q86 L87	I79-A83 VanDerWaalsContact O-CB 3.28Å; I79-A83 WeakPolarHBondContact O-CB 3.45Å; I79-A83 PolarHBondContact O-N 3.43Å; A80-A83 PolarHBondContact O-N 3.02Å; E81-A83 VanDerWaalsContact C-N 3.32Å; E81-A83 PolarHBondContact O-N 3.46Å; A83-Q86 PolarHBondContact O-N 2.94Å; A83-L87 WeakPolarHBondContact O-CB 3.46Å; A83-L87 WeakPolarHBondContact O-CG 3.35Å; A83-L87 PolarHBondContact O-N 3.15Å
84	L	91.7	Very high	85.2	Confident	99 Å²	99	92.5 Å²	92.5	52%	0.518	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-43.8	175.1	-165.7	87.1	0	0	0	111.2	A80 E81 D82 Q86 L87 Q88	A80-L84 WeakPolarHBondContact O-CB 3.35Å; A80-L84 PolarHBondContact O-N 3.5Å; E81-L84 WeakPolarHBondContact O-CB 3.46Å; E81-L84 PolarHBondContact O-N 3.07Å; D82-L84 PolarHBondContact O-N 3.08Å; L84-Q86 VanDerWaalsContact C-N 3.35Å; L84-L87 PolarHBondContact O-N 2.88Å; L84-Q88 WeakPolarHBondContact O-CG 3.39Å; L84-Q88 PolarHBondContact O-N 3.3Å
85	G	89.9	Confident	83.6	Confident	36 Å²	36	89.9 Å²	89.9	37%	0.371	49%	0.49	S	S	.	.	H	α-helix	trans	-61	-43.4	175.4	0	0	0	0	0	111.8	E81 D82 Q88 A89	E81-G85 PolarHBondContact O-N 3.32Å; D82-G85 PolarHBondContact O-N 3.34Å; G85-Q88 PolarHBondContact O-N 3.11Å; G85-A89 WeakPolarHBondContact O-CB 3.3Å; G85-A89 PolarHBondContact O-N 2.97Å
86	Q	88	Confident	81.9	Confident	134 Å²	134	93.7 Å²	93.7	63%	0.626	50%	0.497	S	S	*	.	H	α-helix	trans	-62.6	-42.9	173.1	-73.1	176.7	22.3	0	0	111.9	D82 A83 L84 A89 L90	D82-Q86 WeakPolarHBondContact O-CB 3.49Å; D82-Q86 VanDerWaalsContact O-CG 3.25Å; D82-Q86 WeakPolarHBondContact O-CG 3.28Å; D82-Q86 PolarHBondContact O-N 3.5Å; A83-Q86 PolarHBondContact O-N 2.94Å; L84-Q86 VanDerWaalsContact C-N 3.35Å; Q86-A89 PolarHBondContact O-N 2.95Å; Q86-L90 WeakPolarHBondContact O-CB 3.16Å; Q86-L90 PolarHBondContact O-N 3.07Å
87	L	82.9	Confident	80.2	Confident	112 Å²	112	92.5 Å²	92.5	59%	0.586	49%	0.493	S	S	*	.	H	α-helix	trans	-64.9	-38.3	175.9	-83.5	167.6	0	0	0	112.6	A83 L84 L90 R91	A83-L87 WeakPolarHBondContact O-CB 3.46Å; A83-L87 WeakPolarHBondContact O-CG 3.35Å; A83-L87 PolarHBondContact O-N 3.15Å; L84-L87 PolarHBondContact O-N 2.88Å; L87-L90 PolarHBondContact O-N 3.04Å; L87-R91 VanDerWaalsContact O-CB 3.31Å; L87-R91 WeakPolarHBondContact O-CB 3.11Å; L87-R91 PolarHBondContact O-N 3.48Å
88	Q	81.1	Confident	78.4	Confident	124 Å²	124	94.8 Å²	94.8	58%	0.579	50%	0.503	S	S	*	.	H	α-helix	trans	-67.4	-42.3	174.6	-73.1	178.8	8.8	0	0	111.5	L84 G85 L90 R91 S92	L84-Q88 WeakPolarHBondContact O-CG 3.39Å; L84-Q88 PolarHBondContact O-N 3.3Å; G85-Q88 PolarHBondContact O-N 3.11Å; Q88-L90 VanDerWaalsContact C-N 3.33Å; Q88-L90 PolarHBondContact O-N 3.25Å; Q88-R91 PolarHBondContact O-N 3.15Å; Q88-S92 PolarHBondContact O-N 3.1Å
89	A	77.8	Confident	76.7	Confident	57 Å²	57	95.4 Å²	95.4	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-61.1	-44.1	173.3	0	0	0	0	0	110.9	G85 Q86 S92 G93	G85-A89 WeakPolarHBondContact O-CB 3.3Å; G85-A89 PolarHBondContact O-N 2.97Å; Q86-A89 PolarHBondContact O-N 2.95Å; A89-S92 CarbonylContact O-C 3.59Å; A89-S92 PolarHBondContact O-N 3.15Å; A89-S92 PolarHBondContact O-OG 2.98Å; A89-G93 PolarHBondContact O-N 3.09Å
90	L	77.1	Confident	75.2	Confident	101 Å²	101	92.2 Å²	92.2	53%	0.529	49%	0.485	S	S	.	.	H	α-helix	trans	-66.1	-39.6	177.4	-163.6	150.8	0	0	0	111.2	Q86 L87 Q88 G93 I94	Q86-L90 WeakPolarHBondContact O-CB 3.16Å; Q86-L90 PolarHBondContact O-N 3.07Å; L87-L90 PolarHBondContact O-N 3.04Å; Q88-L90 VanDerWaalsContact C-N 3.33Å; Q88-L90 PolarHBondContact O-N 3.25Å; L90-G93 CarbonylContact O-C 3.59Å; L90-G93 WeakPolarHBondContact O-CA 3.35Å; L90-G93 PolarHBondContact O-N 3.01Å; L90-G93 VanDerWaalsContact O-N 3.15Å; L90-I94 HydrophobicContact CD2-CD1 3.31Å; L90-I94 HydrophobicContact CD2-CG1 3.83Å; L90-I94 WeakPolarHBondContact O-CB 3.37Å; L90-I94 WeakPolarHBondContact O-CG1 3.5Å; L90-I94 PolarHBondContact O-N 3.13Å
91	R	75.1	Confident	73.5	Confident	193 Å²	193	91.6 Å²	91.6	73%	0.728	48%	0.476	S	S	*	.	H	α-helix	trans	-60.2	-46.3	171.5	-173.1	178.4	-176.2	-173.9	1.5	111.1	L87 Q88 G93 I94 S95	L87-R91 VanDerWaalsContact O-CB 3.31Å; L87-R91 WeakPolarHBondContact O-CB 3.11Å; L87-R91 PolarHBondContact O-N 3.48Å; Q88-R91 PolarHBondContact O-N 3.15Å; R91-G93 PolarHBondContact O-N 2.63Å; R91-I94 PolarHBondContact O-N 2.78Å; R91-S95 WeakPolarHBondContact O-CB 3.25Å; R91-S95 PolarHBondContact O-N 3.4Å; R91-S95 PolarHBondContact O-OG 2.98Å; R91-S95 VanDerWaalsContact O-OG 3.07Å
92	S	65.2	Low	71.8	Confident	51 Å²	51	92.4 Å²	92.4	36%	0.357	49%	0.49	S	S	.	.	H	α-helix	trans	-63.9	-31.6	175.4	86.5	0	0	0	0	112.7	Q88 A89 R96	Q88-S92 PolarHBondContact O-N 3.1Å; A89-S92 CarbonylContact O-C 3.59Å; A89-S92 PolarHBondContact O-N 3.15Å; A89-S92 PolarHBondContact O-OG 2.98Å; S92-R96 WeakPolarHBondContact O-CG 3.25Å; S92-R96 PolarHBondContact O-N 2.82Å; S92-R96 PolarHBondContact O-NE 2.75Å; S92-R96 VanDerWaalsContact O-NE 3.15Å; S92-R96 PolarHBondContact OG-NH2 3.27Å
93	G	66.9	Low	70.1	Confident	22 Å²	22	87.5 Å²	87.5	23%	0.227	46%	0.463	C	S	.	.	H	α-helix	trans	-72.4	-48.5	176.2	0	0	0	0	0	111.7	A89 L90 R91 R96 L97	A89-G93 PolarHBondContact O-N 3.09Å; L90-G93 CarbonylContact O-C 3.59Å; L90-G93 WeakPolarHBondContact O-CA 3.35Å; L90-G93 PolarHBondContact O-N 3.01Å; L90-G93 VanDerWaalsContact O-N 3.15Å; R91-G93 PolarHBondContact O-N 2.63Å; G93-R96 WeakPolarHBondContact O-CB 3.37Å; G93-R96 PolarHBondContact O-N 3.38Å; G93-R96 VanDerWaalsContact O-N 3.15Å; G93-L97 WeakPolarHBondContact O-CG 3.44Å; G93-L97 PolarHBondContact O-N 3.43Å
94	I	63.5	Low	68.3	Low	80 Å²	80	89.2 Å²	89.2	41%	0.41	47%	0.471	S	S	.	.	H	α-helix	trans	-60.8	-46.9	174.7	-70.4	-179.8	0	0	0	110.3	L90 R91 R96 L97 Q98	L90-I94 HydrophobicContact CD2-CD1 3.31Å; L90-I94 HydrophobicContact CD2-CG1 3.83Å; L90-I94 WeakPolarHBondContact O-CB 3.37Å; L90-I94 WeakPolarHBondContact O-CG1 3.5Å; L90-I94 PolarHBondContact O-N 3.13Å; R91-I94 PolarHBondContact O-N 2.78Å; I94-R96 PolarHBondContact O-N 3.01Å; I94-L97 PolarHBondContact O-N 2.99Å; I94-L97 VanDerWaalsContact O-N 3.09Å; I94-Q98 HydrophobicContact CG2-CG 4.08Å; I94-Q98 WeakPolarHBondContact O-CB 3.37Å; I94-Q98 WeakPolarHBondContact O-CG 3.39Å; I94-Q98 PolarHBondContact O-N 3.4Å
95	S	58.5	Low	66.5	Low	54 Å²	54	94 Å²	94	38%	0.378	49%	0.487	S	S	.	.	H	α-helix	trans	-59	-31.6	177	-68	0	0	0	0	112.4	R91 Q99	R91-S95 WeakPolarHBondContact O-CB 3.25Å; R91-S95 PolarHBondContact O-N 3.4Å; R91-S95 PolarHBondContact O-OG 2.98Å; R91-S95 VanDerWaalsContact O-OG 3.07Å; S95-Q99 WeakPolarHBondContact O-CG 3.37Å; S95-Q99 PolarHBondContact O-NE2 2.83Å
96	R	58.8	Low	64.7	Low	150 Å²	150	93.2 Å²	93.2	57%	0.566	48%	0.476	S	S	*	.	H	α-helix	trans	-73.1	-48.1	171.4	-83.9	-179.3	-86.8	-178.8	-8.3	111.5	S92 G93 I94 Q98 Q99 Y100	S92-R96 WeakPolarHBondContact O-CG 3.25Å; S92-R96 PolarHBondContact O-N 2.82Å; S92-R96 PolarHBondContact O-NE 2.75Å; S92-R96 VanDerWaalsContact O-NE 3.15Å; S92-R96 PolarHBondContact OG-NH2 3.27Å; G93-R96 WeakPolarHBondContact O-CB 3.37Å; G93-R96 PolarHBondContact O-N 3.38Å; G93-R96 VanDerWaalsContact O-N 3.15Å; I94-R96 PolarHBondContact O-N 3.01Å; R96-Q98 VanDerWaalsContact C-N 3.33Å; R96-Q98 PolarHBondContact O-N 3.01Å; R96-Q99 VanDerWaalsContact O-CB 3.27Å; R96-Q99 WeakPolarHBondContact O-CB 3.32Å; R96-Q99 PolarHBondContact O-N 3.3Å; R96-Y100 WeakPolarHBondContact O-CD2 3.46Å
97	L	57	Low	63.2	Low	107 Å²	107	91.4 Å²	91.4	56%	0.56	48%	0.477	S	S	*	.	H	α-helix	trans	-64.1	-35	-179.2	-70.6	173.6	0	0	0	113	G93 I94 Q99 Y100	G93-L97 WeakPolarHBondContact O-CG 3.44Å; G93-L97 PolarHBondContact O-N 3.43Å; I94-L97 PolarHBondContact O-N 2.99Å; I94-L97 VanDerWaalsContact O-N 3.09Å; L97-Q99 PolarHBondContact O-N 3.03Å; L97-Q99 VanDerWaalsContact O-N 3.16Å; L97-Y100 PolarHBondContact O-N 3.38Å
98	Q	57.4	Low	62	Low	151 Å²	151	86.1 Å²	86.1	71%	0.706	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.5	172.9	-77	179	-21	0	0	112.8	I94 R96	I94-Q98 HydrophobicContact CG2-CG 4.08Å; I94-Q98 WeakPolarHBondContact O-CB 3.37Å; I94-Q98 WeakPolarHBondContact O-CG 3.39Å; I94-Q98 PolarHBondContact O-N 3.4Å; R96-Q98 VanDerWaalsContact C-N 3.33Å; R96-Q98 PolarHBondContact O-N 3.01Å
99	Q	57.2	Low	60.8	Low	79 Å²	79	84 Å²	84	37%	0.369	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-22.9	176.4	-61.8	167.2	33.3	0	0	111.9	S95 R96 L97 Y175 K210	S95-Q99 WeakPolarHBondContact O-CG 3.37Å; S95-Q99 PolarHBondContact O-NE2 2.83Å; R96-Q99 VanDerWaalsContact O-CB 3.27Å; R96-Q99 WeakPolarHBondContact O-CB 3.32Å; R96-Q99 PolarHBondContact O-N 3.3Å; L97-Q99 PolarHBondContact O-N 3.03Å; L97-Q99 VanDerWaalsContact O-N 3.16Å; Q99-Y175 PolarHBondContact OE1-OH 3.29Å; Q99-K210 WeakPolarHBondContact O-CE 3.25Å; Q99-K210 PolarHBondContact O-NZ 3.26Å
100	Y	61.8	Low	59.9	Low	47 Å²	47	82.2 Å²	82.2	18%	0.184	43%	0.429	C	S	.	.	S	Bend	trans	-96.7	138.5	-174.6	-67.8	-68.2	0	0	0	112.1	R96 L97 V150 D153 S154 I157	R96-Y100 WeakPolarHBondContact O-CD2 3.46Å; L97-Y100 PolarHBondContact O-N 3.38Å; Y100-V150 HydrophobicContact CD1-CG1 3.87Å; Y100-V150 HydrophobicContact CE1-CG1 4.28Å; Y100-D153 HydrophobicContact CE1-CB 4.36Å; Y100-D153 WeakPolarHBondContact CE1-OD2 3.4Å; Y100-D153 PolarHBondContact OH-OD2 3.15Å; Y100-S154 WeakPolarHBondContact CB-OG 3.32Å; Y100-S154 WeakPolarHBondContact CD1-OG 3.46Å; Y100-I157 HydrophobicContact CD2-CD1 4.46Å; Y100-I157 HydrophobicContact CE1-CD1 4.5Å; Y100-I157 HydrophobicContact CE2-CD1 4.04Å
101	P	58.7	Low	59.2	Low	45 Å²	45	79.8 Å²	79.8	29%	0.292	43%	0.429	S	S	.	.			trans	-63.1	144.3	174	27.7	-33.6	0	0	0	111.3	I103 Y151 S154	P101-I103 PolarHBondContact O-N 2.63Å; P101-Y151 HydrophobicContact CG-CD2 4.02Å; P101-S154 WeakPolarHBondContact CD-OG 3.37Å
102	V	57.1	Low	58.7	Low	143 Å²	143	73.6 Å²	73.6	87%	0.867	42%	0.419	S	S	*	.			trans	-70.4	114.5	166.8	-179.1	0	0	0	0	107.2
103	I	56.1	Low	58.8	Low	10 Å²	10	79 Å²	79	5%	0.051	44%	0.439	C	S	.	.			trans	-81.1	129.1	179.6	-61.6	160.5	0	0	0	107.9	P101 V106 Y151 S154 A155 E158	P101-I103 PolarHBondContact O-N 2.63Å; I103-V106 HydrophobicContact CG2-CG2 4.06Å; I103-Y151 HydrophobicContact CB-CE2 4.34Å; I103-Y151 HydrophobicContact CG1-CD2 4.05Å; I103-Y151 HydrophobicContact CG1-CE2 3.67Å; I103-Y151 HydrophobicContact CG2-CE2 4.11Å; I103-S154 VanDerWaalsContact CD1-CB 3.43Å; I103-A155 HydrophobicContact CD1-CB 3.64Å; I103-E158 WeakPolarHBondContact CB-OE2 3.09Å
104	P	52.8	Low	58.9	Low	79 Å²	79	82.1 Å²	82.1	51%	0.513	45%	0.45	S	S	.	.			trans	-56.6	142.6	168	-18.8	30.1	0	0	0	108.6	V106	P104-V106 VanDerWaalsContact C-N 3.3Å; P104-V106 WeakPolarHBondContact O-CG2 3.21Å; P104-V106 PolarHBondContact O-N 2.86Å
105	K	53.5	Low	59.2	Low	198 Å²	198	81.3 Å²	81.3	86%	0.861	44%	0.441	S	S	*	.			trans	-58.2	89.4	178	-67.7	-180	179.4	179.1	0	111
106	V	52.7	Low	59.8	Low	21 Å²	21	79 Å²	79	13%	0.127	43%	0.425	C	S	.	.			trans	-84.3	123.7	-178.3	-167.5	0	0	0	0	108.6	I103 P104 L108 E303	I103-V106 HydrophobicContact CG2-CG2 4.06Å; P104-V106 VanDerWaalsContact C-N 3.3Å; P104-V106 WeakPolarHBondContact O-CG2 3.21Å; P104-V106 PolarHBondContact O-N 2.86Å; V106-L108 HydrophobicContact CB-CD1 3.63Å; V106-L108 HydrophobicContact CG1-CD1 3.45Å; V106-L108 VanDerWaalsContact CG1-CD1 3.45Å; V106-L108 HydrophobicContact CG1-CG 4.3Å; V106-L108 PolarHBondContact O-N 3.47Å; V106-E303 HydrophobicContact CG1-CG 4.02Å
107	S	56.1	Low	60.6	Low	95 Å²	95	76 Å²	76	66%	0.664	42%	0.42	S	S	*	.			trans	-87.7	69.2	178.7	48.8	0	0	0	0	111.9
108	L	58.6	Low	61.6	Low	1 Å²	1	71.2 Å²	71.2	1%	0.005	40%	0.395	C	S	.	.			trans	-64.3	135.3	-179	-77.4	83.2	0	0	0	112.4	V106 L110 R115 F159 C300 L304	V106-L108 HydrophobicContact CB-CD1 3.63Å; V106-L108 HydrophobicContact CG1-CD1 3.45Å; V106-L108 VanDerWaalsContact CG1-CD1 3.45Å; V106-L108 HydrophobicContact CG1-CG 4.3Å; V106-L108 PolarHBondContact O-N 3.47Å; L108-L110 VanDerWaalsContact C-N 3.27Å; L108-L110 PolarHBondContact O-N 3.23Å; L108-R115 PolarHBondContact O-NE 3.38Å; L108-R115 PolarHBondContact O-NH2 3.43Å; L108-F159 HydrophobicContact CD1-CE2 4.15Å; L108-F159 HydrophobicContact CD1-CZ 3.77Å; L108-C300 HydrophobicContact CD2-CB 4.43Å; L108-C300 WeakPolarHBondContact CD2-SG 3.41Å; L108-L304 HydrophobicContact CD1-CD2 3.85Å; L108-L304 HydrophobicContact CD1-CG 4.22Å; L108-L304 HydrophobicContact CD2-CD1 3.6Å; L108-L304 HydrophobicContact CD2-CD2 3.86Å; L108-L304 HydrophobicContact CD2-CG 3.52Å; L108-L304 HydrophobicContact CG-CD2 4.37Å; L108-L304 HydrophobicContact CG-CG 4.21Å
109	P	55.2	Low	62.5	Low	79 Å²	79	64 Å²	64	51%	0.513	36%	0.362	S	S	.	.	S	Bend	trans	-79.2	29	-170	28	-36.7	0	0	0	116.7	E303	P109-E303 WeakPolarHBondContact CD-OE2 3.35Å
110	L	58.8	Low	63.4	Low	20 Å²	20	60.4 Å²	60.4	11%	0.105	35%	0.345	C	S	.	.	S	Bend	trans	-118.1	161.6	179.4	-95.3	68.6	0	0	0	113.4	L108 L114 R115 V118 A296 C300	L108-L110 VanDerWaalsContact C-N 3.27Å; L108-L110 PolarHBondContact O-N 3.23Å; L110-L114 HydrophobicContact CD2-CB 4.24Å; L110-L114 HydrophobicContact CD2-CD2 3.66Å; L110-L114 HydrophobicContact CD2-CG 3.93Å; L110-L114 HydrophobicContact CG-CD2 4.05Å; L110-R115 HydrophobicContact CB-CG 3.59Å; L110-R115 PolarHBondContact O-NE 2.95Å; L110-R115 PolarHBondContact O-NH2 3.35Å; L110-V118 HydrophobicContact CD2-CG2 4.21Å; L110-A296 HydrophobicContact CD1-CB 4.49Å; L110-C300 HydrophobicContact CD1-CB 4.16Å; L110-C300 HydrophobicContact CD2-CB 4.41Å
111	G	61.4	Low	64.3	Low	50 Å²	50	61.7 Å²	61.7	52%	0.515	36%	0.359	S	S	.	.			trans	-66.1	148	169.6	0	0	0	0	0	112.1	Q113 L114 R115	G111-Q113 PolarHBondContact O-N 3.01Å; G111-L114 PolarHBondContact O-N 3.33Å; G111-R115 WeakPolarHBondContact O-CG 3.46Å; G111-R115 PolarHBondContact O-N 2.92Å
112	A	65.7	Low	65.4	Low	64 Å²	64	59.7 Å²	59.7	53%	0.529	35%	0.345	S	S	.	.	H	α-helix	trans	-51.5	-46.1	-171	0	0	0	0	0	114.3	R115 S116	A112-R115 WeakPolarHBondContact O-CB 3.24Å; A112-R115 PolarHBondContact O-N 2.83Å; A112-S116 PolarHBondContact O-N 3.26Å; A112-S116 VanDerWaalsContact O-N 3.09Å
113	Q	66.8	Low	66.6	Low	164 Å²	164	53 Å²	53	77%	0.766	31%	0.305	S	S	*	.	H	α-helix	trans	-68.4	-33.2	177.9	-73.2	157	-22.8	0	0	113.2	G111 S116 N117	G111-Q113 PolarHBondContact O-N 3.01Å; Q113-S116 WeakPolarHBondContact CA-OG 3.5Å; Q113-S116 PolarHBondContact O-OG 3.09Å; Q113-N117 VanDerWaalsContact O-CG 3.24Å; Q113-N117 PolarHBondContact O-N 2.95Å; Q113-N117 PolarHBondContact O-ND2 2.92Å
114	L	68.4	Low	67.7	Low	88 Å²	88	53.5 Å²	53.5	46%	0.461	31%	0.31	S	S	.	.	H	α-helix	trans	-74	-36.5	177.2	-156.4	72.7	0	0	0	110.3	L110 G111 N117 V118	L110-L114 HydrophobicContact CD2-CB 4.24Å; L110-L114 HydrophobicContact CD2-CD2 3.66Å; L110-L114 HydrophobicContact CD2-CG 3.93Å; L110-L114 HydrophobicContact CG-CD2 4.05Å; G111-L114 PolarHBondContact O-N 3.33Å; L114-N117 PolarHBondContact O-N 3.46Å; L114-V118 VanDerWaalsContact O-CG2 3.24Å; L114-V118 WeakPolarHBondContact O-CG2 3.46Å; L114-V118 PolarHBondContact O-N 2.85Å
115	R	70.6	Confident	69.2	Low	63 Å²	63	52.3 Å²	52.3	24%	0.238	30%	0.3	C	S	.	.	H	α-helix	trans	-58.9	-50.1	172.4	-66.3	179.3	-168.8	148.1	6	111.1	L108 L110 G111 A112 N117 V118 L119	L108-R115 PolarHBondContact O-NE 3.38Å; L108-R115 PolarHBondContact O-NH2 3.43Å; L110-R115 HydrophobicContact CB-CG 3.59Å; L110-R115 PolarHBondContact O-NE 2.95Å; L110-R115 PolarHBondContact O-NH2 3.35Å; G111-R115 WeakPolarHBondContact O-CG 3.46Å; G111-R115 PolarHBondContact O-N 2.92Å; A112-R115 WeakPolarHBondContact O-CB 3.24Å; A112-R115 PolarHBondContact O-N 2.83Å; R115-N117 VanDerWaalsContact C-N 3.3Å; R115-N117 PolarHBondContact O-N 3.33Å; R115-V118 PolarHBondContact O-N 3Å; R115-L119 WeakPolarHBondContact O-CB 3.4Å; R115-L119 VanDerWaalsContact O-CG 3.3Å; R115-L119 WeakPolarHBondContact O-CG 3.42Å; R115-L119 PolarHBondContact O-N 3.01Å
116	S	70.7	Confident	70.6	Confident	6 Å²	6	43 Å²	43	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-39.2	-179.4	60	0	0	0	0	112.3	A112 Q113 A120	A112-S116 PolarHBondContact O-N 3.26Å; A112-S116 VanDerWaalsContact O-N 3.09Å; Q113-S116 WeakPolarHBondContact CA-OG 3.5Å; Q113-S116 PolarHBondContact O-OG 3.09Å; S116-A120 WeakPolarHBondContact O-CB 3.34Å; S116-A120 PolarHBondContact O-N 3.03Å
117	N	75.8	Confident	72	Confident	86 Å²	86	42.2 Å²	42.2	46%	0.46	25%	0.254	S	S	.	.	H	α-helix	trans	-69.3	-41.7	178	-70.7	-10.9	0	0	0	112.5	Q113 L114 R115 A120 T121	Q113-N117 VanDerWaalsContact O-CG 3.24Å; Q113-N117 PolarHBondContact O-N 2.95Å; Q113-N117 PolarHBondContact O-ND2 2.92Å; L114-N117 PolarHBondContact O-N 3.46Å; R115-N117 VanDerWaalsContact C-N 3.3Å; R115-N117 PolarHBondContact O-N 3.33Å; N117-A120 PolarHBondContact O-N 3.4Å; N117-T121 WeakPolarHBondContact O-CB 3.38Å; N117-T121 WeakPolarHBondContact O-CG2 3.47Å; N117-T121 PolarHBondContact O-N 3.07Å; N117-T121 PolarHBondContact O-OG1 2.95Å
118	V	78.2	Confident	73.3	Confident	6 Å²	6	42.2 Å²	42.2	4%	0.036	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-43.3	176.7	172.6	0	0	0	0	110.8	L110 L114 R115 T121 F122 H297	L110-V118 HydrophobicContact CD2-CG2 4.21Å; L114-V118 VanDerWaalsContact O-CG2 3.24Å; L114-V118 WeakPolarHBondContact O-CG2 3.46Å; L114-V118 PolarHBondContact O-N 2.85Å; R115-V118 PolarHBondContact O-N 3Å; V118-T121 WeakPolarHBondContact CA-OG1 3.46Å; V118-T121 PolarHBondContact O-OG1 3.38Å; V118-F122 VanDerWaalsContact O-CB 3.25Å; V118-F122 WeakPolarHBondContact O-CB 3.43Å; V118-F122 PolarHBondContact O-N 2.59Å; V118-H297 HydrophobicContact CG1-CB 4.23Å; V118-H297 VanDerWaalsContact CG2-CD2 3.45Å; V118-H297 WeakPolarHBondContact CG2-CD2 3.4Å
119	L	77.3	Confident	74.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-40.8	177.4	-74.1	176	0	0	0	112.4	R115 F122 L123 V152 A155 L156 F159 L304	R115-L119 WeakPolarHBondContact O-CB 3.4Å; R115-L119 VanDerWaalsContact O-CG 3.3Å; R115-L119 WeakPolarHBondContact O-CG 3.42Å; R115-L119 PolarHBondContact O-N 3.01Å; L119-F122 PolarHBondContact O-N 2.95Å; L119-L123 WeakPolarHBondContact O-CB 3.36Å; L119-L123 PolarHBondContact O-N 2.93Å; L119-V152 HydrophobicContact CD2-CG1 4.24Å; L119-A155 HydrophobicContact CD1-CB 4.39Å; L119-L156 HydrophobicContact CB-CD1 4.2Å; L119-L156 HydrophobicContact CB-CD2 3.27Å; L119-L156 HydrophobicContact CB-CG 3.65Å; L119-L156 HydrophobicContact CD1-CD2 3.98Å; L119-L156 HydrophobicContact CD1-CG 4.25Å; L119-L156 HydrophobicContact CG-CD2 4.28Å; L119-F159 HydrophobicContact CD1-CD2 3.78Å; L119-F159 HydrophobicContact CD1-CE2 4.22Å; L119-L304 HydrophobicContact CD2-CD1 3.26Å; L119-L304 HydrophobicContact CD2-CD2 4.44Å; L119-L304 HydrophobicContact CD2-CG 4.47Å; L119-L304 HydrophobicContact CG-CD1 4.4Å
120	A	75.1	Confident	75.7	Confident	3 Å²	3	40.5 Å²	40.5	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-68.7	-37.9	179.3	0	0	0	0	0	112.3	S116 N117 A124 L156 V167	S116-A120 WeakPolarHBondContact O-CB 3.34Å; S116-A120 PolarHBondContact O-N 3.03Å; N117-A120 PolarHBondContact O-N 3.4Å; A120-A124 PolarHBondContact O-N 3.01Å; A120-A124 VanDerWaalsContact O-N 3.12Å; A120-L156 HydrophobicContact CB-CD2 4.48Å; A120-V167 HydrophobicContact CB-CG1 4.49Å; A120-V167 HydrophobicContact CB-CG2 4.47Å
121	T	80.8	Confident	76.7	Confident	75 Å²	75	42.5 Å²	42.5	46%	0.46	25%	0.248	S	C	.	.	H	α-helix	trans	-67.2	-43.5	172.4	46.2	0	0	0	0	111	N117 V118 L123 A124 D125	N117-T121 WeakPolarHBondContact O-CB 3.38Å; N117-T121 WeakPolarHBondContact O-CG2 3.47Å; N117-T121 PolarHBondContact O-N 3.07Å; N117-T121 PolarHBondContact O-OG1 2.95Å; V118-T121 WeakPolarHBondContact CA-OG1 3.46Å; V118-T121 PolarHBondContact O-OG1 3.38Å; T121-L123 VanDerWaalsContact C-N 3.34Å; T121-L123 PolarHBondContact O-N 2.99Å; T121-A124 PolarHBondContact O-N 3.48Å; T121-D125 VanDerWaalsContact O-CG 3.32Å; T121-D125 PolarHBondContact O-N 3.21Å
122	F	82.8	Confident	77.6	Confident	3 Å²	3	43.1 Å²	43.1	1%	0.013	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-40.3	175.2	-174.9	-134	0	0	0	112.8	V118 L119 D125 L126 L148 V152 Y289 L301	V118-F122 VanDerWaalsContact O-CB 3.25Å; V118-F122 WeakPolarHBondContact O-CB 3.43Å; V118-F122 PolarHBondContact O-N 2.59Å; L119-F122 PolarHBondContact O-N 2.95Å; F122-D125 PolarHBondContact O-N 3.49Å; F122-L126 HydrophobicContact CD1-CD1 3.82Å; F122-L126 HydrophobicContact CD1-CG 4.49Å; F122-L126 HydrophobicContact CD2-CD1 4.35Å; F122-L126 HydrophobicContact CD2-CG 4.14Å; F122-L126 HydrophobicContact CE1-CD1 3.62Å; F122-L126 HydrophobicContact CE1-CG 4.27Å; F122-L126 HydrophobicContact CE2-CD1 4.18Å; F122-L126 HydrophobicContact CE2-CD2 4.09Å; F122-L126 HydrophobicContact CE2-CG 3.91Å; F122-L126 HydrophobicContact CG-CD1 4.2Å; F122-L126 HydrophobicContact CG-CG 4.45Å; F122-L126 HydrophobicContact CZ-CD1 3.84Å; F122-L126 HydrophobicContact CZ-CD2 4Å; F122-L126 HydrophobicContact CZ-CG 4Å; F122-L126 WeakPolarHBondContact O-CB 3.45Å; F122-L126 VanDerWaalsContact O-CG 3.25Å; F122-L126 WeakPolarHBondContact O-CG 3.3Å; F122-L126 PolarHBondContact O-N 3.31Å; F122-L148 HydrophobicContact CE1-CD2 4.11Å; F122-L148 HydrophobicContact CE1-CG 4.49Å; F122-L148 HydrophobicContact CZ-CD2 3.86Å; F122-V152 HydrophobicContact CD1-CG1 4.26Å; F122-V152 HydrophobicContact CD1-CG2 3.73Å; F122-V152 HydrophobicContact CE1-CG2 3.75Å; F122-Y289 AromaticContact CD2-CD1 3.92Å; F122-Y289 HydrophobicContact CD2-CD1 3.92Å; F122-Y289 AromaticContact CD2-CE1 3.25Å; F122-Y289 HydrophobicContact CD2-CE1 3.25Å; F122-Y289 AromaticContact CD2-CZ 3.65Å; F122-Y289 AromaticContact CE2-CD1 3.66Å; F122-Y289 HydrophobicContact CE2-CD1 3.66Å; F122-Y289 AromaticContact CE2-CE1 3.51Å; F122-Y289 HydrophobicContact CE2-CE1 3.51Å; F122-Y289 HydrophobicContact CG-CE1 4.35Å; F122-L301 HydrophobicContact CB-CD2 4.09Å; F122-L301 HydrophobicContact CD1-CD2 3.43Å; F122-L301 VanDerWaalsContact CD1-CD2 3.43Å; F122-L301 HydrophobicContact CD2-CD2 4.1Å; F122-L301 HydrophobicContact CE1-CD2 3.73Å; F122-L301 HydrophobicContact CE2-CD2 4.36Å; F122-L301 HydrophobicContact CG-CD2 3.61Å; F122-L301 HydrophobicContact CZ-CD2 4.18Å
123	L	80.9	Confident	78	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-41.7	175.8	-175.5	61	0	0	0	111.9	L119 T121 L126 C127 A149 V152 D153 L156 V167 W171	L119-L123 WeakPolarHBondContact O-CB 3.36Å; L119-L123 PolarHBondContact O-N 2.93Å; T121-L123 VanDerWaalsContact C-N 3.34Å; T121-L123 PolarHBondContact O-N 2.99Å; L123-L126 PolarHBondContact O-N 3.49Å; L123-C127 PolarHBondContact O-N 3.42Å; L123-C127 PolarHBondContact O-SG 3.34Å; L123-A149 HydrophobicContact CD1-CB 4.02Å; L123-V152 HydrophobicContact CB-CG1 3.94Å; L123-V152 HydrophobicContact CD1-CG1 4.28Å; L123-D153 HydrophobicContact CD1-CB 4.5Å; L123-D153 HydrophobicContact CD2-CB 4.15Å; L123-L156 HydrophobicContact CB-CD1 4.29Å; L123-L156 HydrophobicContact CD2-CD1 3.82Å; L123-V167 HydrophobicContact CB-CG1 4.27Å; L123-V167 HydrophobicContact CD2-CG1 3.96Å; L123-V167 HydrophobicContact CG-CG1 4.28Å; L123-W171 HydrophobicContact CD1-CD2 4.32Å; L123-W171 HydrophobicContact CD1-CE3 4.1Å; L123-W171 HydrophobicContact CD2-CB 4.12Å; L123-W171 HydrophobicContact CD2-CG 4.24Å
124	A	79.7	Confident	78.3	Confident	20 Å²	20	35 Å²	35	17%	0.165	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-45.6	175.2	0	0	0	0	0	111.3	A120 T121 L126 C127 D128	A120-A124 PolarHBondContact O-N 3.01Å; A120-A124 VanDerWaalsContact O-N 3.12Å; T121-A124 PolarHBondContact O-N 3.48Å; A124-L126 VanDerWaalsContact C-N 3.34Å; A124-L126 PolarHBondContact O-N 3.45Å; A124-C127 WeakPolarHBondContact O-CB 3.38Å; A124-C127 PolarHBondContact O-N 2.83Å; A124-C127 VanDerWaalsContact O-N 3.15Å; A124-D128 PolarHBondContact O-N 3.48Å
125	D	83.6	Confident	78.6	Confident	55 Å²	55	36.7 Å²	36.7	29%	0.294	22%	0.218	S	C	.	.	H	α-helix	trans	-66.4	-35.4	177.9	-64.1	-30.7	0	0	0	112.1	T121 F122 C127 D128 M129 Y289	T121-D125 VanDerWaalsContact O-CG 3.32Å; T121-D125 PolarHBondContact O-N 3.21Å; F122-D125 PolarHBondContact O-N 3.49Å; D125-C127 VanDerWaalsContact C-N 3.34Å; D125-D128 PolarHBondContact O-N 3.24Å; D125-M129 WeakPolarHBondContact O-CB 3.3Å; D125-M129 WeakPolarHBondContact O-CG 3.35Å; D125-M129 PolarHBondContact O-N 2.87Å; D125-Y289 HydrophobicContact CB-CD2 4.45Å; D125-Y289 HydrophobicContact CB-CE2 3.59Å; D125-Y289 WeakPolarHBondContact OD2-CE2 3.26Å; D125-Y289 VanDerWaalsContact OD2-CZ 3.25Å; D125-Y289 PolarHBondContact OD2-OH 3.44Å
126	L	83.6	Confident	78.5	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-40.4	171.9	-77.1	169.3	0	0	0	111.6	F122 L123 A124 D128 M129 F130 L145 L148 A149 V152 I286	F122-L126 HydrophobicContact CD1-CD1 3.82Å; F122-L126 HydrophobicContact CD1-CG 4.49Å; F122-L126 HydrophobicContact CD2-CD1 4.35Å; F122-L126 HydrophobicContact CD2-CG 4.14Å; F122-L126 HydrophobicContact CE1-CD1 3.62Å; F122-L126 HydrophobicContact CE1-CG 4.27Å; F122-L126 HydrophobicContact CE2-CD1 4.18Å; F122-L126 HydrophobicContact CE2-CD2 4.09Å; F122-L126 HydrophobicContact CE2-CG 3.91Å; F122-L126 HydrophobicContact CG-CD1 4.2Å; F122-L126 HydrophobicContact CG-CG 4.45Å; F122-L126 HydrophobicContact CZ-CD1 3.84Å; F122-L126 HydrophobicContact CZ-CD2 4Å; F122-L126 HydrophobicContact CZ-CG 4Å; F122-L126 WeakPolarHBondContact O-CB 3.45Å; F122-L126 VanDerWaalsContact O-CG 3.25Å; F122-L126 WeakPolarHBondContact O-CG 3.3Å; F122-L126 PolarHBondContact O-N 3.31Å; L123-L126 PolarHBondContact O-N 3.49Å; A124-L126 VanDerWaalsContact C-N 3.34Å; A124-L126 PolarHBondContact O-N 3.45Å; L126-D128 VanDerWaalsContact C-N 3.32Å; L126-M129 HydrophobicContact CD2-CE 3.71Å; L126-M129 HydrophobicContact CG-CE 4.21Å; L126-M129 PolarHBondContact O-N 3.05Å; L126-F130 WeakPolarHBondContact O-CB 3.34Å; L126-F130 PolarHBondContact O-N 3.23Å; L126-L145 HydrophobicContact CD2-CD2 3.91Å; L126-L148 HydrophobicContact CD1-CD2 4.21Å; L126-L148 HydrophobicContact CD1-CG 4.12Å; L126-L148 HydrophobicContact CD2-CD2 3.81Å; L126-L148 HydrophobicContact CD2-CG 4.42Å; L126-A149 HydrophobicContact CB-CB 4.43Å; L126-A149 HydrophobicContact CD1-CB 4.39Å; L126-V152 HydrophobicContact CD1-CB 4.42Å; L126-V152 HydrophobicContact CD1-CG2 4.01Å; L126-I286 HydrophobicContact CD2-CD1 3.75Å
127	C	82.9	Confident	78.3	Confident	4 Å²	4	43.6 Å²	43.6	3%	0.027	27%	0.266	C	S	.	.	H	α-helix	trans	-62.9	-40.7	174.5	-69.1	0	0	0	0	111.3	L123 A124 D125 F130 S131 I170 V174	L123-C127 PolarHBondContact O-N 3.42Å; L123-C127 PolarHBondContact O-SG 3.34Å; A124-C127 WeakPolarHBondContact O-CB 3.38Å; A124-C127 PolarHBondContact O-N 2.83Å; A124-C127 VanDerWaalsContact O-N 3.15Å; D125-C127 VanDerWaalsContact C-N 3.34Å; C127-F130 PolarHBondContact O-N 3.22Å; C127-S131 WeakPolarHBondContact O-CB 3.45Å; C127-S131 PolarHBondContact O-N 3.12Å; C127-I170 HydrophobicContact CB-CG2 3.73Å; C127-V174 HydrophobicContact CB-CG2 3.83Å
128	D	82.5	Confident	78.4	Confident	96 Å²	96	42.2 Å²	42.2	51%	0.513	26%	0.258	S	S	.	.	H	α-helix	trans	-67.1	-46.3	176.9	-72	-19.8	0	0	0	111.4	A124 D125 L126 F130 S131 A132	A124-D128 PolarHBondContact O-N 3.48Å; D125-D128 PolarHBondContact O-N 3.24Å; L126-D128 VanDerWaalsContact C-N 3.32Å; D128-F130 VanDerWaalsContact C-N 3.33Å; D128-F130 PolarHBondContact O-N 3.08Å; D128-S131 PolarHBondContact O-N 2.99Å; D128-S131 PolarHBondContact O-OG 3.06Å; D128-A132 WeakPolarHBondContact O-CB 3.35Å; D128-A132 PolarHBondContact O-N 3.26Å
129	M	83.7	Confident	78.5	Confident	36 Å²	36	43.8 Å²	43.8	18%	0.177	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-43	174.3	-73.6	-173.8	-68.2	0	0	111.8	D125 L126 A132 L133 E285 I286	D125-M129 WeakPolarHBondContact O-CB 3.3Å; D125-M129 WeakPolarHBondContact O-CG 3.35Å; D125-M129 PolarHBondContact O-N 2.87Å; L126-M129 HydrophobicContact CD2-CE 3.71Å; L126-M129 HydrophobicContact CG-CE 4.21Å; L126-M129 PolarHBondContact O-N 3.05Å; M129-A132 PolarHBondContact O-N 2.8Å; M129-L133 WeakPolarHBondContact O-CB 3.49Å; M129-L133 WeakPolarHBondContact O-CG 3.26Å; M129-L133 PolarHBondContact O-N 2.95Å; M129-E285 HydrophobicContact SD-CB 4.18Å; M129-I286 HydrophobicContact CE-CD1 3.55Å; M129-I286 HydrophobicContact SD-CD1 4.13Å
130	F	80.6	Confident	78.7	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.035	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-44.7	175.4	-178.1	-98	0	0	0	111.5	L126 C127 D128 A132 L133 S134 L142 F146 V174 L181	L126-F130 WeakPolarHBondContact O-CB 3.34Å; L126-F130 PolarHBondContact O-N 3.23Å; C127-F130 PolarHBondContact O-N 3.22Å; D128-F130 VanDerWaalsContact C-N 3.33Å; D128-F130 PolarHBondContact O-N 3.08Å; F130-A132 VanDerWaalsContact C-N 3.34Å; F130-A132 PolarHBondContact O-N 3.02Å; F130-L133 PolarHBondContact O-N 3.42Å; F130-S134 WeakPolarHBondContact O-CB 3.42Å; F130-S134 PolarHBondContact O-N 3.12Å; F130-L142 HydrophobicContact CD2-CD2 3.89Å; F130-L142 HydrophobicContact CE2-CD2 3.99Å; F130-F146 HydrophobicContact CD2-CB 4.45Å; F130-F146 HydrophobicContact CE2-CB 3.95Å; F130-F146 HydrophobicContact CE2-CD2 4Å; F130-F146 HydrophobicContact CE2-CG 4.44Å; F130-F146 AromaticContact CZ-CD2 3.97Å; F130-F146 HydrophobicContact CZ-CD2 3.97Å; F130-V174 HydrophobicContact CD1-CG1 3.66Å; F130-V174 HydrophobicContact CE1-CG1 3.89Å; F130-V174 HydrophobicContact CG-CG1 4.36Å; F130-L181 HydrophobicContact CE1-CD1 3.57Å; F130-L181 HydrophobicContact CZ-CD1 3.41Å; F130-L181 VanDerWaalsContact CZ-CD1 3.41Å; F130-L181 HydrophobicContact CZ-CD2 4.34Å; F130-L181 HydrophobicContact CZ-CG 4.47Å
131	S	78.9	Confident	79	Confident	61 Å²	61	45 Å²	45	43%	0.427	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-39.1	177.4	78.2	0	0	0	0	112.2	C127 D128 S134	C127-S131 WeakPolarHBondContact O-CB 3.45Å; C127-S131 PolarHBondContact O-N 3.12Å; D128-S131 PolarHBondContact O-N 2.99Å; D128-S131 PolarHBondContact O-OG 3.06Å; S131-S134 PolarHBondContact O-OG 3.27Å
132	A	80.3	Confident	79.1	Confident	64 Å²	64	41.5 Å²	41.5	53%	0.529	25%	0.25	S	C	.	.	H	α-helix	trans	-69.1	-45.5	177.8	0	0	0	0	0	112.2	D128 M129 F130 S134 V135	D128-A132 WeakPolarHBondContact O-CB 3.35Å; D128-A132 PolarHBondContact O-N 3.26Å; M129-A132 PolarHBondContact O-N 2.8Å; F130-A132 VanDerWaalsContact C-N 3.34Å; F130-A132 PolarHBondContact O-N 3.02Å; A132-S134 VanDerWaalsContact C-N 3.29Å; A132-S134 PolarHBondContact O-N 2.91Å; A132-V135 WeakPolarHBondContact O-CB 3.48Å; A132-V135 PolarHBondContact O-N 2.69Å
133	L	75.5	Confident	79.1	Confident	17 Å²	17	41.3 Å²	41.3	9%	0.089	25%	0.249	C	C	.	.	H	α-helix	trans	-71.2	-24.2	178	-75.8	167.5	0	0	0	112.6	M129 F130 V135 Q136 T141 L142 L145 E285	M129-L133 WeakPolarHBondContact O-CB 3.49Å; M129-L133 WeakPolarHBondContact O-CG 3.26Å; M129-L133 PolarHBondContact O-N 2.95Å; F130-L133 PolarHBondContact O-N 3.42Å; L133-V135 PolarHBondContact O-N 2.89Å; L133-Q136 CarbonylContact O-C 3.6Å; L133-Q136 PolarHBondContact O-N 2.67Å; L133-T141 HydrophobicContact CD1-CG2 3.86Å; L133-L142 HydrophobicContact CB-CD2 3.64Å; L133-L142 HydrophobicContact CB-CG 4.27Å; L133-L145 HydrophobicContact CD1-CD1 3.19Å; L133-E285 HydrophobicContact CD1-CG 4.21Å
134	S	73.3	Confident	79.2	Confident	39 Å²	39	41.8 Å²	41.8	27%	0.273	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-9.3	175.8	77.8	0	0	0	0	113.7	F130 S131 A132	F130-S134 WeakPolarHBondContact O-CB 3.42Å; F130-S134 PolarHBondContact O-N 3.12Å; S131-S134 PolarHBondContact O-OG 3.27Å; A132-S134 VanDerWaalsContact C-N 3.29Å; A132-S134 PolarHBondContact O-N 2.91Å
135	V	73.2	Confident	79.3	Confident	124 Å²	124	40.9 Å²	40.9	75%	0.752	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-24.4	173.6	-174.1	0	0	0	0	112.3	A132 L133	A132-V135 WeakPolarHBondContact O-CB 3.48Å; A132-V135 PolarHBondContact O-N 2.69Å; L133-V135 PolarHBondContact O-N 2.89Å
136	Q	69.1	Low	79.2	Confident	138 Å²	138	38.4 Å²	38.4	65%	0.645	23%	0.23	S	C	*	.	S	Bend	trans	-109.5	148.5	-178.7	-64.9	-175.8	-3.5	0	0	111.3	L133 D138	L133-Q136 CarbonylContact O-C 3.6Å; L133-Q136 PolarHBondContact O-N 2.67Å; Q136-D138 VanDerWaalsContact C-N 3.27Å; Q136-D138 PolarHBondContact O-N 3.42Å
137	A	66.2	Low	79.1	Confident	77 Å²	77	39 Å²	39	64%	0.636	24%	0.235	S	C	*	.	S	Bend	trans	-81.4	24.6	-164.1	0	0	0	0	0	116.3	W139	A137-W139 PolarHBondContact O-N 3.32Å
138	D	78.7	Confident	79.1	Confident	56 Å²	56	38.9 Å²	38.9	30%	0.299	23%	0.234	S	C	.	.			trans	-87.5	90	175.4	-172.4	-11.1	0	0	0	111.1	Q136 A140 T141 L142	Q136-D138 VanDerWaalsContact C-N 3.27Å; Q136-D138 PolarHBondContact O-N 3.42Å; D138-A140 PolarHBondContact OD1-N 3.15Å; D138-T141 VanDerWaalsContact CG-OG1 3.23Å; D138-T141 PolarHBondContact OD1-N 3.42Å; D138-T141 PolarHBondContact OD1-OG1 3.4Å; D138-T141 VanDerWaalsContact OD2-CB 3.28Å; D138-T141 WeakPolarHBondContact OD2-CB 3.34Å; D138-T141 PolarHBondContact OD2-OG1 2.91Å; D138-L142 VanDerWaalsContact O-CG 3.31Å; D138-L142 WeakPolarHBondContact O-CG 3.28Å; D138-L142 PolarHBondContact O-N 3.18Å
139	W	80.5	Confident	79.1	Confident	40 Å²	40	34.6 Å²	34.6	15%	0.152	21%	0.211	C	C	.	.	H	α-helix	trans	-67.9	-34.8	-178	-56.4	106.3	0	0	0	113	A137 L142 G143 C185 A188 Q200 M201 C204	A137-W139 PolarHBondContact O-N 3.32Å; W139-L142 HydrophobicContact CE3-CD1 4.2Å; W139-L142 PolarHBondContact O-N 3.23Å; W139-G143 PolarHBondContact O-N 3.5Å; W139-C185 WeakPolarHBondContact CZ3-SG 3.37Å; W139-A188 HydrophobicContact CH2-CB 4.22Å; W139-A188 HydrophobicContact CZ2-CB 3.75Å; W139-Q200 HydrophobicContact CB-CB 4.18Å; W139-M201 HydrophobicContact CB-CG 4.1Å; W139-M201 HydrophobicContact CD2-CG 3.93Å; W139-M201 HydrophobicContact CG-CB 4.44Å; W139-M201 HydrophobicContact CG-CG 3.5Å; W139-M201 VanDerWaalsContact CG-CG 3.5Å; W139-C204 HydrophobicContact CB-CB 4.16Å; W139-C204 VanDerWaalsContact O-CB 3.26Å; W139-C204 WeakPolarHBondContact O-CB 3.46Å; W139-C204 PolarHBondContact O-SG 2.86Å; W139-C204 VanDerWaalsContact O-SG 3.38Å
140	A	80.8	Confident	78.9	Confident	11 Å²	11	33.4 Å²	33.4	9%	0.091	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-48.2	-179	0	0	0	0	0	111	D138 L142 G143 W144 Q200 F278	D138-A140 PolarHBondContact OD1-N 3.15Å; A140-L142 VanDerWaalsContact C-N 3.33Å; A140-L142 PolarHBondContact O-N 2.94Å; A140-G143 PolarHBondContact O-N 2.92Å; A140-W144 WeakPolarHBondContact O-CB 3.21Å; A140-W144 PolarHBondContact O-N 3.37Å; A140-Q200 HydrophobicContact CB-CB 3.85Å; A140-Q200 HydrophobicContact CB-CG 3.7Å; A140-F278 HydrophobicContact CB-CE1 3.8Å; A140-F278 HydrophobicContact CB-CZ 3.79Å
141	T	82.3	Confident	78.7	Confident	16 Å²	16	33.5 Å²	33.5	10%	0.098	21%	0.206	C	C	.	.	H	α-helix	trans	-64.4	-39.3	177.1	-61.7	0	0	0	0	111.4	L133 D138 G143 W144 L145 P283	L133-T141 HydrophobicContact CD1-CG2 3.86Å; D138-T141 VanDerWaalsContact CG-OG1 3.23Å; D138-T141 PolarHBondContact OD1-N 3.42Å; D138-T141 PolarHBondContact OD1-OG1 3.4Å; D138-T141 VanDerWaalsContact OD2-CB 3.28Å; D138-T141 WeakPolarHBondContact OD2-CB 3.34Å; D138-T141 PolarHBondContact OD2-OG1 2.91Å; T141-G143 PolarHBondContact O-N 3.38Å; T141-W144 PolarHBondContact O-N 3.05Å; T141-L145 HydrophobicContact CG2-CD1 3.92Å; T141-L145 HydrophobicContact CG2-CG 4.2Å; T141-L145 WeakPolarHBondContact O-CB 3.47Å; T141-L145 VanDerWaalsContact O-CG 3.26Å; T141-L145 WeakPolarHBondContact O-CG 3.35Å; T141-L145 PolarHBondContact O-N 3.27Å; T141-P283 HydrophobicContact CG2-CB 3.81Å; T141-P283 HydrophobicContact CG2-CG 4.18Å
142	L	82.3	Confident	78.7	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-47.5	174.6	-79.4	172.9	0	0	0	112.9	F130 L133 D138 W139 A140 L145 F146	F130-L142 HydrophobicContact CD2-CD2 3.89Å; F130-L142 HydrophobicContact CE2-CD2 3.99Å; L133-L142 HydrophobicContact CB-CD2 3.64Å; L133-L142 HydrophobicContact CB-CG 4.27Å; D138-L142 VanDerWaalsContact O-CG 3.31Å; D138-L142 WeakPolarHBondContact O-CG 3.28Å; D138-L142 PolarHBondContact O-N 3.18Å; W139-L142 HydrophobicContact CE3-CD1 4.2Å; W139-L142 PolarHBondContact O-N 3.23Å; A140-L142 VanDerWaalsContact C-N 3.33Å; A140-L142 PolarHBondContact O-N 2.94Å; L142-L145 PolarHBondContact O-N 3.18Å; L142-F146 WeakPolarHBondContact O-CB 3.41Å; L142-F146 PolarHBondContact O-N 2.91Å
143	G	82	Confident	78.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-42.7	177.3	0	0	0	0	0	112.2	W139 A140 T141 F146 S147 L207	W139-G143 PolarHBondContact O-N 3.5Å; A140-G143 PolarHBondContact O-N 2.92Å; T141-G143 PolarHBondContact O-N 3.38Å; G143-F146 PolarHBondContact O-N 3.42Å; G143-S147 WeakPolarHBondContact O-CB 3.46Å; G143-S147 PolarHBondContact O-N 3.23Å; G143-L207 VanDerWaalsContact C-CD1 3.43Å
144	W	83.4	Confident	78.4	Confident	11 Å²	11	27.8 Å²	27.8	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-64.1	-46	178.8	-168.8	100.7	0	0	0	111.6	A140 T141 F146 S147 L148 F278 P283 I286 L305 F308	A140-W144 WeakPolarHBondContact O-CB 3.21Å; A140-W144 PolarHBondContact O-N 3.37Å; T141-W144 PolarHBondContact O-N 3.05Å; W144-F146 VanDerWaalsContact C-N 3.34Å; W144-F146 PolarHBondContact O-N 3.23Å; W144-S147 PolarHBondContact O-N 2.69Å; W144-L148 HydrophobicContact CE3-CB 4.28Å; W144-L148 HydrophobicContact CE3-CD2 4.4Å; W144-L148 HydrophobicContact CH2-CD2 3.74Å; W144-L148 HydrophobicContact CZ3-CB 4.01Å; W144-L148 HydrophobicContact CZ3-CD2 3.41Å; W144-L148 VanDerWaalsContact CZ3-CD2 3.41Å; W144-L148 HydrophobicContact CZ3-CG 4.27Å; W144-L148 WeakPolarHBondContact O-CB 3.35Å; W144-L148 PolarHBondContact O-N 3.16Å; W144-F278 HydrophobicContact CB-CD1 4.48Å; W144-F278 AromaticContact CD1-CD1 3.76Å; W144-F278 HydrophobicContact CG-CD1 4.48Å; W144-F278 PolarHBondContact NE1-O 3.07Å; W144-P283 HydrophobicContact CB-CG 4.41Å; W144-P283 HydrophobicContact CD2-CG 3.64Å; W144-P283 HydrophobicContact CE3-CG 3.51Å; W144-P283 HydrophobicContact CG-CG 4.06Å; W144-P283 HydrophobicContact CZ3-CG 4.01Å; W144-I286 HydrophobicContact CH2-CG1 4.26Å; W144-I286 HydrophobicContact CZ3-CG1 3.71Å; W144-L305 HydrophobicContact CH2-CD2 3.89Å; W144-L305 HydrophobicContact CZ2-CD2 4.49Å; W144-F308 HydrophobicContact CD2-CE1 4.34Å; W144-F308 AromaticContact CE2-CE1 3.8Å; W144-F308 HydrophobicContact CH2-CE1 4.45Å; W144-F308 HydrophobicContact CZ2-CD1 4.02Å; W144-F308 AromaticContact CZ2-CE1 3.88Å; W144-F308 HydrophobicContact CZ2-CE1 3.88Å; W144-F308 AromaticContact NE1-CE1 3.99Å
145	L	82.1	Confident	78.4	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-63.8	-39.4	177.2	-72.6	175.4	0	0	0	112.2	L126 L133 T141 L142 L148 A149 I286	L126-L145 HydrophobicContact CD2-CD2 3.91Å; L133-L145 HydrophobicContact CD1-CD1 3.19Å; T141-L145 HydrophobicContact CG2-CD1 3.92Å; T141-L145 HydrophobicContact CG2-CG 4.2Å; T141-L145 WeakPolarHBondContact O-CB 3.47Å; T141-L145 VanDerWaalsContact O-CG 3.26Å; T141-L145 WeakPolarHBondContact O-CG 3.35Å; T141-L145 PolarHBondContact O-N 3.27Å; L142-L145 PolarHBondContact O-N 3.18Å; L145-L148 PolarHBondContact O-N 3.26Å; L145-A149 WeakPolarHBondContact O-CB 3.13Å; L145-A149 PolarHBondContact O-N 3.17Å; L145-I286 HydrophobicContact CD2-CD1 3.45Å; L145-I286 VanDerWaalsContact CD2-CD1 3.45Å; L145-I286 HydrophobicContact CD2-CG1 3.79Å
146	F	82.3	Confident	78.5	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.009	12%	0.115	C	C	.	.	H	α-helix	trans	-63.5	-46.4	175	-172.4	-92	0	0	0	111.2	F130 L142 G143 W144 L148 A149 V150 W171 Y175 R178 M208	F130-F146 HydrophobicContact CD2-CB 4.45Å; F130-F146 HydrophobicContact CE2-CB 3.95Å; F130-F146 HydrophobicContact CE2-CD2 4Å; F130-F146 HydrophobicContact CE2-CG 4.44Å; F130-F146 AromaticContact CZ-CD2 3.97Å; F130-F146 HydrophobicContact CZ-CD2 3.97Å; L142-F146 WeakPolarHBondContact O-CB 3.41Å; L142-F146 PolarHBondContact O-N 2.91Å; G143-F146 PolarHBondContact O-N 3.42Å; W144-F146 VanDerWaalsContact C-N 3.34Å; W144-F146 PolarHBondContact O-N 3.23Å; F146-L148 VanDerWaalsContact C-N 3.31Å; F146-L148 PolarHBondContact O-N 3.12Å; F146-A149 PolarHBondContact O-N 3.33Å; F146-V150 HydrophobicContact CD1-CG2 4.02Å; F146-V150 HydrophobicContact CE1-CG2 3.7Å; F146-V150 HydrophobicContact CZ-CG2 4.24Å; F146-V150 WeakPolarHBondContact O-CG2 3.14Å; F146-V150 PolarHBondContact O-N 3.48Å; F146-W171 HydrophobicContact CE2-CH2 4.25Å; F146-W171 HydrophobicContact CZ-CH2 4.47Å; F146-Y175 HydrophobicContact CE2-CD2 4.46Å; F146-Y175 AromaticContact CZ-CD2 3.78Å; F146-Y175 HydrophobicContact CZ-CD2 3.78Å; F146-Y175 HydrophobicContact CZ-CE2 4.07Å; F146-R178 HydrophobicContact CE2-CB 4.28Å; F146-R178 HydrophobicContact CZ-CB 4.13Å; F146-R178 HydrophobicContact CZ-CG 4.2Å; F146-M208 HydrophobicContact CB-CG 4.33Å; F146-M208 HydrophobicContact CD1-CB 4.23Å; F146-M208 HydrophobicContact CD1-CG 3.77Å; F146-M208 HydrophobicContact CE1-CB 4.3Å; F146-M208 HydrophobicContact CE1-CG 4.21Å; F146-M208 HydrophobicContact CG-CG 3.97Å
147	S	80.5	Confident	78.5	Confident	16 Å²	16	17.3 Å²	17.3	11%	0.112	10%	0.103	C	C	.	.	H	α-helix	trans	-60.9	-40.4	176.4	-176.2	0	0	0	0	111.9	G143 W144 V150 Y151 F308	G143-S147 WeakPolarHBondContact O-CB 3.46Å; G143-S147 PolarHBondContact O-N 3.23Å; W144-S147 PolarHBondContact O-N 2.69Å; S147-V150 PolarHBondContact O-N 3.22Å; S147-Y151 PolarHBondContact O-N 3.16Å; S147-F308 WeakPolarHBondContact OG-CZ 3.49Å
148	L	82.6	Confident	78.6	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-64.5	-43.1	174.2	-179.8	63.5	0	0	0	111.8	F122 L126 W144 L145 F146 V150 Y151 V152 I286 L305 F308	F122-L148 HydrophobicContact CE1-CD2 4.11Å; F122-L148 HydrophobicContact CE1-CG 4.49Å; F122-L148 HydrophobicContact CZ-CD2 3.86Å; L126-L148 HydrophobicContact CD1-CD2 4.21Å; L126-L148 HydrophobicContact CD1-CG 4.12Å; L126-L148 HydrophobicContact CD2-CD2 3.81Å; L126-L148 HydrophobicContact CD2-CG 4.42Å; W144-L148 HydrophobicContact CE3-CB 4.28Å; W144-L148 HydrophobicContact CE3-CD2 4.4Å; W144-L148 HydrophobicContact CH2-CD2 3.74Å; W144-L148 HydrophobicContact CZ3-CB 4.01Å; W144-L148 HydrophobicContact CZ3-CD2 3.41Å; W144-L148 VanDerWaalsContact CZ3-CD2 3.41Å; W144-L148 HydrophobicContact CZ3-CG 4.27Å; W144-L148 WeakPolarHBondContact O-CB 3.35Å; W144-L148 PolarHBondContact O-N 3.16Å; L145-L148 PolarHBondContact O-N 3.26Å; F146-L148 VanDerWaalsContact C-N 3.31Å; F146-L148 PolarHBondContact O-N 3.12Å; L148-V150 VanDerWaalsContact C-N 3.33Å; L148-V150 PolarHBondContact O-N 2.93Å; L148-Y151 WeakPolarHBondContact O-CB 3.25Å; L148-Y151 PolarHBondContact O-N 3.41Å; L148-Y151 VanDerWaalsContact O-N 3.15Å; L148-V152 HydrophobicContact CD1-CG2 4.18Å; L148-V152 HydrophobicContact CG-CG2 4.3Å; L148-V152 WeakPolarHBondContact O-CB 3.3Å; L148-V152 VanDerWaalsContact O-CG2 3.32Å; L148-V152 WeakPolarHBondContact O-CG2 3.38Å; L148-V152 PolarHBondContact O-N 3.01Å; L148-I286 HydrophobicContact CD2-CD1 4.46Å; L148-L305 HydrophobicContact CD1-CD2 3.67Å; L148-L305 HydrophobicContact CD2-CD2 3.9Å; L148-L305 HydrophobicContact CG-CD2 4.47Å; L148-F308 HydrophobicContact CB-CE1 4.2Å; L148-F308 HydrophobicContact CB-CE2 4.49Å; L148-F308 HydrophobicContact CB-CZ 4.03Å; L148-F308 HydrophobicContact CD1-CD1 4.11Å; L148-F308 HydrophobicContact CD1-CD2 4.21Å; L148-F308 HydrophobicContact CD1-CE1 4.33Å; L148-F308 HydrophobicContact CD1-CE2 4.43Å; L148-F308 HydrophobicContact CD1-CG 4.03Å; L148-F308 HydrophobicContact CD1-CZ 4.48Å
149	A	82.3	Confident	78	Confident	5 Å²	5	17.6 Å²	17.6	4%	0.041	9%	0.089	C	C	.	.	H	α-helix	trans	-62.6	-40	177.4	0	0	0	0	0	111.7	L123 L126 L145 F146 Y151 V152 D153 W171	L123-A149 HydrophobicContact CD1-CB 4.02Å; L126-A149 HydrophobicContact CB-CB 4.43Å; L126-A149 HydrophobicContact CD1-CB 4.39Å; L145-A149 WeakPolarHBondContact O-CB 3.13Å; L145-A149 PolarHBondContact O-N 3.17Å; F146-A149 PolarHBondContact O-N 3.33Å; A149-Y151 PolarHBondContact O-N 3.38Å; A149-V152 PolarHBondContact O-N 3.28Å; A149-D153 WeakPolarHBondContact O-CB 3.36Å; A149-D153 PolarHBondContact O-N 2.89Å; A149-W171 HydrophobicContact CB-CE3 4.24Å; A149-W171 HydrophobicContact CB-CH2 3.69Å; A149-W171 HydrophobicContact CB-CZ3 3.39Å
150	V	79.9	Confident	77.1	Confident	11 Å²	11	24.1 Å²	24.1	7%	0.067	12%	0.121	C	C	.	.	H	α-helix	trans	-60.5	-43.9	171.6	174.6	0	0	0	0	110.9	Y100 F146 S147 L148 S154 W171	Y100-V150 HydrophobicContact CD1-CG1 3.87Å; Y100-V150 HydrophobicContact CE1-CG1 4.28Å; F146-V150 HydrophobicContact CD1-CG2 4.02Å; F146-V150 HydrophobicContact CE1-CG2 3.7Å; F146-V150 HydrophobicContact CZ-CG2 4.24Å; F146-V150 WeakPolarHBondContact O-CG2 3.14Å; F146-V150 PolarHBondContact O-N 3.48Å; S147-V150 PolarHBondContact O-N 3.22Å; L148-V150 VanDerWaalsContact C-N 3.33Å; L148-V150 PolarHBondContact O-N 2.93Å; V150-S154 WeakPolarHBondContact O-CB 3.37Å; V150-S154 PolarHBondContact O-N 3.48Å; V150-S154 PolarHBondContact O-OG 3.46Å; V150-W171 HydrophobicContact CB-CZ2 4.41Å; V150-W171 HydrophobicContact CG2-CH2 3.73Å; V150-W171 HydrophobicContact CG2-CZ2 3.79Å
151	Y	77.2	Confident	76.1	Confident	10 Å²	10	24.3 Å²	24.3	4%	0.039	12%	0.123	C	C	.	.	H	α-helix	trans	-64.8	-42.7	177.8	-177.7	-104.5	0	0	0	112.4	P101 I103 S147 L148 A149 S154 A155 L304 S307 F308	P101-Y151 HydrophobicContact CG-CD2 4.02Å; I103-Y151 HydrophobicContact CB-CE2 4.34Å; I103-Y151 HydrophobicContact CG1-CD2 4.05Å; I103-Y151 HydrophobicContact CG1-CE2 3.67Å; I103-Y151 HydrophobicContact CG2-CE2 4.11Å; S147-Y151 PolarHBondContact O-N 3.16Å; L148-Y151 WeakPolarHBondContact O-CB 3.25Å; L148-Y151 PolarHBondContact O-N 3.41Å; L148-Y151 VanDerWaalsContact O-N 3.15Å; A149-Y151 PolarHBondContact O-N 3.38Å; Y151-S154 WeakPolarHBondContact O-CB 3.18Å; Y151-S154 PolarHBondContact O-N 3.39Å; Y151-A155 PolarHBondContact O-N 2.91Å; Y151-L304 HydrophobicContact CE1-CD2 4.47Å; Y151-S307 WeakPolarHBondContact OH-CB 3.5Å; Y151-S307 PolarHBondContact OH-OG 3.31Å; Y151-F308 HydrophobicContact CD1-CB 4.21Å; Y151-F308 AromaticContact CD1-CD2 3.75Å; Y151-F308 HydrophobicContact CD1-CD2 3.75Å; Y151-F308 HydrophobicContact CD1-CG 4.36Å; Y151-F308 HydrophobicContact CD2-CD2 4.02Å; Y151-F308 HydrophobicContact CE1-CB 4.12Å; Y151-F308 HydrophobicContact CE1-CD2 4.37Å; Y151-F308 AromaticContact CG-CD2 3.55Å; Y151-F308 HydrophobicContact CG-CD2 3.55Å; Y151-F308 HydrophobicContact CG-CE2 4.13Å
152	V	78	Confident	75	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-43.1	177.6	168.7	0	0	0	0	111.5	L119 F122 L123 L126 L148 A149 S154 A155 L156	L119-V152 HydrophobicContact CD2-CG1 4.24Å; F122-V152 HydrophobicContact CD1-CG1 4.26Å; F122-V152 HydrophobicContact CD1-CG2 3.73Å; F122-V152 HydrophobicContact CE1-CG2 3.75Å; L123-V152 HydrophobicContact CB-CG1 3.94Å; L123-V152 HydrophobicContact CD1-CG1 4.28Å; L126-V152 HydrophobicContact CD1-CB 4.42Å; L126-V152 HydrophobicContact CD1-CG2 4.01Å; L148-V152 HydrophobicContact CD1-CG2 4.18Å; L148-V152 HydrophobicContact CG-CG2 4.3Å; L148-V152 WeakPolarHBondContact O-CB 3.3Å; L148-V152 VanDerWaalsContact O-CG2 3.32Å; L148-V152 WeakPolarHBondContact O-CG2 3.38Å; L148-V152 PolarHBondContact O-N 3.01Å; A149-V152 PolarHBondContact O-N 3.28Å; V152-S154 VanDerWaalsContact C-N 3.33Å; V152-A155 PolarHBondContact O-N 3.41Å; V152-L156 HydrophobicContact CG1-CD1 4.39Å; V152-L156 WeakPolarHBondContact O-CG 3.42Å; V152-L156 PolarHBondContact O-N 2.74Å
153	D	76.5	Confident	73.9	Confident	13 Å²	13	33 Å²	33	7%	0.07	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-40.8	174.7	-174.7	55.3	0	0	0	111.4	Y100 L123 A149 A155 L156 I157 W171	Y100-D153 HydrophobicContact CE1-CB 4.36Å; Y100-D153 WeakPolarHBondContact CE1-OD2 3.4Å; Y100-D153 PolarHBondContact OH-OD2 3.15Å; L123-D153 HydrophobicContact CD1-CB 4.5Å; L123-D153 HydrophobicContact CD2-CB 4.15Å; A149-D153 WeakPolarHBondContact O-CB 3.36Å; A149-D153 PolarHBondContact O-N 2.89Å; D153-A155 VanDerWaalsContact C-N 3.3Å; D153-A155 PolarHBondContact O-N 2.93Å; D153-L156 WeakPolarHBondContact O-CB 3.47Å; D153-L156 PolarHBondContact O-N 3.45Å; D153-I157 VanDerWaalsContact O-CG1 3.3Å; D153-I157 WeakPolarHBondContact O-CG1 3.4Å; D153-I157 PolarHBondContact O-N 2.8Å; D153-W171 HydrophobicContact CB-CZ2 4.38Å; D153-W171 VanDerWaalsContact OD2-CD1 3.32Å; D153-W171 PolarHBondContact OD2-NE1 3.25Å
154	S	72.9	Confident	73.1	Confident	8 Å²	8	36 Å²	36	6%	0.056	18%	0.183	C	C	.	.	H	α-helix	trans	-59	-43.1	173.5	-52.9	0	0	0	0	111.7	Y100 P101 I103 V150 Y151 V152 L156 I157 E158	Y100-S154 WeakPolarHBondContact CB-OG 3.32Å; Y100-S154 WeakPolarHBondContact CD1-OG 3.46Å; P101-S154 WeakPolarHBondContact CD-OG 3.37Å; I103-S154 VanDerWaalsContact CD1-CB 3.43Å; V150-S154 WeakPolarHBondContact O-CB 3.37Å; V150-S154 PolarHBondContact O-N 3.48Å; V150-S154 PolarHBondContact O-OG 3.46Å; Y151-S154 WeakPolarHBondContact O-CB 3.18Å; Y151-S154 PolarHBondContact O-N 3.39Å; V152-S154 VanDerWaalsContact C-N 3.33Å; S154-L156 VanDerWaalsContact C-N 3.35Å; S154-I157 PolarHBondContact O-N 3.27Å; S154-E158 PolarHBondContact O-N 2.84Å
155	A	74.3	Confident	72.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.2	-40.2	-179.4	0	0	0	0	0	110.8	I103 L119 Y151 V152 D153 I157 E158 F159	I103-A155 HydrophobicContact CD1-CB 3.64Å; L119-A155 HydrophobicContact CD1-CB 4.39Å; Y151-A155 PolarHBondContact O-N 2.91Å; V152-A155 PolarHBondContact O-N 3.41Å; D153-A155 VanDerWaalsContact C-N 3.3Å; D153-A155 PolarHBondContact O-N 2.93Å; A155-I157 VanDerWaalsContact C-N 3.31Å; A155-I157 PolarHBondContact O-N 3.44Å; A155-E158 PolarHBondContact O-N 2.66Å; A155-F159 HydrophobicContact CB-CD2 4.23Å; A155-F159 HydrophobicContact CB-CE2 4.02Å; A155-F159 WeakPolarHBondContact O-CB 3.5Å; A155-F159 WeakPolarHBondContact O-CD2 3.35Å; A155-F159 WeakPolarHBondContact O-CG 3.22Å; A155-F159 PolarHBondContact O-N 3.49Å
156	L	73.9	Confident	71.8	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-41.5	173.5	-80.6	170.9	0	0	0	112.7	L119 A120 L123 V152 D153 S154 T163	L119-L156 HydrophobicContact CB-CD1 4.2Å; L119-L156 HydrophobicContact CB-CD2 3.27Å; L119-L156 HydrophobicContact CB-CG 3.65Å; L119-L156 HydrophobicContact CD1-CD2 3.98Å; L119-L156 HydrophobicContact CD1-CG 4.25Å; L119-L156 HydrophobicContact CG-CD2 4.28Å; A120-L156 HydrophobicContact CB-CD2 4.48Å; L123-L156 HydrophobicContact CB-CD1 4.29Å; L123-L156 HydrophobicContact CD2-CD1 3.82Å; V152-L156 HydrophobicContact CG1-CD1 4.39Å; V152-L156 WeakPolarHBondContact O-CG 3.42Å; V152-L156 PolarHBondContact O-N 2.74Å; D153-L156 WeakPolarHBondContact O-CB 3.47Å; D153-L156 PolarHBondContact O-N 3.45Å; S154-L156 VanDerWaalsContact C-N 3.35Å; L156-T163 HydrophobicContact CB-CG2 4.11Å; L156-T163 HydrophobicContact CD1-CG2 4.13Å; L156-T163 HydrophobicContact CD2-CG2 3.81Å; L156-T163 HydrophobicContact CG-CG2 4.25Å
157	I	70.1	Confident	71.2	Confident	77 Å²	77	48.5 Å²	48.5	40%	0.395	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-44.6	177.3	-66.8	164.4	0	0	0	110.5	Y100 D153 S154 A155 H160	Y100-I157 HydrophobicContact CD2-CD1 4.46Å; Y100-I157 HydrophobicContact CE1-CD1 4.5Å; Y100-I157 HydrophobicContact CE2-CD1 4.04Å; D153-I157 VanDerWaalsContact O-CG1 3.3Å; D153-I157 WeakPolarHBondContact O-CG1 3.4Å; D153-I157 PolarHBondContact O-N 2.8Å; S154-I157 PolarHBondContact O-N 3.27Å; A155-I157 VanDerWaalsContact C-N 3.31Å; A155-I157 PolarHBondContact O-N 3.44Å; I157-H160 PolarHBondContact O-N 3.01Å
158	E	69	Low	70.8	Confident	86 Å²	86	54.4 Å²	54.4	40%	0.402	27%	0.269	S	S	.	.	H	α-helix	trans	-69.5	-38.1	-178.7	-167.8	179.6	179.5	0	0	113.1	I103 S154 A155 H160	I103-E158 WeakPolarHBondContact CB-OE2 3.09Å; S154-E158 PolarHBondContact O-N 2.84Å; A155-E158 PolarHBondContact O-N 2.66Å; E158-H160 PolarHBondContact O-N 3.2Å; E158-H160 VanDerWaalsContact O-N 3.1Å
159	F	66	Low	70.5	Confident	52 Å²	52	57 Å²	57	23%	0.228	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	4.5	-179.7	-69.9	-57.1	0	0	0	114.3	L108 L119 A155 G161	L108-F159 HydrophobicContact CD1-CE2 4.15Å; L108-F159 HydrophobicContact CD1-CZ 3.77Å; L119-F159 HydrophobicContact CD1-CD2 3.78Å; L119-F159 HydrophobicContact CD1-CE2 4.22Å; A155-F159 HydrophobicContact CB-CD2 4.23Å; A155-F159 HydrophobicContact CB-CE2 4.02Å; A155-F159 WeakPolarHBondContact O-CB 3.5Å; A155-F159 WeakPolarHBondContact O-CD2 3.35Å; A155-F159 WeakPolarHBondContact O-CG 3.22Å; A155-F159 PolarHBondContact O-N 3.49Å; F159-G161 PolarHBondContact O-N 3.39Å
160	H	60.1	Low	70.3	Confident	178 Å²	178	59.1 Å²	59.1	82%	0.824	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	29.3	178	-65.6	-60.5	0	0	0	114.6	I157 E158	I157-H160 PolarHBondContact O-N 3.01Å; E158-H160 PolarHBondContact O-N 3.2Å; E158-H160 VanDerWaalsContact O-N 3.1Å
161	G	60.2	Low	70.3	Confident	14 Å²	14	59 Å²	59	14%	0.144	29%	0.293	C	S	.	.			trans	-74.4	141	179.5	0	0	0	0	0	112.4	F159 T163	F159-G161 PolarHBondContact O-N 3.39Å; G161-T163 VanDerWaalsContact C-N 3.28Å; G161-T163 PolarHBondContact O-N 3.22Å
162	E	59.2	Low	70.3	Confident	186 Å²	186	66.2 Å²	66.2	87%	0.869	32%	0.32	S	S	*	.			trans	-65.1	91.7	162.7	-72.6	-173.6	172.3	0	0	108.8
163	T	59.2	Low	70.3	Confident	14 Å²	14	70.6 Å²	70.6	9%	0.086	34%	0.343	C	S	.	.			trans	-76.4	135.2	170.6	52.4	0	0	0	0	109	L156 G161 N165 R168	L156-T163 HydrophobicContact CB-CG2 4.11Å; L156-T163 HydrophobicContact CD1-CG2 4.13Å; L156-T163 HydrophobicContact CD2-CG2 3.81Å; L156-T163 HydrophobicContact CG-CG2 4.25Å; G161-T163 VanDerWaalsContact C-N 3.28Å; G161-T163 PolarHBondContact O-N 3.22Å; T163-N165 PolarHBondContact O-N 2.93Å; T163-R168 PolarHBondContact OG1-NE 3.33Å; T163-R168 PolarHBondContact OG1-NH2 3.48Å
164	P	64.9	Low	70.4	Confident	65 Å²	65	70.9 Å²	70.9	42%	0.422	35%	0.346	S	S	.	.			trans	-55.5	134.9	174.2	-18.2	27.6	0	0	0	110.8	M166 V167 R168	P164-M166 PolarHBondContact O-N 3.37Å; P164-V167 HydrophobicContact CB-CG2 4.19Å; P164-V167 HydrophobicContact CG-CG2 4.12Å; P164-V167 PolarHBondContact O-N 2.92Å; P164-R168 PolarHBondContact O-N 3.44Å
165	N	69.1	Low	70.7	Confident	125 Å²	125	72.8 Å²	72.8	67%	0.668	35%	0.352	S	S	*	.	H	α-helix	trans	-54.5	-29.3	177.6	-73.6	-15.6	0	0	0	112.6	T163 T169	T163-N165 PolarHBondContact O-N 2.93Å; N165-T169 PolarHBondContact O-N 2.86Å; N165-T169 PolarHBondContact O-OG1 2.81Å
166	M	70.2	Confident	71.1	Confident	133 Å²	133	75.7 Å²	75.7	66%	0.655	38%	0.376	S	S	*	.	H	α-helix	trans	-61.8	-47.5	176	-167	66.3	-179.4	0	0	112.1	P164 R168 T169 I170	P164-M166 PolarHBondContact O-N 3.37Å; M166-R168 PolarHBondContact O-N 3.37Å; M166-T169 WeakPolarHBondContact O-CB 3.47Å; M166-T169 PolarHBondContact O-N 3.42Å; M166-T169 VanDerWaalsContact O-N 3.09Å; M166-I170 HydrophobicContact CE-CD1 4.34Å; M166-I170 HydrophobicContact CG-CD1 4.04Å; M166-I170 WeakPolarHBondContact O-CG1 3.44Å; M166-I170 PolarHBondContact O-N 2.98Å
167	V	68.9	Low	71.4	Confident	18 Å²	18	76.9 Å²	76.9	11%	0.109	39%	0.385	C	S	.	.	H	α-helix	trans	-64.7	-41.4	-179.2	-179.5	0	0	0	0	110.7	A120 L123 P164 T169 I170 W171	A120-V167 HydrophobicContact CB-CG1 4.49Å; A120-V167 HydrophobicContact CB-CG2 4.47Å; L123-V167 HydrophobicContact CB-CG1 4.27Å; L123-V167 HydrophobicContact CD2-CG1 3.96Å; L123-V167 HydrophobicContact CG-CG1 4.28Å; P164-V167 HydrophobicContact CB-CG2 4.19Å; P164-V167 HydrophobicContact CG-CG2 4.12Å; P164-V167 PolarHBondContact O-N 2.92Å; V167-T169 VanDerWaalsContact C-N 3.25Å; V167-T169 PolarHBondContact O-N 3.46Å; V167-I170 PolarHBondContact O-N 3.26Å; V167-W171 WeakPolarHBondContact O-CB 3.31Å; V167-W171 PolarHBondContact O-N 3.28Å
168	R	72.7	Confident	71.9	Confident	141 Å²	141	75.6 Å²	75.6	53%	0.532	38%	0.375	S	S	.	.	H	α-helix	trans	-61.3	-35.2	173.7	-72.6	-172.3	178	161.7	7.1	112.6	T163 P164 M166 R172	T163-R168 PolarHBondContact OG1-NE 3.33Å; T163-R168 PolarHBondContact OG1-NH2 3.48Å; P164-R168 PolarHBondContact O-N 3.44Å; M166-R168 PolarHBondContact O-N 3.37Å; R168-R172 VanDerWaalsContact O-CB 3.23Å; R168-R172 WeakPolarHBondContact O-CB 3.3Å; R168-R172 PolarHBondContact O-N 2.91Å
169	T	76.2	Confident	72.3	Confident	54 Å²	54	74.7 Å²	74.7	33%	0.331	38%	0.377	S	S	.	.	H	α-helix	trans	-71	-46.8	178.4	-53.5	0	0	0	0	110.6	N165 M166 V167 W171 R172 D173	N165-T169 PolarHBondContact O-N 2.86Å; N165-T169 PolarHBondContact O-OG1 2.81Å; M166-T169 WeakPolarHBondContact O-CB 3.47Å; M166-T169 PolarHBondContact O-N 3.42Å; M166-T169 VanDerWaalsContact O-N 3.09Å; V167-T169 VanDerWaalsContact C-N 3.25Å; V167-T169 PolarHBondContact O-N 3.46Å; T169-W171 PolarHBondContact O-N 3.42Å; T169-R172 WeakPolarHBondContact O-CB 3.28Å; T169-R172 PolarHBondContact O-N 3.47Å; T169-D173 VanDerWaalsContact O-CG 3.25Å; T169-D173 PolarHBondContact O-N 2.94Å
170	I	77.8	Confident	73.1	Confident	50 Å²	50	79 Å²	79	26%	0.256	40%	0.396	S	S	.	.	H	α-helix	trans	-59.5	-48.7	176.7	-65.4	164.7	0	0	0	110.6	C127 M166 V167 R172 D173 V174	C127-I170 HydrophobicContact CB-CG2 3.73Å; M166-I170 HydrophobicContact CE-CD1 4.34Å; M166-I170 HydrophobicContact CG-CD1 4.04Å; M166-I170 WeakPolarHBondContact O-CG1 3.44Å; M166-I170 PolarHBondContact O-N 2.98Å; V167-I170 PolarHBondContact O-N 3.26Å; I170-R172 VanDerWaalsContact C-N 3.34Å; I170-R172 PolarHBondContact O-N 3.29Å; I170-D173 PolarHBondContact O-N 2.88Å; I170-D173 VanDerWaalsContact O-N 3.15Å; I170-V174 WeakPolarHBondContact O-CG2 3.5Å; I170-V174 PolarHBondContact O-N 3.06Å
171	W	80	Confident	74	Confident	9 Å²	9	71 Å²	71	3%	0.034	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-41.3	177.3	173.7	-122.7	0	0	0	112.1	L123 F146 A149 V150 D153 V167 T169 D173 V174 Y175	L123-W171 HydrophobicContact CD1-CD2 4.32Å; L123-W171 HydrophobicContact CD1-CE3 4.1Å; L123-W171 HydrophobicContact CD2-CB 4.12Å; L123-W171 HydrophobicContact CD2-CG 4.24Å; F146-W171 HydrophobicContact CE2-CH2 4.25Å; F146-W171 HydrophobicContact CZ-CH2 4.47Å; A149-W171 HydrophobicContact CB-CE3 4.24Å; A149-W171 HydrophobicContact CB-CH2 3.69Å; A149-W171 HydrophobicContact CB-CZ3 3.39Å; V150-W171 HydrophobicContact CB-CZ2 4.41Å; V150-W171 HydrophobicContact CG2-CH2 3.73Å; V150-W171 HydrophobicContact CG2-CZ2 3.79Å; D153-W171 HydrophobicContact CB-CZ2 4.38Å; D153-W171 VanDerWaalsContact OD2-CD1 3.32Å; D153-W171 PolarHBondContact OD2-NE1 3.25Å; V167-W171 WeakPolarHBondContact O-CB 3.31Å; V167-W171 PolarHBondContact O-N 3.28Å; T169-W171 PolarHBondContact O-N 3.42Å; W171-D173 PolarHBondContact O-N 2.84Å; W171-V174 HydrophobicContact CE3-CB 4.2Å; W171-V174 HydrophobicContact CE3-CG1 4.11Å; W171-V174 HydrophobicContact CZ3-CG1 3.96Å; W171-V174 PolarHBondContact O-N 3.45Å; W171-Y175 HydrophobicContact CH2-CD2 4.24Å; W171-Y175 AromaticContact CZ2-CD2 3.75Å; W171-Y175 HydrophobicContact CZ2-CD2 3.75Å; W171-Y175 HydrophobicContact CZ2-CG 4.48Å; W171-Y175 VanDerWaalsContact O-CB 3.24Å; W171-Y175 WeakPolarHBondContact O-CB 3.22Å; W171-Y175 PolarHBondContact O-N 3.38Å
172	R	78.1	Confident	74.9	Confident	161 Å²	161	71.3 Å²	71.3	61%	0.608	36%	0.358	S	S	*	.	H	α-helix	trans	-57.9	-40.2	175.1	-176.3	-175.8	68.7	-178.5	0.1	111.5	R168 T169 I170 A176	R168-R172 VanDerWaalsContact O-CB 3.23Å; R168-R172 WeakPolarHBondContact O-CB 3.3Å; R168-R172 PolarHBondContact O-N 2.91Å; T169-R172 WeakPolarHBondContact O-CB 3.28Å; T169-R172 PolarHBondContact O-N 3.47Å; I170-R172 VanDerWaalsContact C-N 3.34Å; I170-R172 PolarHBondContact O-N 3.29Å; R172-A176 VanDerWaalsContact O-CB 3.22Å; R172-A176 WeakPolarHBondContact O-CB 3.46Å; R172-A176 PolarHBondContact O-N 3.44Å
173	D	76.9	Confident	76	Confident	93 Å²	93	67.7 Å²	67.7	50%	0.497	34%	0.342	S	S	.	.	H	α-helix	trans	-71.9	-39.9	179.6	-63.9	-14.1	0	0	0	111.4	T169 I170 W171 A176 S177	T169-D173 VanDerWaalsContact O-CG 3.25Å; T169-D173 PolarHBondContact O-N 2.94Å; I170-D173 PolarHBondContact O-N 2.88Å; I170-D173 VanDerWaalsContact O-N 3.15Å; W171-D173 PolarHBondContact O-N 2.84Å; D173-A176 PolarHBondContact O-N 3.1Å; D173-S177 PolarHBondContact O-N 3.01Å
174	V	79.8	Confident	77.1	Confident	19 Å²	19	72 Å²	72	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-65.7	-45	173.7	171.2	0	0	0	0	111.5	C127 F130 I170 W171 A176 S177 R178	C127-V174 HydrophobicContact CB-CG2 3.83Å; F130-V174 HydrophobicContact CD1-CG1 3.66Å; F130-V174 HydrophobicContact CE1-CG1 3.89Å; F130-V174 HydrophobicContact CG-CG1 4.36Å; I170-V174 WeakPolarHBondContact O-CG2 3.5Å; I170-V174 PolarHBondContact O-N 3.06Å; W171-V174 HydrophobicContact CE3-CB 4.2Å; W171-V174 HydrophobicContact CE3-CG1 4.11Å; W171-V174 HydrophobicContact CZ3-CG1 3.96Å; W171-V174 PolarHBondContact O-N 3.45Å; V174-A176 VanDerWaalsContact C-N 3.31Å; V174-A176 PolarHBondContact O-N 3.43Å; V174-S177 WeakPolarHBondContact O-CB 3.33Å; V174-S177 PolarHBondContact O-N 3.07Å; V174-S177 PolarHBondContact O-OG 3.26Å; V174-R178 PolarHBondContact O-N 3.1Å
175	Y	78.9	Confident	77.9	Confident	49 Å²	49	68.9 Å²	68.9	19%	0.192	34%	0.339	C	S	.	.	H	α-helix	trans	-61.7	-40.2	175.3	-170.8	-97.6	0	0	0	111.4	Q99 F146 W171 S177 R178	Q99-Y175 PolarHBondContact OE1-OH 3.29Å; F146-Y175 HydrophobicContact CE2-CD2 4.46Å; F146-Y175 AromaticContact CZ-CD2 3.78Å; F146-Y175 HydrophobicContact CZ-CD2 3.78Å; F146-Y175 HydrophobicContact CZ-CE2 4.07Å; W171-Y175 HydrophobicContact CH2-CD2 4.24Å; W171-Y175 AromaticContact CZ2-CD2 3.75Å; W171-Y175 HydrophobicContact CZ2-CD2 3.75Å; W171-Y175 HydrophobicContact CZ2-CG 4.48Å; W171-Y175 VanDerWaalsContact O-CB 3.24Å; W171-Y175 WeakPolarHBondContact O-CB 3.22Å; W171-Y175 PolarHBondContact O-N 3.38Å; Y175-S177 VanDerWaalsContact C-N 3.3Å; Y175-S177 PolarHBondContact O-N 3.45Å; Y175-R178 WeakPolarHBondContact O-CB 3.34Å; Y175-R178 PolarHBondContact O-N 2.84Å
176	A	81.1	Confident	78.4	Confident	61 Å²	61	66.2 Å²	66.2	50%	0.504	32%	0.323	S	S	.	.	H	α-helix	trans	-67	-30.2	173.3	0	0	0	0	0	112.8	R172 D173 V174 R178	R172-A176 VanDerWaalsContact O-CB 3.22Å; R172-A176 WeakPolarHBondContact O-CB 3.46Å; R172-A176 PolarHBondContact O-N 3.44Å; D173-A176 PolarHBondContact O-N 3.1Å; V174-A176 VanDerWaalsContact C-N 3.31Å; V174-A176 PolarHBondContact O-N 3.43Å; A176-R178 PolarHBondContact O-N 2.93Å
177	S	80.5	Confident	79	Confident	30 Å²	30	67.4 Å²	67.4	21%	0.21	33%	0.326	C	S	.	.	H	α-helix	trans	-65.4	-18.7	176.7	83.4	0	0	0	0	113.3	D173 V174 Y175 C179 K180 L181	D173-S177 PolarHBondContact O-N 3.01Å; V174-S177 WeakPolarHBondContact O-CB 3.33Å; V174-S177 PolarHBondContact O-N 3.07Å; V174-S177 PolarHBondContact O-OG 3.26Å; Y175-S177 VanDerWaalsContact C-N 3.3Å; Y175-S177 PolarHBondContact O-N 3.45Å; S177-C179 VanDerWaalsContact C-N 3.28Å; S177-C179 PolarHBondContact O-N 3.45Å; S177-K180 WeakPolarHBondContact O-CA 3.4Å; S177-K180 WeakPolarHBondContact O-CB 3.44Å; S177-K180 PolarHBondContact O-N 3.1Å; S177-L181 WeakPolarHBondContact O-CD1 3.44Å; S177-L181 PolarHBondContact O-N 3.4Å
178	R	80.8	Confident	79.7	Confident	49 Å²	49	68.6 Å²	68.6	19%	0.185	34%	0.338	C	S	.	.	H	α-helix	trans	-47	-47.5	175.4	-178.2	-178.4	60.1	162.2	2.9	112.9	F146 V174 Y175 A176 K180 L181 T182 M208	F146-R178 HydrophobicContact CE2-CB 4.28Å; F146-R178 HydrophobicContact CZ-CB 4.13Å; F146-R178 HydrophobicContact CZ-CG 4.2Å; V174-R178 PolarHBondContact O-N 3.1Å; Y175-R178 WeakPolarHBondContact O-CB 3.34Å; Y175-R178 PolarHBondContact O-N 2.84Å; A176-R178 PolarHBondContact O-N 2.93Å; R178-K180 PolarHBondContact O-N 2.98Å; R178-L181 PolarHBondContact O-N 3.48Å; R178-T182 HydrophobicContact CG-CG2 4.45Å; R178-T182 WeakPolarHBondContact O-CG2 3.13Å; R178-T182 PolarHBondContact O-N 3.44Å; R178-T182 PolarHBondContact O-OG1 2.97Å; R178-M208 WeakPolarHBondContact CD-O 3.43Å; R178-M208 HydrophobicContact CG-CB 3.92Å; R178-M208 HydrophobicContact CG-CG 4.33Å; R178-M208 HydrophobicContact CG-SD 4.01Å; R178-M208 PolarHBondContact NH1-O 2.87Å
179	C	78	Confident	80.2	Confident	67 Å²	67	62.5 Å²	62.5	45%	0.453	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-34	-179.3	-59.2	0	0	0	0	112.3	S177 T182 E183	S177-C179 VanDerWaalsContact C-N 3.28Å; S177-C179 PolarHBondContact O-N 3.45Å; C179-T182 VanDerWaalsContact C-OG1 3.3Å; C179-T182 WeakPolarHBondContact CA-OG1 3.42Å; C179-T182 PolarHBondContact O-OG1 3.23Å; C179-E183 WeakPolarHBondContact O-CG 3.37Å; C179-E183 PolarHBondContact O-N 3.22Å; C179-E183 VanDerWaalsContact O-N 3.17Å
180	K	81.7	Confident	80.3	Confident	143 Å²	143	61.8 Å²	61.8	62%	0.622	31%	0.313	S	S	*	.	H	α-helix	trans	-72.9	-33.8	176.4	-59	178.3	-178.9	175.5	0	111.1	S177 R178 K184	S177-K180 WeakPolarHBondContact O-CA 3.4Å; S177-K180 WeakPolarHBondContact O-CB 3.44Å; S177-K180 PolarHBondContact O-N 3.1Å; R178-K180 PolarHBondContact O-N 2.98Å; K180-K184 WeakPolarHBondContact O-CB 3.32Å; K180-K184 VanDerWaalsContact O-CG 3.29Å; K180-K184 WeakPolarHBondContact O-CG 2.94Å; K180-K184 PolarHBondContact O-N 2.99Å
181	L	80.2	Confident	79.7	Confident	9 Å²	9	60 Å²	60	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-72.8	-37.7	175.8	-83	128.6	0	0	0	112.4	F130 S177 R178 E183 K184 C185 M208	F130-L181 HydrophobicContact CE1-CD1 3.57Å; F130-L181 HydrophobicContact CZ-CD1 3.41Å; F130-L181 VanDerWaalsContact CZ-CD1 3.41Å; F130-L181 HydrophobicContact CZ-CD2 4.34Å; F130-L181 HydrophobicContact CZ-CG 4.47Å; S177-L181 WeakPolarHBondContact O-CD1 3.44Å; S177-L181 PolarHBondContact O-N 3.4Å; R178-L181 PolarHBondContact O-N 3.48Å; L181-E183 VanDerWaalsContact C-N 3.3Å; L181-E183 PolarHBondContact O-N 3.42Å; L181-K184 PolarHBondContact O-N 2.94Å; L181-C185 WeakPolarHBondContact O-CB 3.48Å; L181-C185 PolarHBondContact O-N 2.84Å; L181-C185 PolarHBondContact O-SG 3Å; L181-M208 HydrophobicContact CB-CE 4.21Å; L181-M208 HydrophobicContact CB-SD 4.07Å
182	T	79.4	Confident	79.4	Confident	21 Å²	21	68.4 Å²	68.4	13%	0.129	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-41.5	172.4	52.1	0	0	0	0	110.8	R178 C179 C185 E186 L205 M208 E209	R178-T182 HydrophobicContact CG-CG2 4.45Å; R178-T182 WeakPolarHBondContact O-CG2 3.13Å; R178-T182 PolarHBondContact O-N 3.44Å; R178-T182 PolarHBondContact O-OG1 2.97Å; C179-T182 VanDerWaalsContact C-OG1 3.3Å; C179-T182 WeakPolarHBondContact CA-OG1 3.42Å; C179-T182 PolarHBondContact O-OG1 3.23Å; T182-C185 PolarHBondContact O-N 3.07Å; T182-E186 PolarHBondContact O-N 3.38Å; T182-L205 HydrophobicContact CG2-CD2 3.76Å; T182-M208 HydrophobicContact CG2-CE 3.85Å; T182-E209 HydrophobicContact CG2-CG 4.14Å
183	E	82	Confident	79.3	Confident	111 Å²	111	62.7 Å²	62.7	52%	0.519	32%	0.317	S	S	.	.	H	α-helix	trans	-64.5	-41.7	172.6	-74.5	174.7	-174.7	0	0	112.3	C179 L181 E186 Q187	C179-E183 WeakPolarHBondContact O-CG 3.37Å; C179-E183 PolarHBondContact O-N 3.22Å; C179-E183 VanDerWaalsContact O-N 3.17Å; L181-E183 VanDerWaalsContact C-N 3.3Å; L181-E183 PolarHBondContact O-N 3.42Å; E183-E186 PolarHBondContact O-N 2.81Å; E183-Q187 WeakPolarHBondContact O-CB 3.32Å; E183-Q187 VanDerWaalsContact O-CG 3.29Å; E183-Q187 WeakPolarHBondContact O-CG 3.47Å; E183-Q187 PolarHBondContact O-N 3.33Å
184	K	82.2	Confident	79.5	Confident	103 Å²	103	63.1 Å²	63.1	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-63.4	-39.2	174.5	-78.2	178	175.7	-171.4	0	112.4	K180 L181 E186 Q187 A188	K180-K184 WeakPolarHBondContact O-CB 3.32Å; K180-K184 VanDerWaalsContact O-CG 3.29Å; K180-K184 WeakPolarHBondContact O-CG 2.94Å; K180-K184 PolarHBondContact O-N 2.99Å; L181-K184 PolarHBondContact O-N 2.94Å; K184-E186 VanDerWaalsContact C-N 3.33Å; K184-Q187 PolarHBondContact O-N 2.86Å; K184-A188 WeakPolarHBondContact O-CB 3.36Å; K184-A188 PolarHBondContact O-N 3.5Å
185	C	80.3	Confident	79.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-45.1	174.6	-67.5	0	0	0	0	110	W139 L181 T182 Q187 A188 F189 M201 L205 W223	W139-C185 WeakPolarHBondContact CZ3-SG 3.37Å; L181-C185 WeakPolarHBondContact O-CB 3.48Å; L181-C185 PolarHBondContact O-N 2.84Å; L181-C185 PolarHBondContact O-SG 3Å; T182-C185 PolarHBondContact O-N 3.07Å; C185-Q187 PolarHBondContact O-N 3.06Å; C185-A188 PolarHBondContact O-N 3.47Å; C185-F189 PolarHBondContact O-N 2.96Å; C185-F189 VanDerWaalsContact O-N 3.12Å; C185-M201 HydrophobicContact CB-CE 4.4Å; C185-M201 WeakPolarHBondContact O-CE 3.44Å; C185-L205 HydrophobicContact CB-CD2 4.03Å; C185-W223 HydrophobicContact CB-CH2 4.28Å
186	E	81.4	Confident	79.7	Confident	70 Å²	70	63.7 Å²	63.7	33%	0.327	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-40.4	176.4	-178.5	171.8	175.7	0	0	112.4	T182 E183 K184 F189 W223 K226	T182-E186 PolarHBondContact O-N 3.38Å; E183-E186 PolarHBondContact O-N 2.81Å; K184-E186 VanDerWaalsContact C-N 3.33Å; E186-F189 WeakPolarHBondContact O-CB 3.23Å; E186-F189 PolarHBondContact O-N 3.45Å; E186-W223 HydrophobicContact CB-CH2 4.49Å; E186-W223 HydrophobicContact CB-CZ2 3.81Å; E186-W223 HydrophobicContact CG-CG 4.49Å; E186-W223 HydrophobicContact CG-CZ2 4.31Å; E186-K226 IonicContact OE1-NZ 3.55Å; E186-K226 PolarHBondContact OE1-NZ 2.9Å
187	Q	82.8	Confident	79.7	Confident	157 Å²	157	64.6 Å²	64.6	73%	0.734	32%	0.32	S	S	*	.	H	α-helix	trans	-72.3	-33.5	178.5	-72.1	172.7	12.8	0	0	113.4	E183 K184 C185 F189	E183-Q187 WeakPolarHBondContact O-CB 3.32Å; E183-Q187 VanDerWaalsContact O-CG 3.29Å; E183-Q187 WeakPolarHBondContact O-CG 3.47Å; E183-Q187 PolarHBondContact O-N 3.33Å; K184-Q187 PolarHBondContact O-N 2.86Å; C185-Q187 PolarHBondContact O-N 3.06Å; Q187-F189 VanDerWaalsContact C-N 3.26Å
188	A	82.4	Confident	79.9	Confident	44 Å²	44	63.2 Å²	63.2	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-75.8	-18.1	177	0	0	0	0	0	112.2	W139 K184 C185 S190 M201	W139-A188 HydrophobicContact CH2-CB 4.22Å; W139-A188 HydrophobicContact CZ2-CB 3.75Å; K184-A188 WeakPolarHBondContact O-CB 3.36Å; K184-A188 PolarHBondContact O-N 3.5Å; C185-A188 PolarHBondContact O-N 3.47Å; A188-S190 PolarHBondContact O-N 3.44Å; A188-M201 HydrophobicContact CB-CE 4.06Å
189	F	83.1	Confident	80	Confident	13 Å²	13	60.9 Å²	60.9	6%	0.057	30%	0.302	C	S	.	.			trans	-65.2	126.9	-177.6	179	-101.8	0	0	0	111.3	C185 E186 Q187 V198 M201 F220 W223 C224 I227	C185-F189 PolarHBondContact O-N 2.96Å; C185-F189 VanDerWaalsContact O-N 3.12Å; E186-F189 WeakPolarHBondContact O-CB 3.23Å; E186-F189 PolarHBondContact O-N 3.45Å; Q187-F189 VanDerWaalsContact C-N 3.26Å; F189-V198 HydrophobicContact CD2-CG1 4.36Å; F189-V198 HydrophobicContact CD2-CG2 4.49Å; F189-V198 HydrophobicContact CE2-CG1 3.75Å; F189-V198 HydrophobicContact CE2-CG2 4.1Å; F189-M201 HydrophobicContact CB-CE 4.02Å; F189-F220 HydrophobicContact CE2-CD2 4.35Å; F189-F220 HydrophobicContact CE2-CE2 4.23Å; F189-F220 HydrophobicContact CZ-CD2 4.3Å; F189-F220 HydrophobicContact CZ-CE2 4.06Å; F189-W223 HydrophobicContact CB-CE3 4.13Å; F189-W223 HydrophobicContact CB-CZ3 4.37Å; F189-W223 HydrophobicContact CD1-CB 3.63Å; F189-W223 HydrophobicContact CD1-CE3 4.24Å; F189-W223 HydrophobicContact CD1-CG 4.48Å; F189-W223 AromaticContact CD2-CE3 3.94Å; F189-W223 HydrophobicContact CD2-CE3 3.94Å; F189-W223 HydrophobicContact CD2-CZ3 4.33Å; F189-W223 HydrophobicContact CE1-CB 3.71Å; F189-W223 HydrophobicContact CE2-CE3 4.46Å; F189-W223 HydrophobicContact CG-CB 4.36Å; F189-W223 AromaticContact CG-CE3 3.83Å; F189-W223 HydrophobicContact CG-CE3 3.83Å; F189-W223 HydrophobicContact CG-CZ3 4.39Å; F189-W223 HydrophobicContact CZ-CB 4.49Å; F189-C224 VanDerWaalsContact CZ-SG 3.58Å; F189-I227 HydrophobicContact CD1-CD1 3.26Å; F189-I227 HydrophobicContact CE1-CD1 3.38Å; F189-I227 HydrophobicContact CG-CD1 4.47Å
190	S	78.1	Confident	80.3	Confident	39 Å²	39	59.5 Å²	59.5	27%	0.273	29%	0.289	S	S	.	.			trans	-142.9	139	174.3	-177.8	0	0	0	0	109.2	A188 R192 L193	A188-S190 PolarHBondContact O-N 3.44Å; S190-R192 PolarHBondContact O-N 3.3Å; S190-R192 VanDerWaalsContact O-N 3.08Å; S190-R192 PolarHBondContact OG-N 2.82Å; S190-L193 VanDerWaalsContact N-CD1 3.3Å; S190-L193 WeakPolarHBondContact O-CB 3.12Å; S190-L193 VanDerWaalsContact O-CD1 3.31Å; S190-L193 WeakPolarHBondContact O-CD1 3.45Å; S190-L193 WeakPolarHBondContact O-CG 3.46Å; S190-L193 PolarHBondContact O-N 2.95Å; S190-L193 VanDerWaalsContact O-N 3.08Å
191	P	66.8	Low	80.3	Confident	11 Å²	11	52.8 Å²	52.8	7%	0.071	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.9	177.2	29.8	-33.2	0	0	0	112.1	L193 I227 T249 R252	P191-L193 VanDerWaalsContact C-N 3.29Å; P191-I227 HydrophobicContact CG-CG2 3.96Å; P191-T249 HydrophobicContact CG-CG2 3.92Å; P191-R252 HydrophobicContact CB-CG 4.39Å; P191-R252 WeakPolarHBondContact O-CG 3.44Å
192	R	72	Confident	80.5	Confident	187 Å²	187	52.4 Å²	52.4	71%	0.706	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-14.1	173.8	-61.3	-177.7	-178.4	172.9	0.8	113.1	S190 E245	S190-R192 PolarHBondContact O-N 3.3Å; S190-R192 VanDerWaalsContact O-N 3.08Å; S190-R192 PolarHBondContact OG-N 2.82Å; R192-E245 IonicContact CZ-OE1 3.51Å; R192-E245 IonicContact NH2-OE1 3.65Å; R192-E245 PolarHBondContact NH2-OE1 3.34Å; R192-E245 IonicContact NH2-OE2 2.67Å
193	L	76.2	Confident	80.6	Confident	40 Å²	40	51.4 Å²	51.4	21%	0.209	25%	0.251	C	S	.	.	S	Bend	trans	-67.5	159.6	176.9	-65.9	159.6	0	0	0	111.1	S190 P191 E197 V198 M201	S190-L193 VanDerWaalsContact N-CD1 3.3Å; S190-L193 WeakPolarHBondContact O-CB 3.12Å; S190-L193 VanDerWaalsContact O-CD1 3.31Å; S190-L193 WeakPolarHBondContact O-CD1 3.45Å; S190-L193 WeakPolarHBondContact O-CG 3.46Å; S190-L193 PolarHBondContact O-N 2.95Å; S190-L193 VanDerWaalsContact O-N 3.08Å; P191-L193 VanDerWaalsContact C-N 3.29Å; L193-E197 WeakPolarHBondContact CD2-OE2 3.26Å; L193-V198 HydrophobicContact CB-CG2 3.79Å; L193-V198 HydrophobicContact CD1-CG2 4.35Å; L193-M201 HydrophobicContact CD1-SD 4.01Å
194	D	81.6	Confident	80.6	Confident	102 Å²	102	46.2 Å²	46.2	55%	0.545	23%	0.227	S	C	.	.			trans	-74.1	153.4	174.4	-76.3	-30.8	0	0	0	111.2	D196 E197 V198	D194-D196 PolarHBondContact O-N 3.13Å; D194-E197 HydrophobicContact CB-CG 4.49Å; D194-E197 PolarHBondContact N-OE2 2.9Å; D194-E197 PolarHBondContact O-N 3.23Å; D194-V198 WeakPolarHBondContact O-CG2 3.34Å; D194-V198 PolarHBondContact O-N 2.94Å; D194-V198 VanDerWaalsContact O-N 3.12Å
195	A	80.2	Confident	80.5	Confident	8 Å²	8	41.4 Å²	41.4	7%	0.066	21%	0.207	C	C	.	.	H	α-helix	trans	-57.8	-34.2	-179.1	0	0	0	0	0	112	C199 L256 E259 L270	A195-C199 VanDerWaalsContact O-CB 3.22Å; A195-C199 WeakPolarHBondContact O-CB 3.15Å; A195-C199 PolarHBondContact O-N 3.45Å; A195-L256 HydrophobicContact CB-CD2 3.86Å; A195-E259 HydrophobicContact CB-CB 4.43Å; A195-E259 HydrophobicContact CB-CG 3.85Å; A195-L270 VanDerWaalsContact C-CD2 3.49Å; A195-L270 HydrophobicContact CB-CD2 3.87Å; A195-L270 WeakPolarHBondContact O-CD2 3.36Å
196	D	82.6	Confident	80.5	Confident	72 Å²	72	42.2 Å²	42.2	39%	0.385	21%	0.21	S	C	.	.	H	α-helix	trans	-66.7	-50.2	177.4	-166.9	53.4	0	0	0	111.8	D194 V198 C199 Q200	D194-D196 PolarHBondContact O-N 3.13Å; D196-V198 VanDerWaalsContact C-N 3.33Å; D196-V198 PolarHBondContact O-N 3.05Å; D196-C199 CarbonylContact O-C 3.55Å; D196-C199 WeakPolarHBondContact O-CA 3.4Å; D196-C199 WeakPolarHBondContact O-CB 3.5Å; D196-C199 PolarHBondContact O-N 3.48Å; D196-C199 VanDerWaalsContact O-N 3.08Å; D196-Q200 VanDerWaalsContact O-CG 3.25Å; D196-Q200 WeakPolarHBondContact O-CG 3.42Å; D196-Q200 PolarHBondContact O-N 3.27Å; D196-Q200 PolarHBondContact OD2-NE2 3.03Å
197	E	82.1	Confident	80.2	Confident	81 Å²	81	39.4 Å²	39.4	38%	0.379	20%	0.198	S	C	.	.	H	α-helix	trans	-58.3	-44.7	178.2	-64.5	-179.8	143.5	0	0	111.7	L193 D194 C199 Q200 M201	L193-E197 WeakPolarHBondContact CD2-OE2 3.26Å; D194-E197 HydrophobicContact CB-CG 4.49Å; D194-E197 PolarHBondContact N-OE2 2.9Å; D194-E197 PolarHBondContact O-N 3.23Å; E197-C199 VanDerWaalsContact C-N 3.34Å; E197-C199 PolarHBondContact O-N 3.15Å; E197-Q200 PolarHBondContact O-N 3.27Å; E197-M201 VanDerWaalsContact O-CG 3.24Å; E197-M201 WeakPolarHBondContact O-CG 3.31Å; E197-M201 PolarHBondContact O-N 2.96Å
198	V	84	Confident	79.9	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-40.9	176.6	178.3	0	0	0	0	111.2	F189 L193 D194 D196 M201 L202 F220 I260	F189-V198 HydrophobicContact CD2-CG1 4.36Å; F189-V198 HydrophobicContact CD2-CG2 4.49Å; F189-V198 HydrophobicContact CE2-CG1 3.75Å; F189-V198 HydrophobicContact CE2-CG2 4.1Å; L193-V198 HydrophobicContact CB-CG2 3.79Å; L193-V198 HydrophobicContact CD1-CG2 4.35Å; D194-V198 WeakPolarHBondContact O-CG2 3.34Å; D194-V198 PolarHBondContact O-N 2.94Å; D194-V198 VanDerWaalsContact O-N 3.12Å; D196-V198 VanDerWaalsContact C-N 3.33Å; D196-V198 PolarHBondContact O-N 3.05Å; V198-M201 WeakPolarHBondContact O-CB 3.33Å; V198-M201 PolarHBondContact O-N 3.48Å; V198-L202 HydrophobicContact CG1-CD1 4.22Å; V198-L202 WeakPolarHBondContact O-CG 3.27Å; V198-L202 PolarHBondContact O-N 2.89Å; V198-F220 HydrophobicContact CG1-CD2 4.19Å; V198-F220 HydrophobicContact CG1-CE2 4.06Å; V198-I260 HydrophobicContact CB-CD1 3.92Å; V198-I260 HydrophobicContact CG1-CD1 3.58Å
199	C	83.1	Confident	79.2	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.6	-44.4	175.5	-174.2	0	0	0	0	111.3	A195 D196 E197 M201 L202 C203 L270 L271	A195-C199 VanDerWaalsContact O-CB 3.22Å; A195-C199 WeakPolarHBondContact O-CB 3.15Å; A195-C199 PolarHBondContact O-N 3.45Å; D196-C199 CarbonylContact O-C 3.55Å; D196-C199 WeakPolarHBondContact O-CA 3.4Å; D196-C199 WeakPolarHBondContact O-CB 3.5Å; D196-C199 PolarHBondContact O-N 3.48Å; D196-C199 VanDerWaalsContact O-N 3.08Å; E197-C199 VanDerWaalsContact C-N 3.34Å; E197-C199 PolarHBondContact O-N 3.15Å; C199-M201 VanDerWaalsContact C-N 3.33Å; C199-M201 PolarHBondContact O-N 2.96Å; C199-L202 PolarHBondContact O-N 2.99Å; C199-C203 WeakPolarHBondContact O-CB 3.18Å; C199-C203 PolarHBondContact O-N 3.11Å; C199-C203 PolarHBondContact O-SG 3.39Å; C199-L270 HydrophobicContact CB-CD2 3.92Å; C199-L270 HydrophobicContact CB-CG 4.09Å; C199-L271 VanDerWaalsContact SG-CA 3.5Å
200	Q	83.4	Confident	78.5	Confident	38 Å²	38	37.2 Å²	37.2	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-39.5	176.3	-65.3	178.9	12	0	0	111.7	W139 A140 D196 E197 C203 C204	W139-Q200 HydrophobicContact CB-CB 4.18Å; A140-Q200 HydrophobicContact CB-CB 3.85Å; A140-Q200 HydrophobicContact CB-CG 3.7Å; D196-Q200 VanDerWaalsContact O-CG 3.25Å; D196-Q200 WeakPolarHBondContact O-CG 3.42Å; D196-Q200 PolarHBondContact O-N 3.27Å; D196-Q200 PolarHBondContact OD2-NE2 3.03Å; E197-Q200 PolarHBondContact O-N 3.27Å; Q200-C203 PolarHBondContact O-N 3.16Å; Q200-C204 WeakPolarHBondContact O-CB 3.36Å; Q200-C204 PolarHBondContact O-N 3.37Å
201	M	83.4	Confident	78.1	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-46.3	174	-68.6	171	77.8	0	0	112	W139 C185 A188 F189 L193 E197 V198 C199 C204 L205	W139-M201 HydrophobicContact CB-CG 4.1Å; W139-M201 HydrophobicContact CD2-CG 3.93Å; W139-M201 HydrophobicContact CG-CB 4.44Å; W139-M201 HydrophobicContact CG-CG 3.5Å; W139-M201 VanDerWaalsContact CG-CG 3.5Å; C185-M201 HydrophobicContact CB-CE 4.4Å; C185-M201 WeakPolarHBondContact O-CE 3.44Å; A188-M201 HydrophobicContact CB-CE 4.06Å; F189-M201 HydrophobicContact CB-CE 4.02Å; L193-M201 HydrophobicContact CD1-SD 4.01Å; E197-M201 VanDerWaalsContact O-CG 3.24Å; E197-M201 WeakPolarHBondContact O-CG 3.31Å; E197-M201 PolarHBondContact O-N 2.96Å; V198-M201 WeakPolarHBondContact O-CB 3.33Å; V198-M201 PolarHBondContact O-N 3.48Å; C199-M201 VanDerWaalsContact C-N 3.33Å; C199-M201 PolarHBondContact O-N 2.96Å; M201-C204 WeakPolarHBondContact O-CB 3.31Å; M201-C204 PolarHBondContact O-N 2.94Å; M201-L205 WeakPolarHBondContact O-CG 3.22Å; M201-L205 PolarHBondContact O-N 2.96Å; M201-L205 VanDerWaalsContact O-N 3.08Å
202	L	83.9	Confident	78.4	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-43.3	177	-70.7	169.2	0	0	0	111.4	V198 C199 C204 L205 M206 F220 I260 F261	V198-L202 HydrophobicContact CG1-CD1 4.22Å; V198-L202 WeakPolarHBondContact O-CG 3.27Å; V198-L202 PolarHBondContact O-N 2.89Å; C199-L202 PolarHBondContact O-N 2.99Å; L202-C204 VanDerWaalsContact C-N 3.33Å; L202-C204 PolarHBondContact O-N 3.45Å; L202-L205 PolarHBondContact O-N 2.92Å; L202-M206 WeakPolarHBondContact O-CG 3.37Å; L202-M206 PolarHBondContact O-N 2.85Å; L202-F220 HydrophobicContact CD1-CD2 4.39Å; L202-F220 HydrophobicContact CD2-CB 4.41Å; L202-I260 HydrophobicContact CD1-CG2 3.98Å; L202-F261 HydrophobicContact CD1-CE1 4.32Å; L202-F261 HydrophobicContact CD1-CE2 4.29Å; L202-F261 HydrophobicContact CD1-CZ 3.62Å
203	C	81.7	Confident	78.4	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.4	-39.9	173.3	-73.2	0	0	0	0	112.4	C199 Q200 L205 M206 L207 F278	C199-C203 WeakPolarHBondContact O-CB 3.18Å; C199-C203 PolarHBondContact O-N 3.11Å; C199-C203 PolarHBondContact O-SG 3.39Å; Q200-C203 PolarHBondContact O-N 3.16Å; C203-L205 PolarHBondContact O-N 2.63Å; C203-M206 WeakPolarHBondContact O-CB 3.21Å; C203-M206 PolarHBondContact O-N 2.64Å; C203-L207 VanDerWaalsContact O-CG 3.3Å; C203-L207 WeakPolarHBondContact O-CG 3.25Å; C203-L207 PolarHBondContact O-N 3.33Å; C203-F278 HydrophobicContact CB-CE2 3.69Å; C203-F278 HydrophobicContact CB-CZ 4.02Å
204	C	80.6	Confident	78.3	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.007	18%	0.182	C	C	.	.	H	α-helix	trans	-60.2	-46.5	176.1	-173.1	0	0	0	0	111.6	W139 Q200 M201 L202 M206 L207 M208	W139-C204 HydrophobicContact CB-CB 4.16Å; W139-C204 VanDerWaalsContact O-CB 3.26Å; W139-C204 WeakPolarHBondContact O-CB 3.46Å; W139-C204 PolarHBondContact O-SG 2.86Å; W139-C204 VanDerWaalsContact O-SG 3.38Å; Q200-C204 WeakPolarHBondContact O-CB 3.36Å; Q200-C204 PolarHBondContact O-N 3.37Å; M201-C204 WeakPolarHBondContact O-CB 3.31Å; M201-C204 PolarHBondContact O-N 2.94Å; L202-C204 VanDerWaalsContact C-N 3.33Å; L202-C204 PolarHBondContact O-N 3.45Å; C204-M206 PolarHBondContact O-N 3.47Å; C204-L207 PolarHBondContact O-N 3.46Å; C204-M208 WeakPolarHBondContact O-CB 3.41Å; C204-M208 WeakPolarHBondContact O-CG 3.11Å; C204-M208 PolarHBondContact O-N 3.36Å
205	L	80.9	Confident	78.3	Confident	3 Å²	3	35.6 Å²	35.6	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-42.4	176.2	-65.6	172.1	0	0	0	112.8	T182 C185 M201 L202 C203 L207 M208 E209 M219 W223	T182-L205 HydrophobicContact CG2-CD2 3.76Å; C185-L205 HydrophobicContact CB-CD2 4.03Å; M201-L205 WeakPolarHBondContact O-CG 3.22Å; M201-L205 PolarHBondContact O-N 2.96Å; M201-L205 VanDerWaalsContact O-N 3.08Å; L202-L205 PolarHBondContact O-N 2.92Å; C203-L205 PolarHBondContact O-N 2.63Å; L205-L207 VanDerWaalsContact C-N 3.33Å; L205-L207 PolarHBondContact O-N 3.17Å; L205-M208 HydrophobicContact CD2-CE 4.13Å; L205-M208 PolarHBondContact O-N 2.89Å; L205-E209 PolarHBondContact O-N 3.4Å; L205-M219 HydrophobicContact CD1-CE 3.43Å; L205-M219 VanDerWaalsContact CD1-CE 3.43Å; L205-M219 HydrophobicContact CG-CE 4.45Å; L205-W223 HydrophobicContact CD1-CH2 3.06Å; L205-W223 HydrophobicContact CD1-CZ2 3.6Å; L205-W223 HydrophobicContact CD1-CZ3 3.85Å; L205-W223 HydrophobicContact CD2-CH2 4.45Å; L205-W223 HydrophobicContact CG-CH2 4.18Å
206	M	79.7	Confident	78.4	Confident	16 Å²	16	35.2 Å²	35.2	8%	0.079	17%	0.171	C	C	.	.	H	α-helix	trans	-54.8	-51	175	-76.7	-173	78.1	0	0	111.3	L202 C203 C204 M208 K210 L213 L216 L275	L202-M206 WeakPolarHBondContact O-CG 3.37Å; L202-M206 PolarHBondContact O-N 2.85Å; C203-M206 WeakPolarHBondContact O-CB 3.21Å; C203-M206 PolarHBondContact O-N 2.64Å; C204-M206 PolarHBondContact O-N 3.47Å; M206-M208 VanDerWaalsContact C-N 3.32Å; M206-M208 PolarHBondContact O-N 2.98Å; M206-K210 VanDerWaalsContact O-CA 3.24Å; M206-K210 WeakPolarHBondContact O-CA 3.39Å; M206-K210 PolarHBondContact O-N 3.48Å; M206-L213 HydrophobicContact CE-CD2 3.27Å; M206-L213 HydrophobicContact CE-CG 3.57Å; M206-L213 HydrophobicContact SD-CD2 3.98Å; M206-L216 HydrophobicContact CE-CD1 3.97Å; M206-L216 HydrophobicContact CG-CD1 3.51Å; M206-L216 HydrophobicContact CG-CD2 3.45Å; M206-L216 VanDerWaalsContact CG-CD2 3.45Å; M206-L216 HydrophobicContact CG-CG 3.97Å; M206-L216 HydrophobicContact SD-CD1 3.26Å; M206-L216 WeakPolarHBondContact SD-CD1 3.44Å; M206-L216 HydrophobicContact SD-CD2 4.38Å; M206-L216 HydrophobicContact SD-CG 4.34Å; M206-L275 HydrophobicContact CE-CD1 4.37Å; M206-L275 HydrophobicContact SD-CD1 4.13Å; M206-L275 HydrophobicContact SD-CD2 3.97Å
207	L	76.5	Confident	78.5	Confident	12 Å²	12	31.8 Å²	31.8	6%	0.063	15%	0.153	C	C	.	.	H	α-helix	trans	-67.7	-34.9	-176.4	-69.5	172.8	0	0	0	111.7	G143 C203 C204 L205 F278 P310 V311	G143-L207 VanDerWaalsContact C-CD1 3.43Å; C203-L207 VanDerWaalsContact O-CG 3.3Å; C203-L207 WeakPolarHBondContact O-CG 3.25Å; C203-L207 PolarHBondContact O-N 3.33Å; C204-L207 PolarHBondContact O-N 3.46Å; L205-L207 VanDerWaalsContact C-N 3.33Å; L205-L207 PolarHBondContact O-N 3.17Å; L207-F278 HydrophobicContact CD1-CE2 4.37Å; L207-P310 HydrophobicContact CD2-CB 4.06Å; L207-P310 WeakPolarHBondContact CD2-O 3.48Å; L207-V311 HydrophobicContact CD2-CG2 3.84Å
208	M	74.8	Confident	78.7	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.02	15%	0.148	C	C	.	.	H	α-helix	trans	-74.1	-45.3	179	-76.9	-163.5	-61	0	0	113.5	F146 R178 L181 T182 C204 L205 M206	F146-M208 HydrophobicContact CB-CG 4.33Å; F146-M208 HydrophobicContact CD1-CB 4.23Å; F146-M208 HydrophobicContact CD1-CG 3.77Å; F146-M208 HydrophobicContact CE1-CB 4.3Å; F146-M208 HydrophobicContact CE1-CG 4.21Å; F146-M208 HydrophobicContact CG-CG 3.97Å; R178-M208 WeakPolarHBondContact CD-O 3.43Å; R178-M208 HydrophobicContact CG-CB 3.92Å; R178-M208 HydrophobicContact CG-CG 4.33Å; R178-M208 HydrophobicContact CG-SD 4.01Å; R178-M208 PolarHBondContact NH1-O 2.87Å; L181-M208 HydrophobicContact CB-CE 4.21Å; L181-M208 HydrophobicContact CB-SD 4.07Å; T182-M208 HydrophobicContact CG2-CE 3.85Å; C204-M208 WeakPolarHBondContact O-CB 3.41Å; C204-M208 WeakPolarHBondContact O-CG 3.11Å; C204-M208 PolarHBondContact O-N 3.36Å; L205-M208 HydrophobicContact CD2-CE 4.13Å; L205-M208 PolarHBondContact O-N 2.89Å; M206-M208 VanDerWaalsContact C-N 3.32Å; M206-M208 PolarHBondContact O-N 2.98Å
209	E	69.2	Low	78.7	Confident	54 Å²	54	30.6 Å²	30.6	25%	0.252	15%	0.152	S	C	.	.	H	α-helix	trans	-100.6	-7.4	-173.2	-69.9	-171.1	138.2	0	0	114.3	T182 L205 R211	T182-E209 HydrophobicContact CG2-CG 4.14Å; L205-E209 PolarHBondContact O-N 3.4Å; E209-R211 HydrophobicContact CB-CG 3.92Å; E209-R211 PolarHBondContact O-N 2.92Å; E209-R211 IonicContact OE1-NH2 3.44Å; E209-R211 PolarHBondContact OE1-NH2 3.12Å; E209-R211 IonicContact OE2-CZ 3.72Å; E209-R211 IonicContact OE2-NE 3.21Å; E209-R211 PolarHBondContact OE2-NE 3.36Å; E209-R211 IonicContact OE2-NH2 2.64Å; E209-R211 PolarHBondContact OE2-NH2 3.43Å
210	K	67.6	Low	78.9	Confident	110 Å²	110	30.6 Å²	30.6	48%	0.478	15%	0.152	S	C	.	.			trans	50	39.2	-173	-66.2	-172.4	171.7	-179.4	0	112.9	Q99 M206	Q99-K210 WeakPolarHBondContact O-CE 3.25Å; Q99-K210 PolarHBondContact O-NZ 3.26Å; M206-K210 VanDerWaalsContact O-CA 3.24Å; M206-K210 WeakPolarHBondContact O-CA 3.39Å; M206-K210 PolarHBondContact O-N 3.48Å
211	R	70.2	Confident	79.1	Confident	92 Å²	92	29.2 Å²	29.2	35%	0.347	15%	0.145	S	C	.	.			trans	-73.1	147	174.7	-66.9	-166	-168.2	-170.6	6.2	110.6	E209 M219	E209-R211 HydrophobicContact CB-CG 3.92Å; E209-R211 PolarHBondContact O-N 2.92Å; E209-R211 IonicContact OE1-NH2 3.44Å; E209-R211 PolarHBondContact OE1-NH2 3.12Å; E209-R211 IonicContact OE2-CZ 3.72Å; E209-R211 IonicContact OE2-NE 3.21Å; E209-R211 PolarHBondContact OE2-NE 3.36Å; E209-R211 IonicContact OE2-NH2 2.64Å; E209-R211 PolarHBondContact OE2-NH2 3.43Å; R211-M219 PolarHBondContact NH1-SD 3.1Å
212	P	73.5	Confident	79.4	Confident	63 Å²	63	31.6 Å²	31.6	41%	0.409	16%	0.161	S	C	.	.			trans	-68.6	150.3	176.7	31.8	-37	0	0	0	111.4	D214 Q215	P212-D214 WeakPolarHBondContact CB-OD1 3.5Å; P212-D214 WeakPolarHBondContact CG-OD1 3.35Å; P212-D214 PolarHBondContact O-N 2.93Å; P212-Q215 HydrophobicContact CG-CG 3.91Å; P212-Q215 PolarHBondContact O-N 2.89Å; P212-Q215 VanDerWaalsContact O-N 3.1Å
213	L	71.5	Confident	79.5	Confident	34 Å²	34	32.1 Å²	32.1	18%	0.178	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-57.8	-29.5	-175.5	-77.7	150.7	0	0	0	113.3	M206 Q215 L216 L271 L275 V314 I321	M206-L213 HydrophobicContact CE-CD2 3.27Å; M206-L213 HydrophobicContact CE-CG 3.57Å; M206-L213 HydrophobicContact SD-CD2 3.98Å; L213-Q215 VanDerWaalsContact C-N 3.26Å; L213-Q215 PolarHBondContact O-N 3.25Å; L213-L216 HydrophobicContact CD2-CD1 4.16Å; L213-L216 PolarHBondContact O-N 3.42Å; L213-L271 HydrophobicContact CD2-CD2 4.09Å; L213-L275 HydrophobicContact CD2-CD1 3.71Å; L213-V314 HydrophobicContact CD1-CG1 4.04Å; L213-V314 HydrophobicContact CD1-CG2 3.83Å; L213-I321 HydrophobicContact CB-CD1 4.08Å; L213-I321 HydrophobicContact CB-CG1 4.2Å; L213-I321 HydrophobicContact CD1-CD1 4.36Å; L213-I321 HydrophobicContact CD2-CD1 4.34Å
214	D	74.7	Confident	79.8	Confident	74 Å²	74	32.2 Å²	32.2	40%	0.396	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-68.2	-20.9	179.4	65.6	-24.8	0	0	0	113.5	P212 A324	P212-D214 WeakPolarHBondContact CB-OD1 3.5Å; P212-D214 WeakPolarHBondContact CG-OD1 3.35Å; P212-D214 PolarHBondContact O-N 2.93Å; D214-A324 HydrophobicContact CB-CB 4.19Å
215	Q	80.7	Confident	80.2	Confident	81 Å²	81	34.7 Å²	34.7	38%	0.379	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-86.6	-15.3	178.9	-70.6	178.5	15.3	0	0	113.6	P212 L213 S218 M219	P212-Q215 HydrophobicContact CG-CG 3.91Å; P212-Q215 PolarHBondContact O-N 2.89Å; P212-Q215 VanDerWaalsContact O-N 3.1Å; L213-Q215 VanDerWaalsContact C-N 3.26Å; L213-Q215 PolarHBondContact O-N 3.25Å; Q215-S218 PolarHBondContact O-N 3.09Å; Q215-S218 PolarHBondContact O-OG 2.92Å; Q215-M219 PolarHBondContact O-N 3.11Å; Q215-M219 VanDerWaalsContact O-N 3.16Å
216	L	82.6	Confident	80.5	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-42	-176.6	-62	166.5	0	0	0	114.1	M206 L213 S218 M219 F220 F261 L271	M206-L216 HydrophobicContact CE-CD1 3.97Å; M206-L216 HydrophobicContact CG-CD1 3.51Å; M206-L216 HydrophobicContact CG-CD2 3.45Å; M206-L216 VanDerWaalsContact CG-CD2 3.45Å; M206-L216 HydrophobicContact CG-CG 3.97Å; M206-L216 HydrophobicContact SD-CD1 3.26Å; M206-L216 WeakPolarHBondContact SD-CD1 3.44Å; M206-L216 HydrophobicContact SD-CD2 4.38Å; M206-L216 HydrophobicContact SD-CG 4.34Å; L213-L216 HydrophobicContact CD2-CD1 4.16Å; L213-L216 PolarHBondContact O-N 3.42Å; L216-S218 VanDerWaalsContact C-N 3.25Å; L216-S218 PolarHBondContact O-N 2.76Å; L216-M219 PolarHBondContact O-N 3.37Å; L216-F220 WeakPolarHBondContact O-CB 3.48Å; L216-F220 PolarHBondContact O-N 2.86Å; L216-F261 HydrophobicContact CB-CE1 3.74Å; L216-F261 HydrophobicContact CB-CZ 4.18Å; L216-L271 HydrophobicContact CD1-CD1 4.28Å; L216-L271 HydrophobicContact CD1-CD2 4.02Å
217	P	84.6	Confident	80.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.4	-41.6	174	-25.4	35.8	0	0	0	111.7	M219 F220 Y221 F261 L325 E328	P217-M219 VanDerWaalsContact C-N 3.35Å; P217-M219 PolarHBondContact O-N 3.45Å; P217-F220 PolarHBondContact O-N 2.83Å; P217-Y221 HydrophobicContact CB-CD2 4.45Å; P217-Y221 HydrophobicContact CB-CE2 4.42Å; P217-Y221 WeakPolarHBondContact O-CB 3.33Å; P217-Y221 WeakPolarHBondContact O-CD2 3.48Å; P217-Y221 PolarHBondContact O-N 2.91Å; P217-F261 HydrophobicContact CG-CD1 4.04Å; P217-F261 HydrophobicContact CG-CE1 4.09Å; P217-F261 HydrophobicContact CG-CG 4.38Å; P217-F261 HydrophobicContact CG-CZ 4.45Å; P217-L325 HydrophobicContact CB-CD1 4.32Å; P217-E328 HydrophobicContact CB-CB 4.23Å; P217-E328 HydrophobicContact CB-CG 4.36Å
218	S	86.5	Confident	81.5	Confident	41 Å²	41	41.4 Å²	41.4	29%	0.287	21%	0.205	S	C	.	.	H	α-helix	trans	-62.7	-40.4	179.3	77.3	0	0	0	0	112.4	Q215 L216 S222	Q215-S218 PolarHBondContact O-N 3.09Å; Q215-S218 PolarHBondContact O-OG 2.92Å; L216-S218 VanDerWaalsContact C-N 3.25Å; L216-S218 PolarHBondContact O-N 2.76Å; S218-S222 VanDerWaalsContact O-CB 3.29Å; S218-S222 WeakPolarHBondContact O-CB 3.31Å; S218-S222 PolarHBondContact O-N 3.3Å
219	M	83.3	Confident	82.1	Confident	16 Å²	16	45.7 Å²	45.7	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-49.4	175.6	-73.4	-175.2	58.1	0	0	111.3	L205 R211 Q215 L216 P217 Y221 S222 W223	L205-M219 HydrophobicContact CD1-CE 3.43Å; L205-M219 VanDerWaalsContact CD1-CE 3.43Å; L205-M219 HydrophobicContact CG-CE 4.45Å; R211-M219 PolarHBondContact NH1-SD 3.1Å; Q215-M219 PolarHBondContact O-N 3.11Å; Q215-M219 VanDerWaalsContact O-N 3.16Å; L216-M219 PolarHBondContact O-N 3.37Å; P217-M219 VanDerWaalsContact C-N 3.35Å; P217-M219 PolarHBondContact O-N 3.45Å; M219-Y221 VanDerWaalsContact C-N 3.34Å; M219-Y221 PolarHBondContact O-N 3.45Å; M219-S222 WeakPolarHBondContact O-CB 3.38Å; M219-S222 PolarHBondContact O-N 3.14Å; M219-S222 VanDerWaalsContact O-N 3.1Å; M219-S222 PolarHBondContact O-OG 3.36Å; M219-W223 HydrophobicContact CE-CZ2 4.03Å; M219-W223 PolarHBondContact O-N 3.01Å
220	F	87.7	Confident	82.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-55.3	-48.8	177.8	171.5	-95	0	0	0	111.6	F189 V198 L202 L216 P217 S222 W223 C224 T253 L256 A257 I260 F261	F189-F220 HydrophobicContact CE2-CD2 4.35Å; F189-F220 HydrophobicContact CE2-CE2 4.23Å; F189-F220 HydrophobicContact CZ-CD2 4.3Å; F189-F220 HydrophobicContact CZ-CE2 4.06Å; V198-F220 HydrophobicContact CG1-CD2 4.19Å; V198-F220 HydrophobicContact CG1-CE2 4.06Å; L202-F220 HydrophobicContact CD1-CD2 4.39Å; L202-F220 HydrophobicContact CD2-CB 4.41Å; L216-F220 WeakPolarHBondContact O-CB 3.48Å; L216-F220 PolarHBondContact O-N 2.86Å; P217-F220 PolarHBondContact O-N 2.83Å; F220-S222 VanDerWaalsContact C-N 3.34Å; F220-S222 PolarHBondContact O-N 3.34Å; F220-W223 PolarHBondContact O-N 3.05Å; F220-C224 VanDerWaalsContact CZ-SG 3.51Å; F220-C224 WeakPolarHBondContact O-CB 3.45Å; F220-C224 PolarHBondContact O-N 3.38Å; F220-C224 PolarHBondContact O-SG 3.24Å; F220-T253 HydrophobicContact CE1-CG2 3.93Å; F220-T253 HydrophobicContact CZ-CG2 4.34Å; F220-L256 HydrophobicContact CE2-CB 4.27Å; F220-L256 HydrophobicContact CZ-CB 3.83Å; F220-A257 HydrophobicContact CD1-CB 4.38Å; F220-A257 HydrophobicContact CE1-CB 3.74Å; F220-A257 HydrophobicContact CZ-CB 4.43Å; F220-I260 HydrophobicContact CE2-CD1 4.35Å; F220-F261 HydrophobicContact CB-CE2 3.86Å; F220-F261 HydrophobicContact CB-CZ 3.95Å; F220-F261 AromaticContact CD1-CE2 3.96Å; F220-F261 HydrophobicContact CD1-CE2 3.96Å; F220-F261 HydrophobicContact CD2-CE2 4.35Å; F220-F261 AromaticContact CG-CE2 3.78Å; F220-F261 HydrophobicContact CG-CE2 3.78Å; F220-F261 HydrophobicContact CG-CZ 4.32Å
221	Y	88.7	Confident	83.8	Confident	9 Å²	9	40.5 Å²	40.5	4%	0.035	22%	0.215	C	C	.	.	H	α-helix	trans	-67.5	-33.5	177.4	-76	-59.2	0	0	0	112.8	P217 M219 W223 C224 F225 T253 A257 L325 E328 T329 F332	P217-Y221 HydrophobicContact CB-CD2 4.45Å; P217-Y221 HydrophobicContact CB-CE2 4.42Å; P217-Y221 WeakPolarHBondContact O-CB 3.33Å; P217-Y221 WeakPolarHBondContact O-CD2 3.48Å; P217-Y221 PolarHBondContact O-N 2.91Å; M219-Y221 VanDerWaalsContact C-N 3.34Å; M219-Y221 PolarHBondContact O-N 3.45Å; Y221-W223 VanDerWaalsContact C-N 3.35Å; Y221-C224 PolarHBondContact O-N 2.88Å; Y221-F225 WeakPolarHBondContact O-CB 3.43Å; Y221-F225 PolarHBondContact O-N 3.4Å; Y221-T253 HydrophobicContact CD1-CG2 3.94Å; Y221-T253 HydrophobicContact CE1-CG2 3.86Å; Y221-A257 HydrophobicContact CE1-CB 4.24Å; Y221-A257 WeakPolarHBondContact OH-CB 3.4Å; Y221-L325 HydrophobicContact CE2-CD1 4.19Å; Y221-E328 HydrophobicContact CD2-CB 3.76Å; Y221-E328 HydrophobicContact CE2-CB 4.12Å; Y221-T329 HydrophobicContact CE2-CG2 3.9Å; Y221-T329 WeakPolarHBondContact OH-CG2 3.3Å; Y221-F332 HydrophobicContact CD1-CB 3.62Å; Y221-F332 AromaticContact CD1-CD1 3.78Å; Y221-F332 HydrophobicContact CD1-CD1 3.78Å; Y221-F332 AromaticContact CD1-CD2 3.7Å; Y221-F332 HydrophobicContact CD1-CD2 3.7Å; Y221-F332 HydrophobicContact CD1-CE1 4.38Å; Y221-F332 HydrophobicContact CD1-CE2 4.3Å; Y221-F332 AromaticContact CD1-CG 3.39Å; Y221-F332 HydrophobicContact CD1-CG 3.39Å; Y221-F332 HydrophobicContact CE1-CB 4.16Å; Y221-F332 AromaticContact CE1-CD1 3.91Å; Y221-F332 HydrophobicContact CE1-CD1 3.91Å; Y221-F332 AromaticContact CE1-CG 3.97Å; Y221-F332 HydrophobicContact CE1-CG 3.97Å; Y221-F332 HydrophobicContact CG-CB 3.86Å; Y221-F332 HydrophobicContact CG-CD2 4.26Å; Y221-F332 HydrophobicContact CG-CG 4.07Å
222	S	88.2	Confident	84.5	Confident	51 Å²	51	36.4 Å²	36.4	36%	0.357	20%	0.199	S	C	.	.	H	α-helix	trans	-64.2	-40.3	175.9	79.5	0	0	0	0	112.1	S218 M219 F220 K226	S218-S222 VanDerWaalsContact O-CB 3.29Å; S218-S222 WeakPolarHBondContact O-CB 3.31Å; S218-S222 PolarHBondContact O-N 3.3Å; M219-S222 WeakPolarHBondContact O-CB 3.38Å; M219-S222 PolarHBondContact O-N 3.14Å; M219-S222 VanDerWaalsContact O-N 3.1Å; M219-S222 PolarHBondContact O-OG 3.36Å; F220-S222 VanDerWaalsContact C-N 3.34Å; F220-S222 PolarHBondContact O-N 3.34Å; S222-K226 WeakPolarHBondContact O-CG 3.14Å; S222-K226 PolarHBondContact O-N 2.92Å; S222-K226 VanDerWaalsContact O-N 3.14Å
223	W	86.2	Confident	85	Confident	13 Å²	13	38 Å²	38	5%	0.049	20%	0.204	C	C	.	.	H	α-helix	trans	-70.6	-45	176.4	-64.8	-13.2	0	0	0	111.5	C185 E186 F189 L205 M219 F220 Y221 F225 K226 I227	C185-W223 HydrophobicContact CB-CH2 4.28Å; E186-W223 HydrophobicContact CB-CH2 4.49Å; E186-W223 HydrophobicContact CB-CZ2 3.81Å; E186-W223 HydrophobicContact CG-CG 4.49Å; E186-W223 HydrophobicContact CG-CZ2 4.31Å; F189-W223 HydrophobicContact CB-CE3 4.13Å; F189-W223 HydrophobicContact CB-CZ3 4.37Å; F189-W223 HydrophobicContact CD1-CB 3.63Å; F189-W223 HydrophobicContact CD1-CE3 4.24Å; F189-W223 HydrophobicContact CD1-CG 4.48Å; F189-W223 AromaticContact CD2-CE3 3.94Å; F189-W223 HydrophobicContact CD2-CE3 3.94Å; F189-W223 HydrophobicContact CD2-CZ3 4.33Å; F189-W223 HydrophobicContact CE1-CB 3.71Å; F189-W223 HydrophobicContact CE2-CE3 4.46Å; F189-W223 HydrophobicContact CG-CB 4.36Å; F189-W223 AromaticContact CG-CE3 3.83Å; F189-W223 HydrophobicContact CG-CE3 3.83Å; F189-W223 HydrophobicContact CG-CZ3 4.39Å; F189-W223 HydrophobicContact CZ-CB 4.49Å; L205-W223 HydrophobicContact CD1-CH2 3.06Å; L205-W223 HydrophobicContact CD1-CZ2 3.6Å; L205-W223 HydrophobicContact CD1-CZ3 3.85Å; L205-W223 HydrophobicContact CD2-CH2 4.45Å; L205-W223 HydrophobicContact CG-CH2 4.18Å; M219-W223 HydrophobicContact CE-CZ2 4.03Å; M219-W223 PolarHBondContact O-N 3.01Å; F220-W223 PolarHBondContact O-N 3.05Å; Y221-W223 VanDerWaalsContact C-N 3.35Å; W223-F225 VanDerWaalsContact C-N 3.29Å; W223-F225 PolarHBondContact O-N 2.98Å; W223-K226 PolarHBondContact O-N 2.84Å; W223-I227 PolarHBondContact O-N 2.95Å; W223-I227 VanDerWaalsContact O-N 3.14Å
224	C	88.8	Confident	85.4	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.014	20%	0.204	C	C	.	.	H	α-helix	trans	-58.4	-41.8	174.2	-69.9	0	0	0	0	112	F189 F220 Y221 K226 I227 F228 T253 F332	F189-C224 VanDerWaalsContact CZ-SG 3.58Å; F220-C224 VanDerWaalsContact CZ-SG 3.51Å; F220-C224 WeakPolarHBondContact O-CB 3.45Å; F220-C224 PolarHBondContact O-N 3.38Å; F220-C224 PolarHBondContact O-SG 3.24Å; Y221-C224 PolarHBondContact O-N 2.88Å; C224-K226 PolarHBondContact O-N 3.42Å; C224-I227 PolarHBondContact O-N 3.29Å; C224-F228 VanDerWaalsContact O-CB 3.28Å; C224-F228 WeakPolarHBondContact O-CB 3.43Å; C224-F228 PolarHBondContact O-N 2.89Å; C224-T253 HydrophobicContact CB-CG2 3.48Å; C224-T253 VanDerWaalsContact CB-CG2 3.48Å; C224-T253 WeakPolarHBondContact CB-OG1 3.46Å; C224-T253 VanDerWaalsContact SG-CG2 3.54Å; C224-T253 PolarHBondContact SG-OG1 2.99Å; C224-T253 VanDerWaalsContact SG-OG1 3.34Å; C224-F332 HydrophobicContact CB-CE2 4.33Å
225	F	88.4	Confident	85.2	Confident	53 Å²	53	40.1 Å²	40.1	23%	0.232	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-38.1	178	-175.8	-98.9	0	0	0	112.2	Y221 W223 F228 K229 F332 K335 A339	Y221-F225 WeakPolarHBondContact O-CB 3.43Å; Y221-F225 PolarHBondContact O-N 3.4Å; W223-F225 VanDerWaalsContact C-N 3.29Å; W223-F225 PolarHBondContact O-N 2.98Å; F225-F228 PolarHBondContact O-N 3.03Å; F225-K229 HydrophobicContact CE1-CD 4.33Å; F225-K229 VanDerWaalsContact O-CB 3.27Å; F225-K229 WeakPolarHBondContact O-CB 3.26Å; F225-K229 PolarHBondContact O-N 3.31Å; F225-F332 HydrophobicContact CB-CD2 4.25Å; F225-F332 HydrophobicContact CB-CE2 3.98Å; F225-F332 HydrophobicContact CD2-CD2 4.48Å; F225-F332 HydrophobicContact CD2-CE2 4.27Å; F225-K335 HydrophobicContact CE2-CB 4.07Å; F225-A339 HydrophobicContact CE2-CB 4.28Å; F225-A339 HydrophobicContact CZ-CB 4.25Å
226	K	88.2	Confident	85	Confident	119 Å²	119	43.6 Å²	43.6	52%	0.517	24%	0.244	S	C	.	.	H	α-helix	trans	-61.2	-44.5	174.2	-73.8	178.7	-174	-176.9	0	111.6	E186 S222 W223 C224 K229 G230	E186-K226 IonicContact OE1-NZ 3.55Å; E186-K226 PolarHBondContact OE1-NZ 2.9Å; S222-K226 WeakPolarHBondContact O-CG 3.14Å; S222-K226 PolarHBondContact O-N 2.92Å; S222-K226 VanDerWaalsContact O-N 3.14Å; W223-K226 PolarHBondContact O-N 2.84Å; C224-K226 PolarHBondContact O-N 3.42Å; K226-K229 PolarHBondContact O-N 2.93Å; K226-G230 PolarHBondContact O-N 3.41Å
227	I	86.7	Confident	84.9	Confident	51 Å²	51	46.7 Å²	46.7	26%	0.262	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-44.2	178	-70.5	147.8	0	0	0	111.5	F189 P191 W223 C224 K229 G230 A231 T249	F189-I227 HydrophobicContact CD1-CD1 3.26Å; F189-I227 HydrophobicContact CE1-CD1 3.38Å; F189-I227 HydrophobicContact CG-CD1 4.47Å; P191-I227 HydrophobicContact CG-CG2 3.96Å; W223-I227 PolarHBondContact O-N 2.95Å; W223-I227 VanDerWaalsContact O-N 3.14Å; C224-I227 PolarHBondContact O-N 3.29Å; I227-K229 VanDerWaalsContact C-N 3.3Å; I227-K229 PolarHBondContact O-N 3.39Å; I227-G230 WeakPolarHBondContact O-CA 3.49Å; I227-G230 PolarHBondContact O-N 2.97Å; I227-G230 VanDerWaalsContact O-N 3.08Å; I227-A231 PolarHBondContact O-N 3.16Å; I227-T249 HydrophobicContact CG2-CG2 4.33Å
228	F	88.9	Confident	84.9	Confident	1 Å²	1	49 Å²	49	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-55.8	-46.5	174.6	174.4	-99.7	0	0	0	111.1	C224 F225 G230 A231 L232 C246 W250 S336 Y340	C224-F228 VanDerWaalsContact O-CB 3.28Å; C224-F228 WeakPolarHBondContact O-CB 3.43Å; C224-F228 PolarHBondContact O-N 2.89Å; F225-F228 PolarHBondContact O-N 3.03Å; F228-G230 VanDerWaalsContact C-N 3.33Å; F228-G230 PolarHBondContact O-N 3.12Å; F228-A231 PolarHBondContact O-N 3.48Å; F228-L232 HydrophobicContact CE1-CD2 4.34Å; F228-L232 WeakPolarHBondContact O-CB 3.26Å; F228-L232 PolarHBondContact O-N 2.86Å; F228-C246 HydrophobicContact CE2-CB 4.16Å; F228-W250 HydrophobicContact CD2-CB 3.96Å; F228-W250 HydrophobicContact CE2-CB 3.9Å; F228-W250 HydrophobicContact CE2-CG 4.33Å; F228-S336 WeakPolarHBondContact CE1-O 3.49Å; F228-Y340 HydrophobicContact CZ-CD2 4.36Å
229	K	87.8	Confident	84.7	Confident	94 Å²	94	47.8 Å²	47.8	41%	0.409	27%	0.266	S	S	.	.	H	α-helix	trans	-66.1	-35.1	176.4	-169.8	171.2	-175.9	172.3	0	112.4	F225 K226 I227 L232 L233	F225-K229 HydrophobicContact CE1-CD 4.33Å; F225-K229 VanDerWaalsContact O-CB 3.27Å; F225-K229 WeakPolarHBondContact O-CB 3.26Å; F225-K229 PolarHBondContact O-N 3.31Å; K226-K229 PolarHBondContact O-N 2.93Å; I227-K229 VanDerWaalsContact C-N 3.3Å; I227-K229 PolarHBondContact O-N 3.39Å; K229-L232 PolarHBondContact O-N 3.4Å; K229-L233 HydrophobicContact CG-CD1 3.89Å; K229-L233 HydrophobicContact CG-CG 4.39Å; K229-L233 WeakPolarHBondContact O-CB 3.44Å; K229-L233 VanDerWaalsContact O-CG 3.31Å; K229-L233 WeakPolarHBondContact O-CG 3.33Å; K229-L233 PolarHBondContact O-N 3.21Å
230	G	86.6	Confident	84.8	Confident	45 Å²	45	50.2 Å²	50.2	46%	0.464	28%	0.281	S	S	.	.	H	α-helix	trans	-61.7	-45	172.4	0	0	0	0	0	112.5	K226 I227 F228 L232 L233 S234	K226-G230 PolarHBondContact O-N 3.41Å; I227-G230 WeakPolarHBondContact O-CA 3.49Å; I227-G230 PolarHBondContact O-N 2.97Å; I227-G230 VanDerWaalsContact O-N 3.08Å; F228-G230 VanDerWaalsContact C-N 3.33Å; F228-G230 PolarHBondContact O-N 3.12Å; G230-L232 VanDerWaalsContact C-N 3.32Å; G230-L233 PolarHBondContact O-N 2.95Å; G230-S234 PolarHBondContact O-N 3.19Å; G230-S234 VanDerWaalsContact O-N 3.13Å
231	A	86.1	Confident	84.7	Confident	10 Å²	10	55.2 Å²	55.2	8%	0.083	31%	0.305	C	S	.	.	H	α-helix	trans	-65	-36.7	173.9	0	0	0	0	0	111.8	I227 F228 L233 S234 Q242 E245	I227-A231 PolarHBondContact O-N 3.16Å; F228-A231 PolarHBondContact O-N 3.48Å; A231-L233 VanDerWaalsContact C-N 3.31Å; A231-L233 PolarHBondContact O-N 3.34Å; A231-S234 PolarHBondContact O-N 2.72Å; A231-S234 PolarHBondContact O-OG 3.35Å; A231-Q242 WeakPolarHBondContact O-CG 3.41Å; A231-E245 HydrophobicContact CB-CB 4.29Å
232	L	84.2	Confident	84.6	Confident	6 Å²	6	56 Å²	56	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-69.3	-30.3	178.2	-166.7	64.9	0	0	0	112.6	F228 K229 G230 Q242 C246 A339 Y340 D343 V344	F228-L232 HydrophobicContact CE1-CD2 4.34Å; F228-L232 WeakPolarHBondContact O-CB 3.26Å; F228-L232 PolarHBondContact O-N 2.86Å; K229-L232 PolarHBondContact O-N 3.4Å; G230-L232 VanDerWaalsContact C-N 3.32Å; L232-Q242 PolarHBondContact O-NE2 3.46Å; L232-C246 WeakPolarHBondContact CA-SG 3.5Å; L232-C246 PolarHBondContact N-SG 3.39Å; L232-C246 VanDerWaalsContact N-SG 3.39Å; L232-A339 HydrophobicContact CD2-CB 4.49Å; L232-Y340 HydrophobicContact CD1-CD2 4.02Å; L232-D343 HydrophobicContact CD2-CB 3.75Å; L232-D343 HydrophobicContact CG-CB 3.96Å; L232-V344 HydrophobicContact CD1-CG2 3.86Å
233	L	84	Confident	84.5	Confident	96 Å²	96	53.6 Å²	53.6	50%	0.503	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	3.5	-179.7	-64.6	173.6	0	0	0	113.5	K229 G230 A231 T235	K229-L233 HydrophobicContact CG-CD1 3.89Å; K229-L233 HydrophobicContact CG-CG 4.39Å; K229-L233 WeakPolarHBondContact O-CB 3.44Å; K229-L233 VanDerWaalsContact O-CG 3.31Å; K229-L233 WeakPolarHBondContact O-CG 3.33Å; K229-L233 PolarHBondContact O-N 3.21Å; G230-L233 PolarHBondContact O-N 2.95Å; A231-L233 VanDerWaalsContact C-N 3.31Å; A231-L233 PolarHBondContact O-N 3.34Å; L233-T235 PolarHBondContact O-N 2.76Å; L233-T235 VanDerWaalsContact O-N 3.1Å
234	S	80	Confident	84.5	Confident	26 Å²	26	54 Å²	54	18%	0.182	30%	0.3	C	S	.	.			trans	-67.5	111.3	-179.6	67.4	0	0	0	0	110.5	G230 A231	G230-S234 PolarHBondContact O-N 3.19Å; G230-S234 VanDerWaalsContact O-N 3.13Å; A231-S234 PolarHBondContact O-N 2.72Å; A231-S234 PolarHBondContact O-OG 3.35Å
235	T	71.1	Confident	84.3	Confident	127 Å²	127	57 Å²	57	78%	0.779	31%	0.314	S	S	*	.	S	Bend	trans	-82.1	-16.7	178.4	48.6	0	0	0	0	113.7	L233	L233-T235 PolarHBondContact O-N 2.76Å; L233-T235 VanDerWaalsContact O-N 3.1Å
236	D	77.1	Confident	84.3	Confident	154 Å²	154	54.5 Å²	54.5	82%	0.824	30%	0.303	S	S	*	.	S	Bend	trans	-85.5	-13.1	-169.8	-57.4	-21.8	0	0	0	113.1
237	L	79.7	Confident	84.2	Confident	66 Å²	66	48.9 Å²	48.9	35%	0.346	28%	0.278	S	S	.	.	S	Bend	trans	-97.9	150.6	-177.1	-66.4	176.8	0	0	0	111	E241 Q242 E245	L237-E241 HydrophobicContact CB-CB 4.06Å; L237-E241 HydrophobicContact CD2-CB 4.27Å; L237-Q242 HydrophobicContact CB-CB 4.31Å; L237-E245 HydrophobicContact CD1-CG 4.2Å
238	S	84.7	Confident	84.2	Confident	49 Å²	49	49.8 Å²	49.8	34%	0.343	29%	0.286	S	S	.	.			trans	-62.2	148.3	165	65	0	0	0	0	109.6	T240 E241 Q242	S238-T240 PolarHBondContact O-N 3.24Å; S238-T240 PolarHBondContact OG-OG1 3.42Å; S238-E241 WeakPolarHBondContact CB-OE2 3.36Å; S238-E241 PolarHBondContact N-OE2 3.36Å; S238-E241 CarbonylContact O-C 3.59Å; S238-E241 WeakPolarHBondContact O-CA 3.25Å; S238-E241 PolarHBondContact O-N 3.34Å; S238-E241 VanDerWaalsContact OG-CG 3.22Å; S238-E241 WeakPolarHBondContact OG-CG 3.34Å; S238-E241 PolarHBondContact OG-N 3.02Å; S238-E241 PolarHBondContact OG-OE2 2.98Å; S238-Q242 WeakPolarHBondContact O-CB 3.31Å; S238-Q242 PolarHBondContact O-N 2.88Å
239	F	83.3	Confident	84	Confident	15 Å²	15	50.4 Å²	50.4	7%	0.066	29%	0.29	C	S	.	.	H	α-helix	trans	-53.1	-33.4	178.3	176.2	-89.9	0	0	0	113.1	I243 V344 L348 R360	F239-I243 HydrophobicContact CD1-CD1 3.53Å; F239-I243 HydrophobicContact CD2-CD1 3.81Å; F239-I243 HydrophobicContact CE1-CD1 3.06Å; F239-I243 HydrophobicContact CE1-CG1 4.47Å; F239-I243 HydrophobicContact CE2-CD1 3.37Å; F239-I243 HydrophobicContact CG-CD1 3.91Å; F239-I243 HydrophobicContact CZ-CD1 2.99Å; F239-I243 HydrophobicContact CZ-CG1 4.43Å; F239-I243 WeakPolarHBondContact O-CB 3.14Å; F239-I243 PolarHBondContact O-N 2.8Å; F239-V344 HydrophobicContact CE2-CG1 4.38Å; F239-L348 HydrophobicContact CE2-CD2 4.18Å; F239-L348 HydrophobicContact CZ-CD2 4.09Å; F239-R360 VanDerWaalsContact CB-CZ 3.48Å; F239-R360 VanDerWaalsContact CB-NH1 3.27Å; F239-R360 HydrophobicContact CD1-CB 4.38Å; F239-R360 HydrophobicContact CD1-CG 4.3Å; F239-R360 HydrophobicContact CE1-CB 3.65Å; F239-R360 HydrophobicContact CE1-CG 3.98Å; F239-R360 VanDerWaalsContact CG-CD 3.5Å; F239-R360 HydrophobicContact CZ-CB 4.03Å; F239-R360 HydrophobicContact CZ-CG 4.34Å
240	T	84.3	Confident	84	Confident	67 Å²	67	46.1 Å²	46.1	41%	0.411	27%	0.271	S	S	.	.	H	α-helix	trans	-60.5	-46	173.1	33.3	0	0	0	0	112.2	S238 G244 S363	S238-T240 PolarHBondContact O-N 3.24Å; S238-T240 PolarHBondContact OG-OG1 3.42Å; T240-G244 PolarHBondContact O-N 2.92Å; T240-S363 WeakPolarHBondContact CG2-OG 3.4Å
241	E	84.8	Confident	83.8	Confident	105 Å²	105	45 Å²	45	49%	0.491	25%	0.254	S	S	.	.	H	α-helix	trans	-73.6	-42.1	178.8	-70.1	161.2	156.6	0	0	111	L237 S238 I243 G244 E245	L237-E241 HydrophobicContact CB-CB 4.06Å; L237-E241 HydrophobicContact CD2-CB 4.27Å; S238-E241 WeakPolarHBondContact CB-OE2 3.36Å; S238-E241 PolarHBondContact N-OE2 3.36Å; S238-E241 CarbonylContact O-C 3.59Å; S238-E241 WeakPolarHBondContact O-CA 3.25Å; S238-E241 PolarHBondContact O-N 3.34Å; S238-E241 VanDerWaalsContact OG-CG 3.22Å; S238-E241 WeakPolarHBondContact OG-CG 3.34Å; S238-E241 PolarHBondContact OG-N 3.02Å; S238-E241 PolarHBondContact OG-OE2 2.98Å; E241-I243 PolarHBondContact O-N 3.47Å; E241-G244 CarbonylContact O-C 3.54Å; E241-G244 PolarHBondContact O-N 3.3Å; E241-E245 WeakPolarHBondContact O-CB 3.33Å; E241-E245 WeakPolarHBondContact O-CG 3.32Å; E241-E245 PolarHBondContact O-N 3.17Å
242	Q	87.3	Confident	83.8	Confident	25 Å²	25	48.8 Å²	48.8	12%	0.117	27%	0.266	C	S	.	.	H	α-helix	trans	-56.2	-50.2	176.1	-176.7	-172	15.1	0	0	111.2	A231 L232 L237 S238 E245 C246	A231-Q242 WeakPolarHBondContact O-CG 3.41Å; L232-Q242 PolarHBondContact O-NE2 3.46Å; L237-Q242 HydrophobicContact CB-CB 4.31Å; S238-Q242 WeakPolarHBondContact O-CB 3.31Å; S238-Q242 PolarHBondContact O-N 2.88Å; Q242-E245 PolarHBondContact O-N 3.38Å; Q242-C246 WeakPolarHBondContact O-CB 3.48Å; Q242-C246 PolarHBondContact O-N 3.12Å; Q242-C246 PolarHBondContact O-SG 3.49Å
243	I	86.9	Confident	83.9	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-70.9	-36.9	176.6	-81	158.5	0	0	0	111.7	F239 E241 E245 C246 V247 I364 A367	F239-I243 HydrophobicContact CD1-CD1 3.53Å; F239-I243 HydrophobicContact CD2-CD1 3.81Å; F239-I243 HydrophobicContact CE1-CD1 3.06Å; F239-I243 HydrophobicContact CE1-CG1 4.47Å; F239-I243 HydrophobicContact CE2-CD1 3.37Å; F239-I243 HydrophobicContact CG-CD1 3.91Å; F239-I243 HydrophobicContact CZ-CD1 2.99Å; F239-I243 HydrophobicContact CZ-CG1 4.43Å; F239-I243 WeakPolarHBondContact O-CB 3.14Å; F239-I243 PolarHBondContact O-N 2.8Å; E241-I243 PolarHBondContact O-N 3.47Å; I243-E245 VanDerWaalsContact C-N 3.33Å; I243-E245 PolarHBondContact O-N 3.32Å; I243-C246 PolarHBondContact O-N 3.45Å; I243-V247 HydrophobicContact CG2-CG2 3.98Å; I243-V247 VanDerWaalsContact O-CB 3.31Å; I243-V247 WeakPolarHBondContact O-CB 3.49Å; I243-V247 VanDerWaalsContact O-CG2 3.3Å; I243-V247 WeakPolarHBondContact O-CG2 3.48Å; I243-V247 PolarHBondContact O-N 2.71Å; I243-I364 HydrophobicContact CD1-CD1 4.31Å; I243-I364 HydrophobicContact CD1-CG1 3.85Å; I243-I364 HydrophobicContact CG2-CG1 4.06Å; I243-A367 HydrophobicContact CG2-CB 3.94Å
244	G	86.2	Confident	84	Confident	20 Å²	20	44 Å²	44	21%	0.206	24%	0.241	C	C	.	.	H	α-helix	trans	-54.1	-50.8	171.7	0	0	0	0	0	111.3	T240 E241 T248	T240-G244 PolarHBondContact O-N 2.92Å; E241-G244 CarbonylContact O-C 3.54Å; E241-G244 PolarHBondContact O-N 3.3Å; G244-T248 VanDerWaalsContact O-CB 3.26Å; G244-T248 WeakPolarHBondContact O-CB 3.43Å; G244-T248 WeakPolarHBondContact O-CG2 3.31Å; G244-T248 PolarHBondContact O-N 3.15Å; G244-T248 PolarHBondContact O-OG1 2.98Å
245	E	84.6	Confident	84.3	Confident	67 Å²	67	43.3 Å²	43.3	31%	0.313	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-45	175.3	-74.6	-107	140.4	0	0	111.7	R192 A231 L237 E241 Q242 I243 V247 T248 T249	R192-E245 IonicContact CZ-OE1 3.51Å; R192-E245 IonicContact NH2-OE1 3.65Å; R192-E245 PolarHBondContact NH2-OE1 3.34Å; R192-E245 IonicContact NH2-OE2 2.67Å; A231-E245 HydrophobicContact CB-CB 4.29Å; L237-E245 HydrophobicContact CD1-CG 4.2Å; E241-E245 WeakPolarHBondContact O-CB 3.33Å; E241-E245 WeakPolarHBondContact O-CG 3.32Å; E241-E245 PolarHBondContact O-N 3.17Å; Q242-E245 PolarHBondContact O-N 3.38Å; I243-E245 VanDerWaalsContact C-N 3.33Å; I243-E245 PolarHBondContact O-N 3.32Å; E245-V247 PolarHBondContact O-N 2.86Å; E245-T248 WeakPolarHBondContact CA-OG1 3.34Å; E245-T248 PolarHBondContact O-N 3Å; E245-T248 PolarHBondContact O-OG1 2.83Å; E245-T249 VanDerWaalsContact O-CB 3.28Å; E245-T249 WeakPolarHBondContact O-CB 3.39Å; E245-T249 WeakPolarHBondContact O-CG2 3.5Å; E245-T249 PolarHBondContact O-N 2.76Å; E245-T249 PolarHBondContact O-OG1 2.93Å
246	C	88.3	Confident	84.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-47.5	178.4	-70.2	0	0	0	0	112.8	F228 L232 Q242 I243 T249 W250	F228-C246 HydrophobicContact CE2-CB 4.16Å; L232-C246 WeakPolarHBondContact CA-SG 3.5Å; L232-C246 PolarHBondContact N-SG 3.39Å; L232-C246 VanDerWaalsContact N-SG 3.39Å; Q242-C246 WeakPolarHBondContact O-CB 3.48Å; Q242-C246 PolarHBondContact O-N 3.12Å; Q242-C246 PolarHBondContact O-SG 3.49Å; I243-C246 PolarHBondContact O-N 3.45Å; C246-T249 WeakPolarHBondContact CA-OG1 3.4Å; C246-T249 PolarHBondContact O-OG1 3.05Å; C246-W250 VanDerWaalsContact O-CB 3.22Å; C246-W250 WeakPolarHBondContact O-CB 3.48Å; C246-W250 PolarHBondContact O-N 2.95Å
247	V	86.7	Confident	85.3	Confident	1 Å²	1	30 Å²	30	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-69.5	-41.3	-178.2	169.5	0	0	0	0	110.5	I243 E245 F251 A367 L368 V371 F396	I243-V247 HydrophobicContact CG2-CG2 3.98Å; I243-V247 VanDerWaalsContact O-CB 3.31Å; I243-V247 WeakPolarHBondContact O-CB 3.49Å; I243-V247 VanDerWaalsContact O-CG2 3.3Å; I243-V247 WeakPolarHBondContact O-CG2 3.48Å; I243-V247 PolarHBondContact O-N 2.71Å; E245-V247 PolarHBondContact O-N 2.86Å; V247-F251 VanDerWaalsContact O-CB 3.26Å; V247-F251 WeakPolarHBondContact O-CB 3.5Å; V247-F251 PolarHBondContact O-N 3.44Å; V247-A367 HydrophobicContact CB-CB 4.22Å; V247-A367 HydrophobicContact CG1-CB 4.35Å; V247-A367 HydrophobicContact CG2-CB 4.23Å; V247-L368 HydrophobicContact CG1-CD2 3.82Å; V247-L368 HydrophobicContact CG2-CD2 4.15Å; V247-V371 HydrophobicContact CG1-CG2 3.75Å; V247-F396 HydrophobicContact CG2-CE1 4.49Å
248	T	85.1	Confident	85.5	Confident	70 Å²	70	27.9 Å²	27.9	43%	0.429	15%	0.148	S	C	.	.	H	α-helix	trans	-67.8	-43.1	178	53.7	0	0	0	0	112.1	G244 E245 R252	G244-T248 VanDerWaalsContact O-CB 3.26Å; G244-T248 WeakPolarHBondContact O-CB 3.43Å; G244-T248 WeakPolarHBondContact O-CG2 3.31Å; G244-T248 PolarHBondContact O-N 3.15Å; G244-T248 PolarHBondContact O-OG1 2.98Å; E245-T248 WeakPolarHBondContact CA-OG1 3.34Å; E245-T248 PolarHBondContact O-N 3Å; E245-T248 PolarHBondContact O-OG1 2.83Å; T248-R252 WeakPolarHBondContact O-CB 3.47Å; T248-R252 PolarHBondContact O-N 2.92Å
249	T	84.7	Confident	85.4	Confident	14 Å²	14	29.6 Å²	29.6	9%	0.086	15%	0.15	C	C	.	.	H	α-helix	trans	-62	-48.1	175.7	52.3	0	0	0	0	111.1	P191 I227 E245 C246 F251 R252 T253	P191-T249 HydrophobicContact CG-CG2 3.92Å; I227-T249 HydrophobicContact CG2-CG2 4.33Å; E245-T249 VanDerWaalsContact O-CB 3.28Å; E245-T249 WeakPolarHBondContact O-CB 3.39Å; E245-T249 WeakPolarHBondContact O-CG2 3.5Å; E245-T249 PolarHBondContact O-N 2.76Å; E245-T249 PolarHBondContact O-OG1 2.93Å; C246-T249 WeakPolarHBondContact CA-OG1 3.4Å; C246-T249 PolarHBondContact O-OG1 3.05Å; T249-F251 PolarHBondContact O-N 2.81Å; T249-R252 PolarHBondContact O-N 3.44Å; T249-T253 WeakPolarHBondContact O-CB 3.32Å; T249-T253 PolarHBondContact O-N 2.71Å; T249-T253 PolarHBondContact O-OG1 3.44Å; T249-T253 VanDerWaalsContact O-OG1 3.04Å
250	W	87.4	Confident	85.3	Confident	3 Å²	3	28.9 Å²	28.9	1%	0.011	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-46.2	178.2	-177	91.2	0	0	0	112.6	F228 C246 R252 T253 I254 F332 L333 S336 W377 V392 F396	F228-W250 HydrophobicContact CD2-CB 3.96Å; F228-W250 HydrophobicContact CE2-CB 3.9Å; F228-W250 HydrophobicContact CE2-CG 4.33Å; C246-W250 VanDerWaalsContact O-CB 3.22Å; C246-W250 WeakPolarHBondContact O-CB 3.48Å; C246-W250 PolarHBondContact O-N 2.95Å; W250-R252 PolarHBondContact O-N 3.36Å; W250-T253 WeakPolarHBondContact O-CB 3.44Å; W250-T253 PolarHBondContact O-N 3.42Å; W250-I254 HydrophobicContact CD2-CD1 3.79Å; W250-I254 HydrophobicContact CE3-CD1 3.74Å; W250-I254 HydrophobicContact CH2-CD1 3.36Å; W250-I254 HydrophobicContact CZ2-CD1 3.47Å; W250-I254 VanDerWaalsContact CZ2-CD1 3.47Å; W250-I254 HydrophobicContact CZ3-CD1 3.52Å; W250-I254 PolarHBondContact O-N 2.94Å; W250-F332 AromaticContact CD1-CE1 3.72Å; W250-F332 AromaticContact CD1-CZ 3.95Å; W250-F332 AromaticContact NE1-CE1 3.77Å; W250-L333 HydrophobicContact CH2-CD2 4.26Å; W250-L333 HydrophobicContact CZ2-CD2 3.39Å; W250-S336 PolarHBondContact NE1-OG 3.28Å; W250-S336 VanDerWaalsContact NE1-OG 3.13Å; W250-W377 AromaticContact CH2-CH2 3.89Å; W250-W377 HydrophobicContact CH2-CH2 3.89Å; W250-W377 HydrophobicContact CH2-CZ2 4.38Å; W250-W377 AromaticContact CZ3-CH2 3.54Å; W250-W377 HydrophobicContact CZ3-CH2 3.54Å; W250-W377 HydrophobicContact CZ3-CZ2 4.02Å; W250-V392 HydrophobicContact CH2-CG1 3.38Å; W250-V392 HydrophobicContact CZ2-CG1 3.62Å; W250-F396 HydrophobicContact CD2-CE2 4.43Å; W250-F396 AromaticContact CD2-CZ 3.86Å; W250-F396 HydrophobicContact CD2-CZ 3.86Å; W250-F396 HydrophobicContact CE3-CE2 4.21Å; W250-F396 AromaticContact CE3-CZ 3.96Å; W250-F396 HydrophobicContact CE3-CZ 3.96Å; W250-F396 HydrophobicContact CG-CZ 4.33Å; W250-F396 HydrophobicContact CH2-CE2 4.03Å; W250-F396 HydrophobicContact CH2-CZ 4.4Å; W250-F396 HydrophobicContact CZ2-CE2 4.18Å; W250-F396 HydrophobicContact CZ2-CZ 4.25Å; W250-F396 HydrophobicContact CZ3-CE2 4.03Å; W250-F396 HydrophobicContact CZ3-CZ 4.25Å
251	F	84.1	Confident	85.2	Confident	23 Å²	23	25.7 Å²	25.7	10%	0.101	13%	0.128	C	C	.	.	H	α-helix	trans	-62	-45.2	176.1	172.3	-103.9	0	0	0	111.8	V247 T249 T253 I254 M255 V371 N374 W377	V247-F251 VanDerWaalsContact O-CB 3.26Å; V247-F251 WeakPolarHBondContact O-CB 3.5Å; V247-F251 PolarHBondContact O-N 3.44Å; T249-F251 PolarHBondContact O-N 2.81Å; F251-T253 VanDerWaalsContact C-N 3.32Å; F251-T253 PolarHBondContact O-N 3.06Å; F251-I254 PolarHBondContact O-N 3.5Å; F251-M255 HydrophobicContact CD1-CG 4.1Å; F251-M255 HydrophobicContact CD2-CG 4.25Å; F251-M255 HydrophobicContact CE1-CG 3.6Å; F251-M255 HydrophobicContact CE2-CG 3.82Å; F251-M255 HydrophobicContact CE2-SD 4.04Å; F251-M255 HydrophobicContact CG-CG 4.42Å; F251-M255 HydrophobicContact CZ-CG 3.46Å; F251-M255 VanDerWaalsContact CZ-CG 3.46Å; F251-M255 HydrophobicContact CZ-SD 3.83Å; F251-M255 WeakPolarHBondContact O-CG 3.37Å; F251-M255 PolarHBondContact O-N 3.47Å; F251-V371 HydrophobicContact CB-CG1 3.95Å; F251-V371 HydrophobicContact CB-CG2 3.9Å; F251-V371 HydrophobicContact CD1-CG1 4.19Å; F251-V371 HydrophobicContact CD1-CG2 4.25Å; F251-V371 HydrophobicContact CD2-CB 4.32Å; F251-V371 HydrophobicContact CD2-CG1 3.09Å; F251-V371 HydrophobicContact CD2-CG2 4.43Å; F251-V371 HydrophobicContact CE2-CG1 3.45Å; F251-V371 VanDerWaalsContact CE2-CG1 3.45Å; F251-V371 HydrophobicContact CG-CB 4.31Å; F251-V371 HydrophobicContact CG-CG1 3.47Å; F251-V371 VanDerWaalsContact CG-CG1 3.47Å; F251-V371 HydrophobicContact CG-CG2 3.94Å; F251-V371 HydrophobicContact CZ-CG1 4.17Å; F251-N374 HydrophobicContact CZ-CB 3.82Å; F251-W377 AromaticContact CD2-CD2 3.81Å; F251-W377 HydrophobicContact CD2-CD2 3.81Å; F251-W377 AromaticContact CD2-CE3 3.41Å; F251-W377 HydrophobicContact CD2-CE3 3.41Å; F251-W377 VanDerWaalsContact CD2-CE3 3.41Å; F251-W377 HydrophobicContact CD2-CG 4.46Å; F251-W377 HydrophobicContact CD2-CH2 4.09Å; F251-W377 HydrophobicContact CD2-CZ2 4.45Å; F251-W377 AromaticContact CD2-CZ3 3.55Å; F251-W377 HydrophobicContact CD2-CZ3 3.55Å; F251-W377 HydrophobicContact CE2-CB 3.73Å; F251-W377 AromaticContact CE2-CD2 3.39Å; F251-W377 HydrophobicContact CE2-CD2 3.39Å; F251-W377 AromaticContact CE2-CE3 3.16Å; F251-W377 HydrophobicContact CE2-CE3 3.16Å; F251-W377 AromaticContact CE2-CG 3.66Å; F251-W377 HydrophobicContact CE2-CG 3.66Å; F251-W377 AromaticContact CE2-CZ3 3.83Å; F251-W377 HydrophobicContact CE2-CZ3 3.83Å; F251-W377 HydrophobicContact CZ-CB 4.18Å; F251-W377 HydrophobicContact CZ-CE3 4.34Å
252	R	85.1	Confident	84.9	Confident	88 Å²	88	22.4 Å²	22.4	33%	0.332	11%	0.111	S	C	.	.	H	α-helix	trans	-65.4	-36.9	-179.9	-170.7	58.8	170.8	178.7	0.3	111.4	P191 T248 T249 W250 I254 M255 L256	P191-R252 HydrophobicContact CB-CG 4.39Å; P191-R252 WeakPolarHBondContact O-CG 3.44Å; T248-R252 WeakPolarHBondContact O-CB 3.47Å; T248-R252 PolarHBondContact O-N 2.92Å; T249-R252 PolarHBondContact O-N 3.44Å; W250-R252 PolarHBondContact O-N 3.36Å; R252-I254 VanDerWaalsContact C-N 3.33Å; R252-I254 PolarHBondContact O-N 2.91Å; R252-M255 PolarHBondContact O-N 2.95Å; R252-L256 HydrophobicContact CG-CD1 4Å; R252-L256 HydrophobicContact CG-CG 4.25Å; R252-L256 VanDerWaalsContact O-CB 3.31Å; R252-L256 WeakPolarHBondContact O-CB 3.36Å; R252-L256 VanDerWaalsContact O-CG 3.27Å; R252-L256 WeakPolarHBondContact O-CG 3.39Å; R252-L256 PolarHBondContact O-N 3.3Å
253	T	86.8	Confident	83.8	Confident	2 Å²	2	22 Å²	22	1%	0.012	11%	0.11	C	C	.	.	H	α-helix	trans	-55.6	-47.3	171.4	-69.5	0	0	0	0	111.5	F220 Y221 C224 T249 W250 F251 A257 F332	F220-T253 HydrophobicContact CE1-CG2 3.93Å; F220-T253 HydrophobicContact CZ-CG2 4.34Å; Y221-T253 HydrophobicContact CD1-CG2 3.94Å; Y221-T253 HydrophobicContact CE1-CG2 3.86Å; C224-T253 HydrophobicContact CB-CG2 3.48Å; C224-T253 VanDerWaalsContact CB-CG2 3.48Å; C224-T253 WeakPolarHBondContact CB-OG1 3.46Å; C224-T253 VanDerWaalsContact SG-CG2 3.54Å; C224-T253 PolarHBondContact SG-OG1 2.99Å; C224-T253 VanDerWaalsContact SG-OG1 3.34Å; T249-T253 WeakPolarHBondContact O-CB 3.32Å; T249-T253 PolarHBondContact O-N 2.71Å; T249-T253 PolarHBondContact O-OG1 3.44Å; T249-T253 VanDerWaalsContact O-OG1 3.04Å; W250-T253 WeakPolarHBondContact O-CB 3.44Å; W250-T253 PolarHBondContact O-N 3.42Å; F251-T253 VanDerWaalsContact C-N 3.32Å; F251-T253 PolarHBondContact O-N 3.06Å; T253-A257 WeakPolarHBondContact O-CB 3.19Å; T253-A257 PolarHBondContact O-N 3.41Å; T253-F332 HydrophobicContact CG2-CE1 3.87Å; T253-F332 HydrophobicContact CG2-CE2 4.39Å; T253-F332 HydrophobicContact CG2-CZ 3.77Å
254	I	86.5	Confident	82.9	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-67.5	-42.8	179.7	-64	165.2	0	0	0	110.8	W250 F251 R252 A257 H258 L333 W377 L384 F385	W250-I254 HydrophobicContact CD2-CD1 3.79Å; W250-I254 HydrophobicContact CE3-CD1 3.74Å; W250-I254 HydrophobicContact CH2-CD1 3.36Å; W250-I254 HydrophobicContact CZ2-CD1 3.47Å; W250-I254 VanDerWaalsContact CZ2-CD1 3.47Å; W250-I254 HydrophobicContact CZ3-CD1 3.52Å; W250-I254 PolarHBondContact O-N 2.94Å; F251-I254 PolarHBondContact O-N 3.5Å; R252-I254 VanDerWaalsContact C-N 3.33Å; R252-I254 PolarHBondContact O-N 2.91Å; I254-A257 PolarHBondContact O-N 3.18Å; I254-H258 WeakPolarHBondContact O-CB 3.36Å; I254-H258 PolarHBondContact O-N 3.12Å; I254-L333 HydrophobicContact CD1-CD2 4.4Å; I254-W377 HydrophobicContact CB-CZ3 4Å; I254-W377 HydrophobicContact CD1-CH2 3.78Å; I254-W377 HydrophobicContact CD1-CZ3 3.98Å; I254-W377 HydrophobicContact CG2-CH2 4.45Å; I254-W377 HydrophobicContact CG2-CZ3 3.69Å; I254-L384 HydrophobicContact CG2-CD1 3.78Å; I254-F385 HydrophobicContact CD1-CE2 4.14Å; I254-F385 HydrophobicContact CD1-CZ 3.75Å; I254-F385 HydrophobicContact CG1-CZ 4.05Å; I254-F385 HydrophobicContact CG2-CE2 3.98Å; I254-F385 HydrophobicContact CG2-CZ 3.74Å
255	M	85.2	Confident	81.6	Confident	11 Å²	11	33 Å²	33	5%	0.054	16%	0.163	C	C	.	.	H	α-helix	trans	-63.5	-41.8	177.8	-71.7	-56.3	-49.4	0	0	112.6	F251 R252 H258 E259 K376 W377 A380	F251-M255 HydrophobicContact CD1-CG 4.1Å; F251-M255 HydrophobicContact CD2-CG 4.25Å; F251-M255 HydrophobicContact CE1-CG 3.6Å; F251-M255 HydrophobicContact CE2-CG 3.82Å; F251-M255 HydrophobicContact CE2-SD 4.04Å; F251-M255 HydrophobicContact CG-CG 4.42Å; F251-M255 HydrophobicContact CZ-CG 3.46Å; F251-M255 VanDerWaalsContact CZ-CG 3.46Å; F251-M255 HydrophobicContact CZ-SD 3.83Å; F251-M255 WeakPolarHBondContact O-CG 3.37Å; F251-M255 PolarHBondContact O-N 3.47Å; R252-M255 PolarHBondContact O-N 2.95Å; M255-H258 WeakPolarHBondContact O-CB 3.45Å; M255-H258 PolarHBondContact O-N 2.93Å; M255-E259 WeakPolarHBondContact O-CB 3.5Å; M255-E259 PolarHBondContact O-N 3.38Å; M255-K376 HydrophobicContact CE-CB 3.56Å; M255-K376 HydrophobicContact CE-CD 4.21Å; M255-W377 HydrophobicContact SD-CE3 4.26Å; M255-A380 HydrophobicContact SD-CB 4.09Å
256	L	85.1	Confident	80.6	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-68	-40.7	175.9	-74.2	173.6	0	0	0	111.1	A195 F220 R252 H258 E259 I260	A195-L256 HydrophobicContact CB-CD2 3.86Å; F220-L256 HydrophobicContact CE2-CB 4.27Å; F220-L256 HydrophobicContact CZ-CB 3.83Å; R252-L256 HydrophobicContact CG-CD1 4Å; R252-L256 HydrophobicContact CG-CG 4.25Å; R252-L256 VanDerWaalsContact O-CB 3.31Å; R252-L256 WeakPolarHBondContact O-CB 3.36Å; R252-L256 VanDerWaalsContact O-CG 3.27Å; R252-L256 WeakPolarHBondContact O-CG 3.39Å; R252-L256 PolarHBondContact O-N 3.3Å; L256-H258 VanDerWaalsContact C-N 3.29Å; L256-H258 PolarHBondContact O-N 3.45Å; L256-E259 PolarHBondContact O-N 3.14Å; L256-I260 HydrophobicContact CB-CD1 4.29Å; L256-I260 VanDerWaalsContact O-CB 3.27Å; L256-I260 WeakPolarHBondContact O-CB 3.16Å; L256-I260 WeakPolarHBondContact O-CD1 3.5Å; L256-I260 WeakPolarHBondContact O-CG1 3.34Å; L256-I260 PolarHBondContact O-N 3.25Å
257	A	85.3	Confident	79.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-41.7	175.2	0	0	0	0	0	111.9	F220 Y221 T253 I254 F261 L325	F220-A257 HydrophobicContact CD1-CB 4.38Å; F220-A257 HydrophobicContact CE1-CB 3.74Å; F220-A257 HydrophobicContact CZ-CB 4.43Å; Y221-A257 HydrophobicContact CE1-CB 4.24Å; Y221-A257 WeakPolarHBondContact OH-CB 3.4Å; T253-A257 WeakPolarHBondContact O-CB 3.19Å; T253-A257 PolarHBondContact O-N 3.41Å; I254-A257 PolarHBondContact O-N 3.18Å; A257-F261 HydrophobicContact CB-CD2 4.44Å; A257-F261 WeakPolarHBondContact O-CB 3.28Å; A257-F261 PolarHBondContact O-N 3.26Å; A257-L325 HydrophobicContact CB-CD1 4.45Å
258	H	83.9	Confident	78.7	Confident	22 Å²	22	47.9 Å²	47.9	10%	0.102	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-48.2	174.5	-174.6	-106.1	0	0	0	111.5	I254 M255 L256 Y262 A380 E383 L384	I254-H258 WeakPolarHBondContact O-CB 3.36Å; I254-H258 PolarHBondContact O-N 3.12Å; M255-H258 WeakPolarHBondContact O-CB 3.45Å; M255-H258 PolarHBondContact O-N 2.93Å; L256-H258 VanDerWaalsContact C-N 3.29Å; L256-H258 PolarHBondContact O-N 3.45Å; H258-Y262 AromaticContact CD2-CG 3.84Å; H258-Y262 AromaticContact NE2-CD1 3.65Å; H258-Y262 AromaticContact NE2-CG 3.87Å; H258-Y262 WeakPolarHBondContact O-CB 3.42Å; H258-Y262 PolarHBondContact O-N 3.03Å; H258-A380 HydrophobicContact CB-CB 4.09Å; H258-E383 IonicContact CD2-OE2 2.73Å; H258-E383 IonicContact CE1-OE2 2.65Å; H258-E383 PolarHBondContact CE1-OE2 3.37Å; H258-E383 IonicContact NE2-OE2 3.28Å; H258-E383 PolarHBondContact NE2-OE2 3.09Å; H258-L384 HydrophobicContact CB-CD1 4.08Å
259	E	81.7	Confident	78.3	Confident	85 Å²	85	44.7 Å²	44.7	40%	0.397	22%	0.218	S	C	.	.	H	α-helix	trans	-68.9	-36.2	-178.4	-170.3	160.5	-156.5	0	0	113.3	A195 M255 L256 L270	A195-E259 HydrophobicContact CB-CB 4.43Å; A195-E259 HydrophobicContact CB-CG 3.85Å; M255-E259 WeakPolarHBondContact O-CB 3.5Å; M255-E259 PolarHBondContact O-N 3.38Å; L256-E259 PolarHBondContact O-N 3.14Å; E259-L270 WeakPolarHBondContact O-CB 3.42Å; E259-L270 PolarHBondContact O-N 3.11Å
260	I	81.7	Confident	78	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-83.8	-44.8	-174.7	-64.6	167.6	0	0	0	112.5	V198 L202 F220 L256 S269 L271	V198-I260 HydrophobicContact CB-CD1 3.92Å; V198-I260 HydrophobicContact CG1-CD1 3.58Å; L202-I260 HydrophobicContact CD1-CG2 3.98Å; F220-I260 HydrophobicContact CE2-CD1 4.35Å; L256-I260 HydrophobicContact CB-CD1 4.29Å; L256-I260 VanDerWaalsContact O-CB 3.27Å; L256-I260 WeakPolarHBondContact O-CB 3.16Å; L256-I260 WeakPolarHBondContact O-CD1 3.5Å; L256-I260 WeakPolarHBondContact O-CG1 3.34Å; L256-I260 PolarHBondContact O-N 3.25Å; I260-S269 VanDerWaalsContact O-CB 3.24Å; I260-S269 WeakPolarHBondContact O-CB 3.38Å; I260-S269 PolarHBondContact O-OG 3.15Å; I260-L271 HydrophobicContact CG2-CB 4.25Å; I260-L271 WeakPolarHBondContact O-CB 3.01Å; I260-L271 PolarHBondContact O-N 3.09Å; I260-L271 VanDerWaalsContact O-N 3.11Å
261	F	81.9	Confident	77.6	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-107.6	-29.4	-167.6	-62.5	-72.4	0	0	0	114.2	L202 L216 P217 F220 A257 T263 L271 L325	L202-F261 HydrophobicContact CD1-CE1 4.32Å; L202-F261 HydrophobicContact CD1-CE2 4.29Å; L202-F261 HydrophobicContact CD1-CZ 3.62Å; L216-F261 HydrophobicContact CB-CE1 3.74Å; L216-F261 HydrophobicContact CB-CZ 4.18Å; P217-F261 HydrophobicContact CG-CD1 4.04Å; P217-F261 HydrophobicContact CG-CE1 4.09Å; P217-F261 HydrophobicContact CG-CG 4.38Å; P217-F261 HydrophobicContact CG-CZ 4.45Å; F220-F261 HydrophobicContact CB-CE2 3.86Å; F220-F261 HydrophobicContact CB-CZ 3.95Å; F220-F261 AromaticContact CD1-CE2 3.96Å; F220-F261 HydrophobicContact CD1-CE2 3.96Å; F220-F261 HydrophobicContact CD2-CE2 4.35Å; F220-F261 AromaticContact CG-CE2 3.78Å; F220-F261 HydrophobicContact CG-CE2 3.78Å; F220-F261 HydrophobicContact CG-CZ 4.32Å; A257-F261 HydrophobicContact CB-CD2 4.44Å; A257-F261 WeakPolarHBondContact O-CB 3.28Å; A257-F261 PolarHBondContact O-N 3.26Å; F261-T263 PolarHBondContact O-N 3.17Å; F261-L271 HydrophobicContact CD1-CD2 4.15Å; F261-L271 HydrophobicContact CE1-CD2 4.26Å; F261-L325 HydrophobicContact CB-CD1 3.76Å; F261-L325 HydrophobicContact CB-CD2 3.73Å; F261-L325 HydrophobicContact CB-CG 4.24Å; F261-L325 HydrophobicContact CD2-CD1 4.07Å; F261-L325 HydrophobicContact CG-CD1 4.15Å
262	Y	77.7	Confident	77.2	Confident	36 Å²	36	45 Å²	45	14%	0.141	22%	0.22	C	C	.	.			trans	-68.3	119.6	-172	-171.5	-100.3	0	0	0	111.2	H258 D264 S269 L325 E383 L384	H258-Y262 AromaticContact CD2-CG 3.84Å; H258-Y262 AromaticContact NE2-CD1 3.65Å; H258-Y262 AromaticContact NE2-CG 3.87Å; H258-Y262 WeakPolarHBondContact O-CB 3.42Å; H258-Y262 PolarHBondContact O-N 3.03Å; Y262-D264 HydrophobicContact CE1-CB 3.89Å; Y262-S269 VanDerWaalsContact O-CB 3.26Å; Y262-S269 WeakPolarHBondContact O-CB 3.49Å; Y262-L325 HydrophobicContact CD2-CD2 4.44Å; Y262-E383 HydrophobicContact CE1-CB 4.32Å; Y262-E383 HydrophobicContact CE1-CG 4.26Å; Y262-E383 WeakPolarHBondContact CE1-OE2 3.18Å; Y262-E383 HydrophobicContact CE2-CB 3.86Å; Y262-L384 HydrophobicContact CD2-CD2 4.44Å
263	T	65	Low	77	Confident	16 Å²	16	43.4 Å²	43.4	10%	0.098	22%	0.222	C	C	.	.			trans	-119.5	132.2	176.4	31.4	0	0	0	0	108.8	F261 R267 S269 V272 V322	F261-T263 PolarHBondContact O-N 3.17Å; T263-R267 WeakPolarHBondContact CA-O 3.46Å; T263-S269 WeakPolarHBondContact CG2-OG 3.38Å; T263-V272 HydrophobicContact CG2-CG2 4.1Å; T263-V322 VanDerWaalsContact OG1-CG2 3.29Å; T263-V322 WeakPolarHBondContact OG1-CG2 3.4Å
264	D	67.3	Low	76.5	Confident	82 Å²	82	43.9 Å²	43.9	44%	0.439	23%	0.225	S	C	.	.	B	Isolated β-bridge	trans	-138.7	171.3	172.3	-175	25.6	0	0	0	109	Y262 N266 R267	Y262-D264 HydrophobicContact CE1-CB 3.89Å; D264-N266 PolarHBondContact O-N 3.1Å; D264-R267 PolarHBondContact N-O 3.43Å; D264-R267 CarbonylContact O-C 3.6Å; D264-R267 PolarHBondContact O-N 3.1Å
265	L	60.4	Low	76	Confident	171 Å²	171	43.8 Å²	43.8	90%	0.895	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-30.1	-179.1	-66.6	172.6	0	0	0	113.4
266	N	62.8	Low	75.5	Confident	148 Å²	148	46.5 Å²	46.5	79%	0.791	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-15.4	-178.5	-65.7	-41.1	0	0	0	114.2	D264	D264-N266 PolarHBondContact O-N 3.1Å
267	R	67.4	Low	75.2	Confident	145 Å²	145	48.3 Å²	48.3	55%	0.547	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-137.4	117.1	-171.5	-72.2	-172.5	176.6	-171.7	-1.6	110.7	T263 D264	T263-R267 WeakPolarHBondContact CA-O 3.46Å; D264-R267 PolarHBondContact N-O 3.43Å; D264-R267 CarbonylContact O-C 3.6Å; D264-R267 PolarHBondContact O-N 3.1Å
268	V	67.5	Low	74.6	Confident	88 Å²	88	49.2 Å²	49.2	53%	0.533	26%	0.256	S	S	.	.			trans	-80.7	133.1	168	-173	0	0	0	0	107.8	V272	V268-V272 HydrophobicContact CG1-CB 3.69Å; V268-V272 HydrophobicContact CG1-CG1 3.57Å
269	S	76.9	Confident	73.9	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.021	27%	0.267	C	S	.	.			trans	-67.7	156.8	178.1	69.2	0	0	0	0	111	I260 Y262 T263 L271 V272 S273	I260-S269 VanDerWaalsContact O-CB 3.24Å; I260-S269 WeakPolarHBondContact O-CB 3.38Å; I260-S269 PolarHBondContact O-OG 3.15Å; Y262-S269 VanDerWaalsContact O-CB 3.26Å; Y262-S269 WeakPolarHBondContact O-CB 3.49Å; T263-S269 WeakPolarHBondContact CG2-OG 3.38Å; S269-L271 PolarHBondContact O-N 3.34Å; S269-V272 PolarHBondContact O-N 3.02Å; S269-V272 WeakPolarHBondContact OG-CG2 3.19Å; S269-V272 PolarHBondContact OG-N 3.01Å; S269-S273 PolarHBondContact O-N 3.31Å
270	L	78.5	Confident	73.3	Confident	42 Å²	42	53 Å²	53	22%	0.22	28%	0.281	C	S	.	.	H	α-helix	trans	-58.7	-40.9	177.5	-170.9	62.6	0	0	0	110.9	A195 C199 E259 V272 S273 T274	A195-L270 VanDerWaalsContact C-CD2 3.49Å; A195-L270 HydrophobicContact CB-CD2 3.87Å; A195-L270 WeakPolarHBondContact O-CD2 3.36Å; C199-L270 HydrophobicContact CB-CD2 3.92Å; C199-L270 HydrophobicContact CB-CG 4.09Å; E259-L270 WeakPolarHBondContact O-CB 3.42Å; E259-L270 PolarHBondContact O-N 3.11Å; L270-V272 PolarHBondContact O-N 2.78Å; L270-S273 WeakPolarHBondContact CA-OG 2.93Å; L270-S273 PolarHBondContact O-N 3.18Å; L270-S273 VanDerWaalsContact O-N 3.16Å; L270-S273 PolarHBondContact O-OG 2.88Å; L270-T274 WeakPolarHBondContact O-CB 3.46Å; L270-T274 PolarHBondContact O-N 3.37Å; L270-T274 PolarHBondContact O-OG1 3.43Å
271	L	79.5	Confident	72.6	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-54.6	-52.7	176	-174.2	80.8	0	0	0	112.2	C199 L213 L216 I260 F261 S269 S273 T274 L275	C199-L271 VanDerWaalsContact SG-CA 3.5Å; L213-L271 HydrophobicContact CD2-CD2 4.09Å; L216-L271 HydrophobicContact CD1-CD1 4.28Å; L216-L271 HydrophobicContact CD1-CD2 4.02Å; I260-L271 HydrophobicContact CG2-CB 4.25Å; I260-L271 WeakPolarHBondContact O-CB 3.01Å; I260-L271 PolarHBondContact O-N 3.09Å; I260-L271 VanDerWaalsContact O-N 3.11Å; F261-L271 HydrophobicContact CD1-CD2 4.15Å; F261-L271 HydrophobicContact CE1-CD2 4.26Å; S269-L271 PolarHBondContact O-N 3.34Å; L271-S273 VanDerWaalsContact C-N 3.28Å; L271-S273 PolarHBondContact O-N 2.77Å; L271-T274 PolarHBondContact O-N 2.9Å; L271-L275 HydrophobicContact CD1-CD1 4.39Å; L271-L275 HydrophobicContact CD2-CD1 4.35Å; L271-L275 HydrophobicContact CG-CD1 3.89Å; L271-L275 HydrophobicContact CG-CG 4.44Å; L271-L275 WeakPolarHBondContact O-CB 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.39Å; L271-L275 PolarHBondContact O-N 3.32Å
272	V	76.2	Confident	72.1	Confident	3 Å²	3	59.8 Å²	59.8	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-36.2	-178.6	175	0	0	0	0	110.5	T263 V268 S269 L270 N276 V314	T263-V272 HydrophobicContact CG2-CG2 4.1Å; V268-V272 HydrophobicContact CG1-CB 3.69Å; V268-V272 HydrophobicContact CG1-CG1 3.57Å; S269-V272 PolarHBondContact O-N 3.02Å; S269-V272 WeakPolarHBondContact OG-CG2 3.19Å; S269-V272 PolarHBondContact OG-N 3.01Å; L270-V272 PolarHBondContact O-N 2.78Å; V272-N276 VanDerWaalsContact O-CB 3.3Å; V272-N276 WeakPolarHBondContact O-CB 3.37Å; V272-N276 PolarHBondContact O-N 2.86Å; V272-N276 PolarHBondContact O-ND2 3.37Å; V272-V314 HydrophobicContact CG2-CG1 4.3Å
273	S	78.9	Confident	72	Confident	54 Å²	54	58.7 Å²	58.7	38%	0.378	32%	0.318	S	S	.	.	H	α-helix	trans	-65.3	-43.2	176	79.6	0	0	0	0	112.7	S269 L270 L271 N276 S277	S269-S273 PolarHBondContact O-N 3.31Å; L270-S273 WeakPolarHBondContact CA-OG 2.93Å; L270-S273 PolarHBondContact O-N 3.18Å; L270-S273 VanDerWaalsContact O-N 3.16Å; L270-S273 PolarHBondContact O-OG 2.88Å; L271-S273 VanDerWaalsContact C-N 3.28Å; L271-S273 PolarHBondContact O-N 2.77Å; S273-N276 PolarHBondContact O-N 2.86Å; S273-S277 PolarHBondContact O-N 3.39Å
274	T	78.2	Confident	72.4	Confident	12 Å²	12	60.5 Å²	60.5	7%	0.074	33%	0.334	C	S	.	.	H	α-helix	trans	-71	-39.9	179.5	-55.1	0	0	0	0	110.9	L270 L271 N276 S277 F278	L270-T274 WeakPolarHBondContact O-CB 3.46Å; L270-T274 PolarHBondContact O-N 3.37Å; L270-T274 PolarHBondContact O-OG1 3.43Å; L271-T274 PolarHBondContact O-N 2.9Å; T274-N276 PolarHBondContact O-N 3.49Å; T274-S277 WeakPolarHBondContact O-CB 3.2Å; T274-S277 PolarHBondContact O-N 3.49Å; T274-S277 VanDerWaalsContact O-N 3.12Å; T274-S277 PolarHBondContact O-OG 3.42Å; T274-F278 HydrophobicContact CG2-CE2 4.11Å; T274-F278 HydrophobicContact CG2-CZ 4.03Å; T274-F278 WeakPolarHBondContact O-CD2 3.47Å; T274-F278 PolarHBondContact O-N 3.32Å
275	L	75.3	Confident	72.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.2	-41.5	174	-68.5	172.4	0	0	0	111.9	M206 L213 L271 S277 F278 V311 V314	M206-L275 HydrophobicContact CE-CD1 4.37Å; M206-L275 HydrophobicContact SD-CD1 4.13Å; M206-L275 HydrophobicContact SD-CD2 3.97Å; L213-L275 HydrophobicContact CD2-CD1 3.71Å; L271-L275 HydrophobicContact CD1-CD1 4.39Å; L271-L275 HydrophobicContact CD2-CD1 4.35Å; L271-L275 HydrophobicContact CG-CD1 3.89Å; L271-L275 HydrophobicContact CG-CG 4.44Å; L271-L275 WeakPolarHBondContact O-CB 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.39Å; L271-L275 PolarHBondContact O-N 3.32Å; L275-S277 VanDerWaalsContact C-N 3.28Å; L275-S277 PolarHBondContact O-N 3.21Å; L275-F278 HydrophobicContact CD2-CD2 4.2Å; L275-F278 HydrophobicContact CD2-CE2 4.25Å; L275-F278 PolarHBondContact O-N 3.06Å; L275-V311 HydrophobicContact CD2-CG2 3.98Å; L275-V314 HydrophobicContact CD1-CG2 4.21Å
276	N	75.1	Confident	73.7	Confident	67 Å²	67	51.1 Å²	51.1	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-33	173.3	-74.1	-30.2	0	0	0	112.1	V272 S273 T274 F278 H279	V272-N276 VanDerWaalsContact O-CB 3.3Å; V272-N276 WeakPolarHBondContact O-CB 3.37Å; V272-N276 PolarHBondContact O-N 2.86Å; V272-N276 PolarHBondContact O-ND2 3.37Å; S273-N276 PolarHBondContact O-N 2.86Å; T274-N276 PolarHBondContact O-N 3.49Å; N276-F278 VanDerWaalsContact C-N 3.29Å; N276-F278 PolarHBondContact O-N 3.43Å; N276-H279 WeakPolarHBondContact O-CB 3.46Å; N276-H279 PolarHBondContact O-N 3.02Å
277	S	77.9	Confident	74.4	Confident	40 Å²	40	48.1 Å²	48.1	28%	0.28	27%	0.267	S	S	.	.	H	α-helix	trans	-64	-31.6	176.4	86.2	0	0	0	0	112.8	S273 T274 L275 H279 T280 C281	S273-S277 PolarHBondContact O-N 3.39Å; T274-S277 WeakPolarHBondContact O-CB 3.2Å; T274-S277 PolarHBondContact O-N 3.49Å; T274-S277 VanDerWaalsContact O-N 3.12Å; T274-S277 PolarHBondContact O-OG 3.42Å; L275-S277 VanDerWaalsContact C-N 3.28Å; L275-S277 PolarHBondContact O-N 3.21Å; S277-H279 PolarHBondContact O-N 3.19Å; S277-T280 PolarHBondContact O-N 3.16Å; S277-T280 VanDerWaalsContact O-N 3.11Å; S277-T280 PolarHBondContact O-OG1 3.43Å; S277-C281 WeakPolarHBondContact O-CB 3.37Å; S277-C281 PolarHBondContact O-N 3.29Å
278	F	72.5	Confident	75	Confident	18 Å²	18	47.6 Å²	47.6	8%	0.079	27%	0.271	C	S	.	.	H	α-helix	trans	-66.6	-19.8	176.2	-65.8	-48.4	0	0	0	114	A140 W144 C203 L207 T274 L275 N276 P310	A140-F278 HydrophobicContact CB-CE1 3.8Å; A140-F278 HydrophobicContact CB-CZ 3.79Å; W144-F278 HydrophobicContact CB-CD1 4.48Å; W144-F278 AromaticContact CD1-CD1 3.76Å; W144-F278 HydrophobicContact CG-CD1 4.48Å; W144-F278 PolarHBondContact NE1-O 3.07Å; C203-F278 HydrophobicContact CB-CE2 3.69Å; C203-F278 HydrophobicContact CB-CZ 4.02Å; L207-F278 HydrophobicContact CD1-CE2 4.37Å; T274-F278 HydrophobicContact CG2-CE2 4.11Å; T274-F278 HydrophobicContact CG2-CZ 4.03Å; T274-F278 WeakPolarHBondContact O-CD2 3.47Å; T274-F278 PolarHBondContact O-N 3.32Å; L275-F278 HydrophobicContact CD2-CD2 4.2Å; L275-F278 HydrophobicContact CD2-CE2 4.25Å; L275-F278 PolarHBondContact O-N 3.06Å; N276-F278 VanDerWaalsContact C-N 3.29Å; N276-F278 PolarHBondContact O-N 3.43Å; F278-P310 HydrophobicContact CB-CG 3.88Å
279	H	70.5	Confident	75.6	Confident	74 Å²	74	44.8 Å²	44.8	34%	0.343	25%	0.251	S	S	.	.	H	α-helix	trans	-82.3	-28.7	173.3	-70.1	-65.3	0	0	0	112.9	N276 S277 V311	N276-H279 WeakPolarHBondContact O-CB 3.46Å; N276-H279 PolarHBondContact O-N 3.02Å; S277-H279 PolarHBondContact O-N 3.19Å; H279-V311 PolarHBondContact CE1-O 3.26Å; H279-V311 PolarHBondContact NE2-O 2.9Å
280	T	67.3	Low	75.7	Confident	112 Å²	112	44.8 Å²	44.8	69%	0.687	25%	0.251	S	S	*	.	H	α-helix	trans	-99.8	-36	-174.8	56.3	0	0	0	0	113.2	S277	S277-T280 PolarHBondContact O-N 3.16Å; S277-T280 VanDerWaalsContact O-N 3.11Å; S277-T280 PolarHBondContact O-OG1 3.43Å
281	C	66.9	Low	75.7	Confident	82 Å²	82	45.9 Å²	45.9	55%	0.554	27%	0.266	S	S	*	.			trans	-109.8	118.1	-171.2	-65.9	0	0	0	0	109.9	S277	S277-C281 WeakPolarHBondContact O-CB 3.37Å; S277-C281 PolarHBondContact O-N 3.29Å
282	K	73	Confident	75.9	Confident	61 Å²	61	51.7 Å²	51.7	27%	0.265	30%	0.301	S	S	.	.			trans	-87	141.2	172.8	171.2	-176.2	168.3	-167.9	0	109.6	I286 D287	K282-I286 HydrophobicContact CD-CB 4.48Å; K282-I286 HydrophobicContact CD-CG2 4.41Å; K282-I286 HydrophobicContact CG-CB 4.31Å; K282-I286 VanDerWaalsContact NZ-C 3.32Å; K282-I286 PolarHBondContact NZ-O 2.8Å; K282-I286 VanDerWaalsContact NZ-O 3.11Å; K282-D287 VanDerWaalsContact CD-OD1 3.25Å; K282-D287 WeakPolarHBondContact CD-OD1 3.39Å; K282-D287 WeakPolarHBondContact CE-OD1 3.42Å; K282-D287 VanDerWaalsContact NZ-CA 3.32Å; K282-D287 IonicContact NZ-OD1 3.59Å; K282-D287 PolarHBondContact NZ-OD1 2.85Å
283	P	74	Confident	76	Confident	13 Å²	13	53.8 Å²	53.8	8%	0.084	31%	0.31	C	S	.	.			trans	-62.9	144	174.6	-22.5	33.4	0	0	0	113.2	T141 W144 E285 I286 D287	T141-P283 HydrophobicContact CG2-CB 3.81Å; T141-P283 HydrophobicContact CG2-CG 4.18Å; W144-P283 HydrophobicContact CB-CG 4.41Å; W144-P283 HydrophobicContact CD2-CG 3.64Å; W144-P283 HydrophobicContact CE3-CG 3.51Å; W144-P283 HydrophobicContact CG-CG 4.06Å; W144-P283 HydrophobicContact CZ3-CG 4.01Å; P283-E285 VanDerWaalsContact CB-OE2 3.3Å; P283-E285 WeakPolarHBondContact CB-OE2 3.42Å; P283-E285 PolarHBondContact O-N 2.65Å; P283-I286 PolarHBondContact O-N 2.84Å; P283-I286 VanDerWaalsContact O-N 3.15Å; P283-D287 PolarHBondContact O-N 2.89Å
284	A	74.2	Confident	76	Confident	54 Å²	54	60.6 Å²	60.6	45%	0.446	33%	0.328	S	S	.	.	H	α-helix	trans	-61.8	-31.2	-175.5	0	0	0	0	0	112.6	I286 D287 Q288	A284-I286 VanDerWaalsContact C-N 3.3Å; A284-I286 PolarHBondContact O-N 3.11Å; A284-D287 PolarHBondContact O-N 3.46Å; A284-D287 VanDerWaalsContact O-N 3.17Å; A284-Q288 VanDerWaalsContact O-CG 3.3Å; A284-Q288 WeakPolarHBondContact O-CG 3.38Å; A284-Q288 PolarHBondContact O-N 3.2Å
285	E	77.2	Confident	75.8	Confident	56 Å²	56	70.5 Å²	70.5	26%	0.262	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-40	178.8	-61.7	76.2	-166.5	0	0	111	M129 L133 P283 Y289	M129-E285 HydrophobicContact SD-CB 4.18Å; L133-E285 HydrophobicContact CD1-CG 4.21Å; P283-E285 VanDerWaalsContact CB-OE2 3.3Å; P283-E285 WeakPolarHBondContact CB-OE2 3.42Å; P283-E285 PolarHBondContact O-N 2.65Å; E285-Y289 WeakPolarHBondContact O-CB 3.3Å; E285-Y289 PolarHBondContact O-N 3.34Å
286	I	78.1	Confident	75.6	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-76.8	-29.8	177.7	-54	-55.5	0	0	0	111	L126 M129 W144 L145 L148 K282 P283 A284 Y289 I290 L305	L126-I286 HydrophobicContact CD2-CD1 3.75Å; M129-I286 HydrophobicContact CE-CD1 3.55Å; M129-I286 HydrophobicContact SD-CD1 4.13Å; W144-I286 HydrophobicContact CH2-CG1 4.26Å; W144-I286 HydrophobicContact CZ3-CG1 3.71Å; L145-I286 HydrophobicContact CD2-CD1 3.45Å; L145-I286 VanDerWaalsContact CD2-CD1 3.45Å; L145-I286 HydrophobicContact CD2-CG1 3.79Å; L148-I286 HydrophobicContact CD2-CD1 4.46Å; K282-I286 HydrophobicContact CD-CB 4.48Å; K282-I286 HydrophobicContact CD-CG2 4.41Å; K282-I286 HydrophobicContact CG-CB 4.31Å; K282-I286 VanDerWaalsContact NZ-C 3.32Å; K282-I286 PolarHBondContact NZ-O 2.8Å; K282-I286 VanDerWaalsContact NZ-O 3.11Å; P283-I286 PolarHBondContact O-N 2.84Å; P283-I286 VanDerWaalsContact O-N 3.15Å; A284-I286 VanDerWaalsContact C-N 3.3Å; A284-I286 PolarHBondContact O-N 3.11Å; I286-Y289 PolarHBondContact O-N 3Å; I286-I290 HydrophobicContact CG2-CD1 4.06Å; I286-I290 HydrophobicContact CG2-CG1 4.24Å; I286-I290 WeakPolarHBondContact O-CB 3.36Å; I286-I290 VanDerWaalsContact O-CG1 3.26Å; I286-I290 WeakPolarHBondContact O-CG1 3.43Å; I286-I290 PolarHBondContact O-N 3.01Å; I286-L305 HydrophobicContact CG2-CD1 3.9Å
287	D	77.1	Confident	75.6	Confident	85 Å²	85	71.3 Å²	71.3	46%	0.455	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-44.2	172.4	-83.5	-37.6	0	0	0	111.3	K282 P283 A284 I290 A291	K282-D287 VanDerWaalsContact CD-OD1 3.25Å; K282-D287 WeakPolarHBondContact CD-OD1 3.39Å; K282-D287 WeakPolarHBondContact CE-OD1 3.42Å; K282-D287 VanDerWaalsContact NZ-CA 3.32Å; K282-D287 IonicContact NZ-OD1 3.59Å; K282-D287 PolarHBondContact NZ-OD1 2.85Å; P283-D287 PolarHBondContact O-N 2.89Å; A284-D287 PolarHBondContact O-N 3.46Å; A284-D287 VanDerWaalsContact O-N 3.17Å; D287-I290 PolarHBondContact O-N 3.43Å; D287-A291 WeakPolarHBondContact O-CB 3.33Å; D287-A291 PolarHBondContact O-N 3.2Å
288	Q	79.6	Confident	75.5	Confident	134 Å²	134	74.3 Å²	74.3	63%	0.626	38%	0.378	S	S	*	.	H	α-helix	trans	-62.2	-44.7	173.8	-68.8	174.3	26.5	0	0	111.3	A284 A291 V292	A284-Q288 VanDerWaalsContact O-CG 3.3Å; A284-Q288 WeakPolarHBondContact O-CG 3.38Å; A284-Q288 PolarHBondContact O-N 3.2Å; Q288-A291 PolarHBondContact O-N 2.93Å; Q288-V292 WeakPolarHBondContact O-CG2 3.49Å; Q288-V292 PolarHBondContact O-N 2.8Å
289	Y	80.7	Confident	75.6	Confident	30 Å²	30	78.9 Å²	78.9	12%	0.118	40%	0.4	C	S	.	.	H	α-helix	trans	-59.2	-51.7	177.3	-177.2	-94.2	0	0	0	111.8	F122 D125 E285 I286 A291 V292 Q293 L301	F122-Y289 AromaticContact CD2-CD1 3.92Å; F122-Y289 HydrophobicContact CD2-CD1 3.92Å; F122-Y289 AromaticContact CD2-CE1 3.25Å; F122-Y289 HydrophobicContact CD2-CE1 3.25Å; F122-Y289 AromaticContact CD2-CZ 3.65Å; F122-Y289 AromaticContact CE2-CD1 3.66Å; F122-Y289 HydrophobicContact CE2-CD1 3.66Å; F122-Y289 AromaticContact CE2-CE1 3.51Å; F122-Y289 HydrophobicContact CE2-CE1 3.51Å; F122-Y289 HydrophobicContact CG-CE1 4.35Å; D125-Y289 HydrophobicContact CB-CD2 4.45Å; D125-Y289 HydrophobicContact CB-CE2 3.59Å; D125-Y289 WeakPolarHBondContact OD2-CE2 3.26Å; D125-Y289 VanDerWaalsContact OD2-CZ 3.25Å; D125-Y289 PolarHBondContact OD2-OH 3.44Å; E285-Y289 WeakPolarHBondContact O-CB 3.3Å; E285-Y289 PolarHBondContact O-N 3.34Å; I286-Y289 PolarHBondContact O-N 3Å; Y289-A291 VanDerWaalsContact C-N 3.26Å; Y289-A291 PolarHBondContact O-N 3.3Å; Y289-V292 PolarHBondContact O-N 3Å; Y289-V292 VanDerWaalsContact O-N 3.12Å; Y289-Q293 HydrophobicContact CD1-CG 4.14Å; Y289-Q293 HydrophobicContact CE1-CG 3.78Å; Y289-Q293 WeakPolarHBondContact O-CG 3.32Å; Y289-Q293 PolarHBondContact O-N 3.5Å; Y289-Q293 PolarHBondContact OH-NE2 2.97Å; Y289-L301 HydrophobicContact CD1-CD1 4.37Å; Y289-L301 HydrophobicContact CE1-CD1 3.84Å
290	I	78.4	Confident	75.7	Confident	3 Å²	3	75.3 Å²	75.3	2%	0.015	38%	0.384	C	S	.	.	H	α-helix	trans	-62.8	-34.5	-179.3	-68.8	-178.8	0	0	0	111.8	I286 D287 V292 Q293 R298 L301 E302 L305	I286-I290 HydrophobicContact CG2-CD1 4.06Å; I286-I290 HydrophobicContact CG2-CG1 4.24Å; I286-I290 WeakPolarHBondContact O-CB 3.36Å; I286-I290 VanDerWaalsContact O-CG1 3.26Å; I286-I290 WeakPolarHBondContact O-CG1 3.43Å; I286-I290 PolarHBondContact O-N 3.01Å; D287-I290 PolarHBondContact O-N 3.43Å; I290-V292 VanDerWaalsContact C-N 3.26Å; I290-V292 PolarHBondContact O-N 3.04Å; I290-Q293 PolarHBondContact O-N 2.7Å; I290-R298 HydrophobicContact CG2-CB 4.4Å; I290-R298 HydrophobicContact CG2-CG 3.64Å; I290-L301 HydrophobicContact CD1-CB 4.43Å; I290-E302 HydrophobicContact CD1-CG 4.49Å; I290-E302 HydrophobicContact CG2-CG 4.31Å; I290-L305 HydrophobicContact CD1-CD1 3.34Å
291	A	78.5	Confident	76.2	Confident	64 Å²	64	70.1 Å²	70.1	53%	0.529	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-30.9	177.6	0	0	0	0	0	113	D287 Q288 Y289	D287-A291 WeakPolarHBondContact O-CB 3.33Å; D287-A291 PolarHBondContact O-N 3.2Å; Q288-A291 PolarHBondContact O-N 2.93Å; Y289-A291 VanDerWaalsContact C-N 3.26Å; Y289-A291 PolarHBondContact O-N 3.3Å
292	V	83.7	Confident	76.8	Confident	123 Å²	123	70.1 Å²	70.1	75%	0.745	34%	0.343	S	S	*	.	H	α-helix	trans	-80.1	-22.5	179.3	176.2	0	0	0	0	112.3	Q288 Y289 I290	Q288-V292 WeakPolarHBondContact O-CG2 3.49Å; Q288-V292 PolarHBondContact O-N 2.8Å; Y289-V292 PolarHBondContact O-N 3Å; Y289-V292 VanDerWaalsContact O-N 3.12Å; I290-V292 VanDerWaalsContact C-N 3.26Å; I290-V292 PolarHBondContact O-N 3.04Å
293	Q	79.6	Confident	76.9	Confident	47 Å²	47	70.3 Å²	70.3	22%	0.22	35%	0.345	C	S	.	.	S	Bend	trans	-74.3	152.5	-175	-64.1	-54.6	-31.9	0	0	114.1	Y289 I290 H297 L301	Y289-Q293 HydrophobicContact CD1-CG 4.14Å; Y289-Q293 HydrophobicContact CE1-CG 3.78Å; Y289-Q293 WeakPolarHBondContact O-CG 3.32Å; Y289-Q293 PolarHBondContact O-N 3.5Å; Y289-Q293 PolarHBondContact OH-NE2 2.97Å; I290-Q293 PolarHBondContact O-N 2.7Å; Q293-H297 HydrophobicContact CB-CB 4.26Å; Q293-L301 HydrophobicContact CG-CD1 4.12Å
294	R	78.5	Confident	76.9	Confident	197 Å²	197	69.9 Å²	69.9	74%	0.743	34%	0.342	S	S	*	.			trans	-63.7	149.7	174.2	-65	-179.4	-178.1	167.3	1.4	111	A296 H297 R298	R294-A296 VanDerWaalsContact C-N 3.31Å; R294-A296 PolarHBondContact O-N 3.04Å; R294-A296 VanDerWaalsContact O-N 3.11Å; R294-H297 PolarHBondContact O-N 3.18Å; R294-R298 PolarHBondContact O-N 3.18Å
295	R	73.9	Confident	77	Confident	220 Å²	220	68.9 Å²	68.9	83%	0.83	33%	0.329	S	S	*	.	H	α-helix	trans	-46.2	-46.7	-176.9	-80.7	-172.2	-168	167.8	4.1	114.7	R298 Q299	R295-R298 PolarHBondContact O-N 3.47Å; R295-Q299 PolarHBondContact O-N 2.88Å; R295-Q299 VanDerWaalsContact O-N 3.1Å
296	A	70.1	Confident	76.7	Confident	45 Å²	45	70.5 Å²	70.5	37%	0.372	35%	0.352	S	S	.	.	H	α-helix	trans	-66.9	-38.3	-178.7	0	0	0	0	0	112.6	L110 R294 C300	L110-A296 HydrophobicContact CD1-CB 4.49Å; R294-A296 VanDerWaalsContact C-N 3.31Å; R294-A296 PolarHBondContact O-N 3.04Å; R294-A296 VanDerWaalsContact O-N 3.11Å; A296-C300 WeakPolarHBondContact O-CB 3.21Å; A296-C300 PolarHBondContact O-N 2.93Å
297	H	75.9	Confident	76.3	Confident	40 Å²	40	71.9 Å²	71.9	19%	0.185	36%	0.362	C	S	.	.	H	α-helix	trans	-70.9	-37.2	176	-59.7	-177.9	0	0	0	110.8	V118 Q293 R294 C300 L301	V118-H297 HydrophobicContact CG1-CB 4.23Å; V118-H297 VanDerWaalsContact CG2-CD2 3.45Å; V118-H297 WeakPolarHBondContact CG2-CD2 3.4Å; Q293-H297 HydrophobicContact CB-CB 4.26Å; R294-H297 PolarHBondContact O-N 3.18Å; H297-C300 WeakPolarHBondContact O-CB 3.31Å; H297-C300 PolarHBondContact O-N 3.4Å; H297-L301 VanDerWaalsContact O-CG 3.3Å; H297-L301 WeakPolarHBondContact O-CG 3.39Å; H297-L301 PolarHBondContact O-N 3.25Å
298	R	76	Confident	76	Confident	102 Å²	102	68.7 Å²	68.7	39%	0.385	34%	0.344	S	S	.	.	H	α-helix	trans	-60.2	-47.6	176.8	174.7	162	-174.5	161.6	5.1	112.7	I290 R294 R295 C300 L301 E302	I290-R298 HydrophobicContact CG2-CB 4.4Å; I290-R298 HydrophobicContact CG2-CG 3.64Å; R294-R298 PolarHBondContact O-N 3.18Å; R295-R298 PolarHBondContact O-N 3.47Å; R298-C300 VanDerWaalsContact C-N 3.33Å; R298-C300 PolarHBondContact O-N 2.89Å; R298-L301 PolarHBondContact O-N 2.73Å; R298-E302 HydrophobicContact CG-CG 4.28Å; R298-E302 VanDerWaalsContact CG-OE1 3.29Å; R298-E302 WeakPolarHBondContact CG-OE1 3.49Å; R298-E302 IonicContact CZ-OE1 2.82Å; R298-E302 IonicContact NE-OE1 3.51Å; R298-E302 PolarHBondContact NE-OE1 3.05Å; R298-E302 IonicContact NH2-OE1 3.27Å; R298-E302 WeakPolarHBondContact O-CB 3.49Å; R298-E302 VanDerWaalsContact O-CG 3.28Å; R298-E302 WeakPolarHBondContact O-CG 3.29Å; R298-E302 PolarHBondContact O-N 3.09Å
299	Q	75.3	Confident	75.4	Confident	114 Å²	114	71.2 Å²	71.2	53%	0.533	35%	0.348	S	S	.	.	H	α-helix	trans	-60.6	-43.2	176.1	-72.3	175.7	-17.5	0	0	112.1	R295 E302 E303	R295-Q299 PolarHBondContact O-N 2.88Å; R295-Q299 VanDerWaalsContact O-N 3.1Å; Q299-E302 PolarHBondContact O-N 2.79Å; Q299-E303 WeakPolarHBondContact O-CB 3.41Å; Q299-E303 PolarHBondContact O-N 3.36Å; Q299-E303 VanDerWaalsContact O-N 3.08Å
300	C	72.7	Confident	74.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-58.6	-47.4	176.6	-171.4	0	0	0	0	111.6	L108 L110 A296 H297 R298 L304	L108-C300 HydrophobicContact CD2-CB 4.43Å; L108-C300 WeakPolarHBondContact CD2-SG 3.41Å; L110-C300 HydrophobicContact CD1-CB 4.16Å; L110-C300 HydrophobicContact CD2-CB 4.41Å; A296-C300 WeakPolarHBondContact O-CB 3.21Å; A296-C300 PolarHBondContact O-N 2.93Å; H297-C300 WeakPolarHBondContact O-CB 3.31Å; H297-C300 PolarHBondContact O-N 3.4Å; R298-C300 VanDerWaalsContact C-N 3.33Å; R298-C300 PolarHBondContact O-N 2.89Å; C300-L304 WeakPolarHBondContact O-CD1 3.33Å; C300-L304 WeakPolarHBondContact O-CG 3.42Å; C300-L304 PolarHBondContact O-N 3.45Å
301	L	76.8	Confident	73.9	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-71.4	-39.1	179.2	-67.8	171.1	0	0	0	112.9	F122 Y289 I290 Q293 H297 R298 E303 L304 L305	F122-L301 HydrophobicContact CB-CD2 4.09Å; F122-L301 HydrophobicContact CD1-CD2 3.43Å; F122-L301 VanDerWaalsContact CD1-CD2 3.43Å; F122-L301 HydrophobicContact CD2-CD2 4.1Å; F122-L301 HydrophobicContact CE1-CD2 3.73Å; F122-L301 HydrophobicContact CE2-CD2 4.36Å; F122-L301 HydrophobicContact CG-CD2 3.61Å; F122-L301 HydrophobicContact CZ-CD2 4.18Å; Y289-L301 HydrophobicContact CD1-CD1 4.37Å; Y289-L301 HydrophobicContact CE1-CD1 3.84Å; I290-L301 HydrophobicContact CD1-CB 4.43Å; Q293-L301 HydrophobicContact CG-CD1 4.12Å; H297-L301 VanDerWaalsContact O-CG 3.3Å; H297-L301 WeakPolarHBondContact O-CG 3.39Å; H297-L301 PolarHBondContact O-N 3.25Å; R298-L301 PolarHBondContact O-N 2.73Å; L301-E303 VanDerWaalsContact C-N 3.33Å; L301-E303 PolarHBondContact O-N 3.11Å; L301-L304 HydrophobicContact CD2-CD1 4.41Å; L301-L304 PolarHBondContact O-N 3.18Å; L301-L305 WeakPolarHBondContact O-CB 3.05Å; L301-L305 WeakPolarHBondContact O-CG 3.47Å; L301-L305 PolarHBondContact O-N 3.34Å
302	E	79.4	Confident	73.1	Confident	82 Å²	82	75.4 Å²	75.4	38%	0.383	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-37.6	177.3	-75.8	171.7	175	0	0	111.6	I290 R298 Q299 L305 A306	I290-E302 HydrophobicContact CD1-CG 4.49Å; I290-E302 HydrophobicContact CG2-CG 4.31Å; R298-E302 HydrophobicContact CG-CG 4.28Å; R298-E302 VanDerWaalsContact CG-OE1 3.29Å; R298-E302 WeakPolarHBondContact CG-OE1 3.49Å; R298-E302 IonicContact CZ-OE1 2.82Å; R298-E302 IonicContact NE-OE1 3.51Å; R298-E302 PolarHBondContact NE-OE1 3.05Å; R298-E302 IonicContact NH2-OE1 3.27Å; R298-E302 WeakPolarHBondContact O-CB 3.49Å; R298-E302 VanDerWaalsContact O-CG 3.28Å; R298-E302 WeakPolarHBondContact O-CG 3.29Å; R298-E302 PolarHBondContact O-N 3.09Å; Q299-E302 PolarHBondContact O-N 2.79Å; E302-L305 PolarHBondContact O-N 3.27Å; E302-A306 WeakPolarHBondContact O-CB 3.24Å; E302-A306 PolarHBondContact O-N 3.01Å
303	E	75.2	Confident	71.7	Confident	65 Å²	65	74.4 Å²	74.4	30%	0.304	36%	0.363	S	S	.	.	H	α-helix	trans	-72.9	-35.2	176.4	-166.4	170.2	-178.9	0	0	113	V106 P109 Q299 L301 A306 S307	V106-E303 HydrophobicContact CG1-CG 4.02Å; P109-E303 WeakPolarHBondContact CD-OE2 3.35Å; Q299-E303 WeakPolarHBondContact O-CB 3.41Å; Q299-E303 PolarHBondContact O-N 3.36Å; Q299-E303 VanDerWaalsContact O-N 3.08Å; L301-E303 VanDerWaalsContact C-N 3.33Å; L301-E303 PolarHBondContact O-N 3.11Å; E303-A306 PolarHBondContact O-N 2.74Å; E303-S307 PolarHBondContact O-N 2.82Å; E303-S307 PolarHBondContact O-OG 3.32Å
304	L	74.3	Confident	70.7	Confident	5 Å²	5	72.8 Å²	72.8	3%	0.026	36%	0.357	C	S	.	.	H	α-helix	trans	-63.8	-43.7	170.3	-75.3	163	0	0	0	111.9	L108 L119 Y151 C300 L301 A306 S307 F308	L108-L304 HydrophobicContact CD1-CD2 3.85Å; L108-L304 HydrophobicContact CD1-CG 4.22Å; L108-L304 HydrophobicContact CD2-CD1 3.6Å; L108-L304 HydrophobicContact CD2-CD2 3.86Å; L108-L304 HydrophobicContact CD2-CG 3.52Å; L108-L304 HydrophobicContact CG-CD2 4.37Å; L108-L304 HydrophobicContact CG-CG 4.21Å; L119-L304 HydrophobicContact CD2-CD1 3.26Å; L119-L304 HydrophobicContact CD2-CD2 4.44Å; L119-L304 HydrophobicContact CD2-CG 4.47Å; L119-L304 HydrophobicContact CG-CD1 4.4Å; Y151-L304 HydrophobicContact CE1-CD2 4.47Å; C300-L304 WeakPolarHBondContact O-CD1 3.33Å; C300-L304 WeakPolarHBondContact O-CG 3.42Å; C300-L304 PolarHBondContact O-N 3.45Å; L301-L304 HydrophobicContact CD2-CD1 4.41Å; L301-L304 PolarHBondContact O-N 3.18Å; L304-A306 VanDerWaalsContact C-N 3.34Å; L304-S307 PolarHBondContact O-N 3.39Å; L304-S307 PolarHBondContact O-OG 3.48Å; L304-F308 PolarHBondContact O-N 2.88Å
305	L	75.3	Confident	69.6	Low	32 Å²	32	65.4 Å²	65.4	17%	0.168	34%	0.335	C	S	.	.	H	α-helix	trans	-69.9	-32.2	178	-71.7	173.8	0	0	0	112.4	W144 L148 I286 I290 L301 E302 S307 F308	W144-L305 HydrophobicContact CH2-CD2 3.89Å; W144-L305 HydrophobicContact CZ2-CD2 4.49Å; L148-L305 HydrophobicContact CD1-CD2 3.67Å; L148-L305 HydrophobicContact CD2-CD2 3.9Å; L148-L305 HydrophobicContact CG-CD2 4.47Å; I286-L305 HydrophobicContact CG2-CD1 3.9Å; I290-L305 HydrophobicContact CD1-CD1 3.34Å; L301-L305 WeakPolarHBondContact O-CB 3.05Å; L301-L305 WeakPolarHBondContact O-CG 3.47Å; L301-L305 PolarHBondContact O-N 3.34Å; E302-L305 PolarHBondContact O-N 3.27Å; L305-S307 PolarHBondContact O-N 3.37Å; L305-F308 PolarHBondContact O-N 3.01Å
306	A	72.8	Confident	68.7	Low	90 Å²	90	59 Å²	59	74%	0.744	32%	0.322	S	S	*	.	H	α-helix	trans	-64.9	-27.8	174.1	0	0	0	0	0	112.8	E302 E303 L304	E302-A306 WeakPolarHBondContact O-CB 3.24Å; E302-A306 PolarHBondContact O-N 3.01Å; E303-A306 PolarHBondContact O-N 2.74Å; L304-A306 VanDerWaalsContact C-N 3.34Å
307	S	68.5	Low	67.8	Low	29 Å²	29	61.4 Å²	61.4	20%	0.203	34%	0.336	C	S	.	.	H	α-helix	trans	-91.1	-16.8	175.9	54.4	0	0	0	0	113.6	Y151 E303 L304 L305 R309	Y151-S307 WeakPolarHBondContact OH-CB 3.5Å; Y151-S307 PolarHBondContact OH-OG 3.31Å; E303-S307 PolarHBondContact O-N 2.82Å; E303-S307 PolarHBondContact O-OG 3.32Å; L304-S307 PolarHBondContact O-N 3.39Å; L304-S307 PolarHBondContact O-OG 3.48Å; L305-S307 PolarHBondContact O-N 3.37Å; S307-R309 PolarHBondContact O-N 3.39Å
308	F	70.6	Confident	66.8	Low	18 Å²	18	62 Å²	62	8%	0.079	34%	0.341	C	S	.	.			trans	-70.1	119.2	-179.9	178.1	-117.8	0	0	0	111.2	W144 S147 L148 Y151 L304 L305 P310	W144-F308 HydrophobicContact CD2-CE1 4.34Å; W144-F308 AromaticContact CE2-CE1 3.8Å; W144-F308 HydrophobicContact CH2-CE1 4.45Å; W144-F308 HydrophobicContact CZ2-CD1 4.02Å; W144-F308 AromaticContact CZ2-CE1 3.88Å; W144-F308 HydrophobicContact CZ2-CE1 3.88Å; W144-F308 AromaticContact NE1-CE1 3.99Å; S147-F308 WeakPolarHBondContact OG-CZ 3.49Å; L148-F308 HydrophobicContact CB-CE1 4.2Å; L148-F308 HydrophobicContact CB-CE2 4.49Å; L148-F308 HydrophobicContact CB-CZ 4.03Å; L148-F308 HydrophobicContact CD1-CD1 4.11Å; L148-F308 HydrophobicContact CD1-CD2 4.21Å; L148-F308 HydrophobicContact CD1-CE1 4.33Å; L148-F308 HydrophobicContact CD1-CE2 4.43Å; L148-F308 HydrophobicContact CD1-CG 4.03Å; L148-F308 HydrophobicContact CD1-CZ 4.48Å; Y151-F308 HydrophobicContact CD1-CB 4.21Å; Y151-F308 AromaticContact CD1-CD2 3.75Å; Y151-F308 HydrophobicContact CD1-CD2 3.75Å; Y151-F308 HydrophobicContact CD1-CG 4.36Å; Y151-F308 HydrophobicContact CD2-CD2 4.02Å; Y151-F308 HydrophobicContact CE1-CB 4.12Å; Y151-F308 HydrophobicContact CE1-CD2 4.37Å; Y151-F308 AromaticContact CG-CD2 3.55Å; Y151-F308 HydrophobicContact CG-CD2 3.55Å; Y151-F308 HydrophobicContact CG-CE2 4.13Å; L304-F308 PolarHBondContact O-N 2.88Å; L305-F308 PolarHBondContact O-N 3.01Å; F308-P310 HydrophobicContact CE1-CB 3.83Å; F308-P310 HydrophobicContact CE1-CG 4.14Å; F308-P310 HydrophobicContact CZ-CB 3.72Å; F308-P310 HydrophobicContact CZ-CG 4.5Å
309	R	68.3	Low	66.1	Low	187 Å²	187	60 Å²	60	71%	0.706	35%	0.346	S	S	*	.			trans	-117	109	168.8	-67.5	-171.6	-179.9	-172.6	-0.3	108.2	S307 V311	S307-R309 PolarHBondContact O-N 3.39Å; R309-V311 VanDerWaalsContact C-N 3.25Å; R309-V311 PolarHBondContact O-N 3.33Å
310	P	64.1	Low	65.9	Low	17 Å²	17	60.7 Å²	60.7	11%	0.11	35%	0.353	C	S	.	.	S	Bend	trans	-66.5	-29.6	-176.8	21.7	-30.4	0	0	0	112.8	L207 F278 F308	L207-P310 HydrophobicContact CD2-CB 4.06Å; L207-P310 WeakPolarHBondContact CD2-O 3.48Å; F278-P310 HydrophobicContact CB-CG 3.88Å; F308-P310 HydrophobicContact CE1-CB 3.83Å; F308-P310 HydrophobicContact CE1-CG 4.14Å; F308-P310 HydrophobicContact CZ-CB 3.72Å; F308-P310 HydrophobicContact CZ-CG 4.5Å
311	V	63.4	Low	65.9	Low	20 Å²	20	61.1 Å²	61.1	12%	0.121	36%	0.355	C	S	.	.	S	Bend	trans	-133.9	149.4	-177.2	-165.6	0	0	0	0	108.5	L207 L275 H279 R309 V314	L207-V311 HydrophobicContact CD2-CG2 3.84Å; L275-V311 HydrophobicContact CD2-CG2 3.98Å; H279-V311 PolarHBondContact CE1-O 3.26Å; H279-V311 PolarHBondContact NE2-O 2.9Å; R309-V311 VanDerWaalsContact C-N 3.25Å; R309-V311 PolarHBondContact O-N 3.33Å; V311-V314 HydrophobicContact CG1-CG2 3.96Å
312	D	60.8	Low	65.8	Low	149 Å²	149	62.3 Å²	62.3	80%	0.797	36%	0.362	S	S	*	.			trans	-66.1	143.8	166.1	-69	-42.4	0	0	0	109.1	V314	D312-V314 WeakPolarHBondContact O-CG2 3.34Å; D312-V314 PolarHBondContact O-N 3.16Å
313	S	55.4	Low	65.9	Low	102 Å²	102	62.7 Å²	62.7	71%	0.713	37%	0.367	S	S	*	.			trans	-56.4	106.8	-175	53.6	0	0	0	0	110.9	S315	S313-S315 PolarHBondContact O-N 2.82Å
314	V	57.6	Low	66.2	Low	13 Å²	13	59.7 Å²	59.7	8%	0.079	35%	0.354	C	S	.	.			trans	-76.4	118	-179.3	-175.2	0	0	0	0	108.3	L213 V272 L275 V311 D312 I321	L213-V314 HydrophobicContact CD1-CG1 4.04Å; L213-V314 HydrophobicContact CD1-CG2 3.83Å; V272-V314 HydrophobicContact CG2-CG1 4.3Å; L275-V314 HydrophobicContact CD1-CG2 4.21Å; V311-V314 HydrophobicContact CG1-CG2 3.96Å; D312-V314 WeakPolarHBondContact O-CG2 3.34Å; D312-V314 PolarHBondContact O-N 3.16Å; V314-I321 HydrophobicContact CG1-CD1 4.46Å
315	S	56.2	Low	66.6	Low	42 Å²	42	59.5 Å²	59.5	29%	0.294	35%	0.352	S	S	.	.			trans	-80	133.4	174.7	98.8	0	0	0	0	108.4	S313 S317 D318	S313-S315 PolarHBondContact O-N 2.82Å; S315-S317 PolarHBondContact O-N 3.47Å; S315-S317 PolarHBondContact OG-OG 2.92Å; S315-D318 VanDerWaalsContact O-CG 3.29Å; S315-D318 PolarHBondContact O-N 2.74Å; S315-D318 PolarHBondContact OG-OD1 3.45Å
316	P	54.4	Low	67.1	Low	85 Å²	85	60.8 Å²	60.8	55%	0.552	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-15.4	176.2	25.8	-33.9	0	0	0	112.5	D318	P316-D318 VanDerWaalsContact C-N 3.35Å
317	S	51.3	Low	67.7	Low	96 Å²	96	63.8 Å²	63.8	67%	0.671	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	9.3	179.8	35.3	0	0	0	0	114.6	S315 A319	S315-S317 PolarHBondContact O-N 3.47Å; S315-S317 PolarHBondContact OG-OG 2.92Å; S317-A319 PolarHBondContact O-N 2.83Å
318	D	55.8	Low	68.6	Low	52 Å²	52	64.9 Å²	64.9	28%	0.278	35%	0.352	S	S	.	.			trans	-70.1	81.1	178.1	-70	-7.8	0	0	0	110.2	S315 P316 L320 I321	S315-D318 VanDerWaalsContact O-CG 3.29Å; S315-D318 PolarHBondContact O-N 2.74Å; S315-D318 PolarHBondContact OG-OD1 3.45Å; P316-D318 VanDerWaalsContact C-N 3.35Å; D318-L320 PolarHBondContact O-N 2.82Å; D318-I321 HydrophobicContact CB-CD1 4.16Å; D318-I321 HydrophobicContact CB-CG1 4.21Å; D318-I321 PolarHBondContact O-N 3.44Å
319	A	61.2	Low	69.3	Low	61 Å²	61	64.2 Å²	64.2	50%	0.504	35%	0.349	S	S	.	.	H	α-helix	trans	-48.4	-25.9	173.7	0	0	0	0	0	112.3	S317 I321 V322 D323	S317-A319 PolarHBondContact O-N 2.83Å; A319-I321 VanDerWaalsContact C-N 3.31Å; A319-I321 PolarHBondContact O-N 3.33Å; A319-V322 PolarHBondContact O-N 2.83Å; A319-D323 WeakPolarHBondContact O-CB 3.27Å; A319-D323 VanDerWaalsContact O-CG 3.29Å; A319-D323 PolarHBondContact O-N 3.04Å
320	L	70.5	Confident	70.2	Confident	128 Å²	128	57.6 Å²	57.6	67%	0.67	33%	0.334	S	S	*	.	H	α-helix	trans	-56.2	-38.4	174.1	-64.2	174.1	0	0	0	113.7	D318 A324	D318-L320 PolarHBondContact O-N 2.82Å; L320-A324 WeakPolarHBondContact O-CB 3.5Å; L320-A324 PolarHBondContact O-N 3.1Å
321	I	72.5	Confident	71.3	Confident	8 Å²	8	58.3 Å²	58.3	4%	0.041	34%	0.342	C	S	.	.	H	α-helix	trans	-71.6	-43.4	-179.3	-60	175.8	0	0	0	110	L213 V314 D318 A319 A324 L325	L213-I321 HydrophobicContact CB-CD1 4.08Å; L213-I321 HydrophobicContact CB-CG1 4.2Å; L213-I321 HydrophobicContact CD1-CD1 4.36Å; L213-I321 HydrophobicContact CD2-CD1 4.34Å; V314-I321 HydrophobicContact CG1-CD1 4.46Å; D318-I321 HydrophobicContact CB-CD1 4.16Å; D318-I321 HydrophobicContact CB-CG1 4.21Å; D318-I321 PolarHBondContact O-N 3.44Å; A319-I321 VanDerWaalsContact C-N 3.31Å; A319-I321 PolarHBondContact O-N 3.33Å; I321-A324 PolarHBondContact O-N 3.4Å; I321-L325 WeakPolarHBondContact O-CB 3.38Å; I321-L325 PolarHBondContact O-N 3.36Å
322	V	75.1	Confident	72.5	Confident	28 Å²	28	57.8 Å²	57.8	17%	0.17	34%	0.338	C	S	.	.	H	α-helix	trans	-67.2	-42.7	179.1	179.3	0	0	0	0	110.6	T263 A319 A324 L325 H326	T263-V322 VanDerWaalsContact OG1-CG2 3.29Å; T263-V322 WeakPolarHBondContact OG1-CG2 3.4Å; A319-V322 PolarHBondContact O-N 2.83Å; V322-A324 PolarHBondContact O-N 3.37Å; V322-L325 WeakPolarHBondContact O-CB 3.23Å; V322-L325 PolarHBondContact O-N 3.48Å; V322-H326 WeakPolarHBondContact CG1-NE2 3.34Å; V322-H326 PolarHBondContact O-CD2 3.33Å; V322-H326 PolarHBondContact O-N 3.05Å
323	D	80.7	Confident	73.7	Confident	89 Å²	89	51.7 Å²	51.7	48%	0.476	31%	0.305	S	S	.	.	H	α-helix	trans	-63.4	-41.2	175.3	-74.4	-16.2	0	0	0	112.2	A319 R327	A319-D323 WeakPolarHBondContact O-CB 3.27Å; A319-D323 VanDerWaalsContact O-CG 3.29Å; A319-D323 PolarHBondContact O-N 3.04Å; D323-R327 WeakPolarHBondContact O-CB 3.36Å; D323-R327 PolarHBondContact O-N 2.84Å
324	A	80.8	Confident	75.2	Confident	3 Å²	3	50.7 Å²	50.7	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-42	173.9	0	0	0	0	0	111.3	D214 L320 I321 V322 R327 E328	D214-A324 HydrophobicContact CB-CB 4.19Å; L320-A324 WeakPolarHBondContact O-CB 3.5Å; L320-A324 PolarHBondContact O-N 3.1Å; I321-A324 PolarHBondContact O-N 3.4Å; V322-A324 PolarHBondContact O-N 3.37Å; A324-R327 PolarHBondContact O-N 3.3Å; A324-E328 WeakPolarHBondContact O-CB 3.45Å; A324-E328 WeakPolarHBondContact O-CG 3.47Å; A324-E328 PolarHBondContact O-N 2.91Å
325	L	84	Confident	76.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.5	-53.1	175.6	179.1	64.8	0	0	0	110.8	P217 Y221 A257 F261 Y262 I321 V322 R327 E328 T329 L384	P217-L325 HydrophobicContact CB-CD1 4.32Å; Y221-L325 HydrophobicContact CE2-CD1 4.19Å; A257-L325 HydrophobicContact CB-CD1 4.45Å; F261-L325 HydrophobicContact CB-CD1 3.76Å; F261-L325 HydrophobicContact CB-CD2 3.73Å; F261-L325 HydrophobicContact CB-CG 4.24Å; F261-L325 HydrophobicContact CD2-CD1 4.07Å; F261-L325 HydrophobicContact CG-CD1 4.15Å; Y262-L325 HydrophobicContact CD2-CD2 4.44Å; I321-L325 WeakPolarHBondContact O-CB 3.38Å; I321-L325 PolarHBondContact O-N 3.36Å; V322-L325 WeakPolarHBondContact O-CB 3.23Å; V322-L325 PolarHBondContact O-N 3.48Å; L325-R327 VanDerWaalsContact C-N 3.34Å; L325-R327 PolarHBondContact O-N 3Å; L325-E328 PolarHBondContact O-N 2.99Å; L325-T329 HydrophobicContact CD1-CG2 3.92Å; L325-T329 HydrophobicContact CG-CG2 4.04Å; L325-T329 WeakPolarHBondContact O-CB 3.38Å; L325-T329 WeakPolarHBondContact O-CG2 3.11Å; L325-T329 PolarHBondContact O-N 2.69Å; L325-T329 PolarHBondContact O-OG1 2.89Å; L325-L384 HydrophobicContact CD2-CD2 3.77Å; L325-L384 HydrophobicContact CG-CD2 4.06Å
326	H	84.6	Confident	78.2	Confident	60 Å²	60	54.4 Å²	54.4	28%	0.278	30%	0.304	S	S	.	.	H	α-helix	trans	-59	-44.8	178.7	-74.3	-58.2	0	0	0	112.2	V322 E328 T329 A330 E383 L384	V322-H326 WeakPolarHBondContact CG1-NE2 3.34Å; V322-H326 PolarHBondContact O-CD2 3.33Å; V322-H326 PolarHBondContact O-N 3.05Å; H326-E328 PolarHBondContact O-N 3.23Å; H326-T329 WeakPolarHBondContact CA-OG1 3.31Å; H326-T329 PolarHBondContact O-N 3.32Å; H326-T329 PolarHBondContact O-OG1 3.35Å; H326-A330 PolarHBondContact O-N 3.45Å; H326-E383 PolarHBondContact CE1-O 3.43Å; H326-L384 PolarHBondContact ND1-O 3.48Å; H326-L384 VanDerWaalsContact ND1-O 3.15Å
327	R	86.9	Confident	79.8	Confident	153 Å²	153	51 Å²	51	58%	0.577	28%	0.281	S	S	*	.	H	α-helix	trans	-58.8	-48.5	178.2	-169.9	-170.5	-51.3	139.1	8.3	112	D323 A324 L325 A330 A331	D323-R327 WeakPolarHBondContact O-CB 3.36Å; D323-R327 PolarHBondContact O-N 2.84Å; A324-R327 PolarHBondContact O-N 3.3Å; L325-R327 VanDerWaalsContact C-N 3.34Å; L325-R327 PolarHBondContact O-N 3Å; R327-A330 PolarHBondContact O-N 3.44Å; R327-A331 PolarHBondContact O-N 3.33Å; R327-A331 VanDerWaalsContact O-N 3.08Å
328	E	85.9	Confident	81.6	Confident	52 Å²	52	50.9 Å²	50.9	24%	0.243	27%	0.273	C	S	.	.	H	α-helix	trans	-73.8	-32.1	-178.8	-64.5	-56.9	140.6	0	0	112.2	P217 Y221 A324 L325 H326 A331 F332	P217-E328 HydrophobicContact CB-CB 4.23Å; P217-E328 HydrophobicContact CB-CG 4.36Å; Y221-E328 HydrophobicContact CD2-CB 3.76Å; Y221-E328 HydrophobicContact CE2-CB 4.12Å; A324-E328 WeakPolarHBondContact O-CB 3.45Å; A324-E328 WeakPolarHBondContact O-CG 3.47Å; A324-E328 PolarHBondContact O-N 2.91Å; L325-E328 PolarHBondContact O-N 2.99Å; H326-E328 PolarHBondContact O-N 3.23Å; E328-A331 PolarHBondContact O-N 3.5Å; E328-F332 VanDerWaalsContact O-CB 3.31Å; E328-F332 WeakPolarHBondContact O-CB 3.4Å; E328-F332 PolarHBondContact O-N 3.14Å
329	T	86.1	Confident	83.2	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-60.7	-46.1	171.9	66.8	0	0	0	0	110.9	Y221 L325 H326 A331 F332 L333 L384	Y221-T329 HydrophobicContact CE2-CG2 3.9Å; Y221-T329 WeakPolarHBondContact OH-CG2 3.3Å; L325-T329 HydrophobicContact CD1-CG2 3.92Å; L325-T329 HydrophobicContact CG-CG2 4.04Å; L325-T329 WeakPolarHBondContact O-CB 3.38Å; L325-T329 WeakPolarHBondContact O-CG2 3.11Å; L325-T329 PolarHBondContact O-N 2.69Å; L325-T329 PolarHBondContact O-OG1 2.89Å; H326-T329 WeakPolarHBondContact CA-OG1 3.31Å; H326-T329 PolarHBondContact O-N 3.32Å; H326-T329 PolarHBondContact O-OG1 3.35Å; T329-A331 PolarHBondContact O-N 3.19Å; T329-F332 PolarHBondContact O-N 3.08Å; T329-L333 WeakPolarHBondContact O-CB 3.19Å; T329-L333 VanDerWaalsContact O-CG 3.32Å; T329-L333 WeakPolarHBondContact O-CG 3.29Å; T329-L333 PolarHBondContact O-N 3.45Å; T329-L384 HydrophobicContact CG2-CD2 3.98Å
330	A	86.3	Confident	84.5	Confident	49 Å²	49	46.2 Å²	46.2	41%	0.405	24%	0.242	S	C	.	.	H	α-helix	trans	-65.4	-39.8	179.1	0	0	0	0	0	111.6	H326 R327 T334	H326-A330 PolarHBondContact O-N 3.45Å; R327-A330 PolarHBondContact O-N 3.44Å; A330-T334 PolarHBondContact O-N 2.99Å; A330-T334 PolarHBondContact O-OG1 3.48Å
331	A	88.1	Confident	85.3	Confident	32 Å²	32	41.8 Å²	41.8	26%	0.264	22%	0.22	S	C	.	.	H	α-helix	trans	-64.7	-42.6	174.6	0	0	0	0	0	112	R327 E328 T329 K335	R327-A331 PolarHBondContact O-N 3.33Å; R327-A331 VanDerWaalsContact O-N 3.08Å; E328-A331 PolarHBondContact O-N 3.5Å; T329-A331 PolarHBondContact O-N 3.19Å; A331-K335 WeakPolarHBondContact O-CB 3.28Å; A331-K335 VanDerWaalsContact O-CG 3.31Å; A331-K335 WeakPolarHBondContact O-CG 3.26Å; A331-K335 PolarHBondContact O-N 3.13Å
332	F	88.8	Confident	86.1	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.035	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-45.1	175.9	174	-99.8	0	0	0	111.8	Y221 C224 F225 W250 T253 E328 T329 T334 K335 S336	Y221-F332 HydrophobicContact CD1-CB 3.62Å; Y221-F332 AromaticContact CD1-CD1 3.78Å; Y221-F332 HydrophobicContact CD1-CD1 3.78Å; Y221-F332 AromaticContact CD1-CD2 3.7Å; Y221-F332 HydrophobicContact CD1-CD2 3.7Å; Y221-F332 HydrophobicContact CD1-CE1 4.38Å; Y221-F332 HydrophobicContact CD1-CE2 4.3Å; Y221-F332 AromaticContact CD1-CG 3.39Å; Y221-F332 HydrophobicContact CD1-CG 3.39Å; Y221-F332 HydrophobicContact CE1-CB 4.16Å; Y221-F332 AromaticContact CE1-CD1 3.91Å; Y221-F332 HydrophobicContact CE1-CD1 3.91Å; Y221-F332 AromaticContact CE1-CG 3.97Å; Y221-F332 HydrophobicContact CE1-CG 3.97Å; Y221-F332 HydrophobicContact CG-CB 3.86Å; Y221-F332 HydrophobicContact CG-CD2 4.26Å; Y221-F332 HydrophobicContact CG-CG 4.07Å; C224-F332 HydrophobicContact CB-CE2 4.33Å; F225-F332 HydrophobicContact CB-CD2 4.25Å; F225-F332 HydrophobicContact CB-CE2 3.98Å; F225-F332 HydrophobicContact CD2-CD2 4.48Å; F225-F332 HydrophobicContact CD2-CE2 4.27Å; W250-F332 AromaticContact CD1-CE1 3.72Å; W250-F332 AromaticContact CD1-CZ 3.95Å; W250-F332 AromaticContact NE1-CE1 3.77Å; T253-F332 HydrophobicContact CG2-CE1 3.87Å; T253-F332 HydrophobicContact CG2-CE2 4.39Å; T253-F332 HydrophobicContact CG2-CZ 3.77Å; E328-F332 VanDerWaalsContact O-CB 3.31Å; E328-F332 WeakPolarHBondContact O-CB 3.4Å; E328-F332 PolarHBondContact O-N 3.14Å; T329-F332 PolarHBondContact O-N 3.08Å; F332-T334 PolarHBondContact O-N 2.85Å; F332-K335 PolarHBondContact O-N 3.22Å; F332-S336 WeakPolarHBondContact O-CB 3.36Å; F332-S336 PolarHBondContact O-N 3.27Å; F332-S336 PolarHBondContact O-OG 2.87Å
333	L	85.9	Confident	86.6	Confident	22 Å²	22	46.6 Å²	46.6	12%	0.115	24%	0.242	C	C	.	.	H	α-helix	trans	-55.3	-53.2	175.8	-78.2	-177.7	0	0	0	111	W250 I254 T329 K335 S336 L337 F385 V392	W250-L333 HydrophobicContact CH2-CD2 4.26Å; W250-L333 HydrophobicContact CZ2-CD2 3.39Å; I254-L333 HydrophobicContact CD1-CD2 4.4Å; T329-L333 WeakPolarHBondContact O-CB 3.19Å; T329-L333 VanDerWaalsContact O-CG 3.32Å; T329-L333 WeakPolarHBondContact O-CG 3.29Å; T329-L333 PolarHBondContact O-N 3.45Å; L333-K335 PolarHBondContact O-N 3.42Å; L333-S336 PolarHBondContact O-N 2.85Å; L333-S336 PolarHBondContact O-OG 3.31Å; L333-S336 VanDerWaalsContact O-OG 3.13Å; L333-L337 VanDerWaalsContact O-CB 3.25Å; L333-L337 WeakPolarHBondContact O-CB 3.28Å; L333-L337 WeakPolarHBondContact O-CD1 3.48Å; L333-L337 WeakPolarHBondContact O-CG 3.41Å; L333-L337 PolarHBondContact O-N 2.89Å; L333-F385 HydrophobicContact CD1-CD1 3.27Å; L333-F385 HydrophobicContact CD1-CE1 3.23Å; L333-F385 HydrophobicContact CD1-CG 4.07Å; L333-F385 HydrophobicContact CD1-CZ 4Å; L333-F385 HydrophobicContact CD2-CE1 3.91Å; L333-F385 HydrophobicContact CD2-CZ 3.91Å; L333-F385 HydrophobicContact CG-CD1 4.23Å; L333-F385 HydrophobicContact CG-CE1 3.68Å; L333-F385 HydrophobicContact CG-CZ 4.2Å; L333-V392 HydrophobicContact CD2-CG1 4.46Å
334	T	86.2	Confident	87	Confident	81 Å²	81	42.6 Å²	42.6	50%	0.497	22%	0.221	S	C	.	.	H	α-helix	trans	-58.9	-51.9	-179	-50.3	0	0	0	0	110.5	A330 F332 S336 L337 D338	A330-T334 PolarHBondContact O-N 2.99Å; A330-T334 PolarHBondContact O-OG1 3.48Å; F332-T334 PolarHBondContact O-N 2.85Å; T334-S336 PolarHBondContact O-N 2.9Å; T334-L337 PolarHBondContact O-N 3.41Å; T334-D338 VanDerWaalsContact O-CB 3.3Å; T334-D338 WeakPolarHBondContact O-CB 3.49Å; T334-D338 PolarHBondContact O-N 3.18Å
335	K	89.8	Confident	87.2	Confident	132 Å²	132	43.3 Å²	43.3	57%	0.574	23%	0.228	S	C	*	.	H	α-helix	trans	-63.4	-41.4	-179.1	-72.2	175.3	-178.8	173.5	0	113.7	F225 A331 F332 L333 A339	F225-K335 HydrophobicContact CE2-CB 4.07Å; A331-K335 WeakPolarHBondContact O-CB 3.28Å; A331-K335 VanDerWaalsContact O-CG 3.31Å; A331-K335 WeakPolarHBondContact O-CG 3.26Å; A331-K335 PolarHBondContact O-N 3.13Å; F332-K335 PolarHBondContact O-N 3.22Å; L333-K335 PolarHBondContact O-N 3.42Å; K335-A339 VanDerWaalsContact O-CB 3.28Å; K335-A339 WeakPolarHBondContact O-CB 3.48Å; K335-A339 PolarHBondContact O-N 3.18Å
336	S	88.3	Confident	87.4	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-70.9	-41	-178.7	58.1	0	0	0	0	111.8	F228 W250 F332 L333 T334 Y340	F228-S336 WeakPolarHBondContact CE1-O 3.49Å; W250-S336 PolarHBondContact NE1-OG 3.28Å; W250-S336 VanDerWaalsContact NE1-OG 3.13Å; F332-S336 WeakPolarHBondContact O-CB 3.36Å; F332-S336 PolarHBondContact O-N 3.27Å; F332-S336 PolarHBondContact O-OG 2.87Å; L333-S336 PolarHBondContact O-N 2.85Å; L333-S336 PolarHBondContact O-OG 3.31Å; L333-S336 VanDerWaalsContact O-OG 3.13Å; T334-S336 PolarHBondContact O-N 2.9Å; S336-Y340 VanDerWaalsContact O-CB 3.28Å; S336-Y340 WeakPolarHBondContact O-CB 3.4Å; S336-Y340 PolarHBondContact O-N 3.19Å
337	L	86.4	Confident	87.4	Confident	13 Å²	13	47.7 Å²	47.7	7%	0.068	25%	0.251	C	S	.	.	H	α-helix	trans	-71.1	-40.1	177.3	-65.3	171.2	0	0	0	111.4	L333 T334 Y340 T341 V392 I395 F396	L333-L337 VanDerWaalsContact O-CB 3.25Å; L333-L337 WeakPolarHBondContact O-CB 3.28Å; L333-L337 WeakPolarHBondContact O-CD1 3.48Å; L333-L337 WeakPolarHBondContact O-CG 3.41Å; L333-L337 PolarHBondContact O-N 2.89Å; T334-L337 PolarHBondContact O-N 3.41Å; L337-Y340 WeakPolarHBondContact O-CB 3.47Å; L337-Y340 PolarHBondContact O-N 3Å; L337-T341 VanDerWaalsContact O-CG2 3.27Å; L337-T341 WeakPolarHBondContact O-CG2 3.49Å; L337-T341 PolarHBondContact O-N 3.28Å; L337-T341 PolarHBondContact O-OG1 3.2Å; L337-V392 HydrophobicContact CD1-CG1 4.24Å; L337-I395 HydrophobicContact CB-CG2 3.96Å; L337-I395 HydrophobicContact CD1-CB 4.44Å; L337-I395 HydrophobicContact CD1-CD1 3.79Å; L337-I395 HydrophobicContact CD1-CG2 4.18Å; L337-I395 HydrophobicContact CD2-CB 4.32Å; L337-I395 HydrophobicContact CD2-CG2 3.94Å; L337-I395 HydrophobicContact CG-CG2 4.24Å; L337-F396 HydrophobicContact CD2-CD2 4.34Å; L337-F396 HydrophobicContact CD2-CE1 4.37Å; L337-F396 HydrophobicContact CD2-CE2 3.85Å; L337-F396 HydrophobicContact CD2-CZ 3.86Å
338	D	88.8	Confident	87.4	Confident	94 Å²	94	40.5 Å²	40.5	50%	0.503	22%	0.224	S	C	.	.	H	α-helix	trans	-60.3	-49.5	173.7	-71	-18.8	0	0	0	110.7	T334 Y340 T341 E342	T334-D338 VanDerWaalsContact O-CB 3.3Å; T334-D338 WeakPolarHBondContact O-CB 3.49Å; T334-D338 PolarHBondContact O-N 3.18Å; D338-Y340 VanDerWaalsContact C-N 3.33Å; D338-Y340 PolarHBondContact O-N 2.99Å; D338-T341 PolarHBondContact O-N 3.33Å; D338-T341 PolarHBondContact O-OG1 3.11Å; D338-E342 PolarHBondContact O-N 2.81Å
339	A	89.4	Confident	87.4	Confident	15 Å²	15	44 Å²	44	12%	0.124	24%	0.24	C	C	.	.	H	α-helix	trans	-59.6	-42.7	176.4	0	0	0	0	0	112.2	F225 L232 K335 E342 D343	F225-A339 HydrophobicContact CE2-CB 4.28Å; F225-A339 HydrophobicContact CZ-CB 4.25Å; L232-A339 HydrophobicContact CD2-CB 4.49Å; K335-A339 VanDerWaalsContact O-CB 3.28Å; K335-A339 WeakPolarHBondContact O-CB 3.48Å; K335-A339 PolarHBondContact O-N 3.18Å; A339-E342 PolarHBondContact O-N 3.03Å; A339-D343 PolarHBondContact O-N 3.35Å
340	Y	89.9	Confident	87.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.5	-49.2	175.3	-178.1	-92.4	0	0	0	111.4	F228 L232 S336 L337 D338 E342 V344 I364 F396 P399	F228-Y340 HydrophobicContact CZ-CD2 4.36Å; L232-Y340 HydrophobicContact CD1-CD2 4.02Å; S336-Y340 VanDerWaalsContact O-CB 3.28Å; S336-Y340 WeakPolarHBondContact O-CB 3.4Å; S336-Y340 PolarHBondContact O-N 3.19Å; L337-Y340 WeakPolarHBondContact O-CB 3.47Å; L337-Y340 PolarHBondContact O-N 3Å; D338-Y340 VanDerWaalsContact C-N 3.33Å; D338-Y340 PolarHBondContact O-N 2.99Å; Y340-E342 VanDerWaalsContact C-N 3.3Å; Y340-E342 PolarHBondContact O-N 3.08Å; Y340-V344 HydrophobicContact CD1-CG2 4.31Å; Y340-V344 HydrophobicContact CD2-CG2 3.75Å; Y340-V344 HydrophobicContact CE1-CB 4.37Å; Y340-V344 HydrophobicContact CE1-CG2 4.07Å; Y340-V344 HydrophobicContact CE2-CG2 3.5Å; Y340-V344 HydrophobicContact CG-CG2 4.15Å; Y340-V344 WeakPolarHBondContact O-CB 3.35Å; Y340-V344 WeakPolarHBondContact O-CG2 3.44Å; Y340-V344 PolarHBondContact O-N 3.4Å; Y340-I364 WeakPolarHBondContact OH-CD1 3.41Å; Y340-F396 AromaticContact CD1-CD1 3.98Å; Y340-F396 HydrophobicContact CD1-CD1 3.98Å; Y340-F396 HydrophobicContact CD1-CE1 4.47Å; Y340-F396 HydrophobicContact CD2-CD1 4.17Å; Y340-F396 HydrophobicContact CD2-CE1 4.13Å; Y340-F396 HydrophobicContact CE1-CB 4.31Å; Y340-F396 AromaticContact CE1-CD1 3.71Å; Y340-F396 HydrophobicContact CE1-CD1 3.71Å; Y340-F396 HydrophobicContact CE1-CG 4.43Å; Y340-F396 WeakPolarHBondContact CE1-O 3.45Å; Y340-F396 AromaticContact CE2-CD1 3.88Å; Y340-F396 HydrophobicContact CE2-CD1 3.88Å; Y340-F396 HydrophobicContact CE2-CE1 4.18Å; Y340-F396 HydrophobicContact CG-CD1 4.21Å; Y340-F396 HydrophobicContact CG-CE1 4.28Å; Y340-F396 AromaticContact CZ-CD1 3.65Å; Y340-P399 HydrophobicContact CD1-CG 4.25Å; Y340-P399 HydrophobicContact CE1-CG 4.1Å
341	T	86.2	Confident	87.2	Confident	35 Å²	35	47.5 Å²	47.5	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-37.9	-178.4	60	0	0	0	0	112.4	L337 D338 G345 I395 M398 P399	L337-T341 VanDerWaalsContact O-CG2 3.27Å; L337-T341 WeakPolarHBondContact O-CG2 3.49Å; L337-T341 PolarHBondContact O-N 3.28Å; L337-T341 PolarHBondContact O-OG1 3.2Å; D338-T341 PolarHBondContact O-N 3.33Å; D338-T341 PolarHBondContact O-OG1 3.11Å; T341-G345 WeakPolarHBondContact O-CA 3.24Å; T341-G345 PolarHBondContact O-N 3.19Å; T341-I395 HydrophobicContact CG2-CG2 4.26Å; T341-M398 HydrophobicContact CG2-SD 4.4Å; T341-P399 HydrophobicContact CG2-CG 3.95Å
342	E	88.9	Confident	87	Confident	115 Å²	115	51.1 Å²	51.1	54%	0.537	27%	0.274	S	S	.	.	H	α-helix	trans	-69.7	-53.5	178.8	-167.2	-171	155.5	0	0	112	D338 A339 Y340 G345 K346	D338-E342 PolarHBondContact O-N 2.81Å; A339-E342 PolarHBondContact O-N 3.03Å; Y340-E342 VanDerWaalsContact C-N 3.3Å; Y340-E342 PolarHBondContact O-N 3.08Å; E342-G345 PolarHBondContact O-N 3.35Å; E342-K346 WeakPolarHBondContact O-CG 3.43Å; E342-K346 PolarHBondContact O-N 3.49Å; E342-K346 WeakPolarHBondContact OE1-CE 3.05Å; E342-K346 IonicContact OE1-NZ 2.79Å; E342-K346 PolarHBondContact OE1-NZ 2.74Å
343	D	87.5	Confident	86.8	Confident	23 Å²	23	56 Å²	56	12%	0.123	30%	0.3	C	S	.	.	H	α-helix	trans	-77.5	-40.5	-171.9	-69	-27	0	0	0	112.1	L232 A339 G345 K346 T347	L232-D343 HydrophobicContact CD2-CB 3.75Å; L232-D343 HydrophobicContact CG-CB 3.96Å; A339-D343 PolarHBondContact O-N 3.35Å; D343-G345 VanDerWaalsContact C-N 3.27Å; D343-G345 PolarHBondContact O-N 3.38Å; D343-K346 WeakPolarHBondContact O-CB 2.96Å; D343-K346 PolarHBondContact O-N 2.95Å; D343-K346 IonicContact OD1-NZ 3.34Å; D343-K346 PolarHBondContact OD1-NZ 3.49Å; D343-T347 WeakPolarHBondContact O-CG2 3.36Å; D343-T347 PolarHBondContact O-N 3.27Å
344	V	87.6	Confident	86.8	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.03	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-39.1	170.1	179.8	0	0	0	0	109.8	L232 F239 Y340 K346 T347 L348 P399	L232-V344 HydrophobicContact CD1-CG2 3.86Å; F239-V344 HydrophobicContact CE2-CG1 4.38Å; Y340-V344 HydrophobicContact CD1-CG2 4.31Å; Y340-V344 HydrophobicContact CD2-CG2 3.75Å; Y340-V344 HydrophobicContact CE1-CB 4.37Å; Y340-V344 HydrophobicContact CE1-CG2 4.07Å; Y340-V344 HydrophobicContact CE2-CG2 3.5Å; Y340-V344 HydrophobicContact CG-CG2 4.15Å; Y340-V344 WeakPolarHBondContact O-CB 3.35Å; Y340-V344 WeakPolarHBondContact O-CG2 3.44Å; Y340-V344 PolarHBondContact O-N 3.4Å; V344-K346 VanDerWaalsContact C-N 3.32Å; V344-K346 PolarHBondContact O-N 3.29Å; V344-T347 WeakPolarHBondContact CA-OG1 3.44Å; V344-T347 PolarHBondContact O-N 3.36Å; V344-T347 VanDerWaalsContact O-N 3.15Å; V344-T347 PolarHBondContact O-OG1 3.01Å; V344-L348 HydrophobicContact CG1-CD1 3.66Å; V344-L348 HydrophobicContact CG1-CG 4.02Å; V344-L348 WeakPolarHBondContact O-CB 3.06Å; V344-L348 VanDerWaalsContact O-CG 3.26Å; V344-L348 WeakPolarHBondContact O-CG 3.27Å; V344-L348 PolarHBondContact O-N 2.64Å; V344-P399 HydrophobicContact CB-CB 4.45Å; V344-P399 HydrophobicContact CG1-CB 4.21Å
345	G	86.5	Confident	86.8	Confident	17 Å²	17	59.1 Å²	59.1	18%	0.175	31%	0.307	C	S	.	.	H	α-helix	trans	-52.2	-48.5	171.6	0	0	0	0	0	112.5	T341 E342 D343 L348 Q349	T341-G345 WeakPolarHBondContact O-CA 3.24Å; T341-G345 PolarHBondContact O-N 3.19Å; E342-G345 PolarHBondContact O-N 3.35Å; D343-G345 VanDerWaalsContact C-N 3.27Å; D343-G345 PolarHBondContact O-N 3.38Å; G345-L348 PolarHBondContact O-N 3.04Å; G345-Q349 VanDerWaalsContact O-CG 3.32Å; G345-Q349 WeakPolarHBondContact O-CG 3.41Å; G345-Q349 PolarHBondContact O-N 2.83Å
346	K	87.1	Confident	86.6	Confident	99 Å²	99	53.9 Å²	53.9	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-43	176	-69.5	167	-167	153.7	0	112.6	E342 D343 V344 L348 Q349	E342-K346 WeakPolarHBondContact O-CG 3.43Å; E342-K346 PolarHBondContact O-N 3.49Å; E342-K346 WeakPolarHBondContact OE1-CE 3.05Å; E342-K346 IonicContact OE1-NZ 2.79Å; E342-K346 PolarHBondContact OE1-NZ 2.74Å; D343-K346 WeakPolarHBondContact O-CB 2.96Å; D343-K346 PolarHBondContact O-N 2.95Å; D343-K346 IonicContact OD1-NZ 3.34Å; D343-K346 PolarHBondContact OD1-NZ 3.49Å; V344-K346 VanDerWaalsContact C-N 3.32Å; V344-K346 PolarHBondContact O-N 3.29Å; K346-L348 VanDerWaalsContact C-N 3.31Å; K346-L348 PolarHBondContact O-N 2.88Å; K346-Q349 PolarHBondContact O-N 3.49Å
347	T	85	Confident	86.5	Confident	54 Å²	54	53.9 Å²	53.9	33%	0.331	29%	0.286	S	S	.	.	H	α-helix	trans	-63.1	-39.5	178.2	63.6	0	0	0	0	112	D343 V344 S350	D343-T347 WeakPolarHBondContact O-CG2 3.36Å; D343-T347 PolarHBondContact O-N 3.27Å; V344-T347 WeakPolarHBondContact CA-OG1 3.44Å; V344-T347 PolarHBondContact O-N 3.36Å; V344-T347 VanDerWaalsContact O-N 3.15Å; V344-T347 PolarHBondContact O-OG1 3.01Å; T347-S350 PolarHBondContact O-OG 3.24Å
348	L	86.8	Confident	86.4	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-77.8	-20.2	-178.1	-64.8	174	0	0	0	113.6	F239 V344 G345 K346 S350 L351 L357 R360 P399 I400 R403	F239-L348 HydrophobicContact CE2-CD2 4.18Å; F239-L348 HydrophobicContact CZ-CD2 4.09Å; V344-L348 HydrophobicContact CG1-CD1 3.66Å; V344-L348 HydrophobicContact CG1-CG 4.02Å; V344-L348 WeakPolarHBondContact O-CB 3.06Å; V344-L348 VanDerWaalsContact O-CG 3.26Å; V344-L348 WeakPolarHBondContact O-CG 3.27Å; V344-L348 PolarHBondContact O-N 2.64Å; G345-L348 PolarHBondContact O-N 3.04Å; K346-L348 VanDerWaalsContact C-N 3.31Å; K346-L348 PolarHBondContact O-N 2.88Å; L348-S350 PolarHBondContact O-N 2.89Å; L348-S350 VanDerWaalsContact O-N 3.14Å; L348-L351 HydrophobicContact CD2-CD1 3.8Å; L348-L351 PolarHBondContact O-N 3.39Å; L348-L357 HydrophobicContact CD2-CD2 4.2Å; L348-R360 HydrophobicContact CD2-CB 4.47Å; L348-P399 HydrophobicContact CD1-CB 4.14Å; L348-I400 HydrophobicContact CD1-CB 4.33Å; L348-I400 HydrophobicContact CD1-CG1 3.48Å; L348-I400 VanDerWaalsContact CD1-CG1 3.48Å; L348-I400 HydrophobicContact CD2-CG1 4.41Å; L348-R403 HydrophobicContact CB-CB 4.37Å; L348-R403 HydrophobicContact CB-CG 4.18Å; L348-R403 PolarHBondContact O-NE 3.33Å
349	Q	85.6	Confident	86.3	Confident	125 Å²	125	55.3 Å²	55.3	58%	0.584	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.3	175.7	-81.4	169.3	18.5	0	0	112.8	G345 K346 L351 R403	G345-Q349 VanDerWaalsContact O-CG 3.32Å; G345-Q349 WeakPolarHBondContact O-CG 3.41Å; G345-Q349 PolarHBondContact O-N 2.83Å; K346-Q349 PolarHBondContact O-N 3.49Å; Q349-L351 VanDerWaalsContact C-N 3.29Å; Q349-L351 PolarHBondContact O-N 2.86Å; Q349-R403 PolarHBondContact O-NH2 3.08Å; Q349-R403 VanDerWaalsContact O-NH2 3.13Å
350	S	83.6	Confident	86.2	Confident	91 Å²	91	58.5 Å²	58.5	64%	0.636	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-20.1	176.6	66.9	0	0	0	0	114.1	T347 L348	T347-S350 PolarHBondContact O-OG 3.24Å; L348-S350 PolarHBondContact O-N 2.89Å; L348-S350 VanDerWaalsContact O-N 3.14Å
351	L	84.9	Confident	86	Confident	35 Å²	35	59 Å²	59	18%	0.183	30%	0.301	C	S	.	.			trans	-92.5	116	-172.4	-63.1	177.1	0	0	0	111.5	L348 Q349 L357 R360 R403	L348-L351 HydrophobicContact CD2-CD1 3.8Å; L348-L351 PolarHBondContact O-N 3.39Å; Q349-L351 VanDerWaalsContact C-N 3.29Å; Q349-L351 PolarHBondContact O-N 2.86Å; L351-L357 HydrophobicContact CB-CD2 4.06Å; L351-L357 HydrophobicContact CD1-CD2 3.96Å; L351-R360 HydrophobicContact CD1-CG 3.92Å; L351-R403 VanDerWaalsContact O-CZ 3.27Å; L351-R403 PolarHBondContact O-NE 3.49Å; L351-R403 PolarHBondContact O-NH2 2.9Å
352	N	83.4	Confident	85.9	Confident	108 Å²	108	61.6 Å²	61.6	58%	0.578	31%	0.311	S	S	*	.			trans	-102.7	-2.7	178.7	-65.2	-38.9	0	0	0	113.6	R403 V407	N352-R403 PolarHBondContact OD1-NH2 3.37Å; N352-V407 WeakPolarHBondContact O-CG1 3.27Å
353	D	85.8	Confident	85.8	Confident	110 Å²	110	57 Å²	57	59%	0.588	29%	0.292	S	S	*	.			trans	-108.7	127.4	-173.7	-59.9	-42.1	0	0	0	111.5	K355 S356 L357	D353-K355 VanDerWaalsContact C-N 3.27Å; D353-K355 PolarHBondContact O-N 3.05Å; D353-S356 PolarHBondContact O-N 3.48Å; D353-S356 PolarHBondContact O-OG 2.91Å; D353-L357 PolarHBondContact O-N 3.33Å
354	L	84.3	Confident	85.7	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.084	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-36.3	-179.9	-72.7	168.8	0	0	0	112.8	S356 L357 V358 V407 V408 I411 M472 A475	L354-S356 PolarHBondContact O-N 3.1Å; L354-L357 PolarHBondContact O-N 3.48Å; L354-L357 VanDerWaalsContact O-N 3.15Å; L354-V358 WeakPolarHBondContact O-CG2 3.46Å; L354-V358 PolarHBondContact O-N 3.43Å; L354-V407 HydrophobicContact CD2-CB 4.33Å; L354-V407 HydrophobicContact CD2-CG1 3.88Å; L354-V407 HydrophobicContact CG-CG1 3.86Å; L354-V408 HydrophobicContact CD1-CG2 4.26Å; L354-V408 HydrophobicContact CD2-CG2 3.93Å; L354-I411 HydrophobicContact CD1-CD1 3.73Å; L354-I411 HydrophobicContact CG-CD1 3.94Å; L354-M472 HydrophobicContact CD1-CB 4.35Å; L354-M472 HydrophobicContact CD1-CG 3.79Å; L354-A475 HydrophobicContact CB-CB 3.8Å; L354-A475 HydrophobicContact CD1-CB 4.25Å
355	K	86	Confident	85.5	Confident	154 Å²	154	58 Å²	58	67%	0.67	30%	0.295	S	S	*	.	H	α-helix	trans	-59.6	-45.3	177.1	-67.7	-177.5	179	178.7	0	112	D353 L357 V358 E359	D353-K355 VanDerWaalsContact C-N 3.27Å; D353-K355 PolarHBondContact O-N 3.05Å; K355-L357 VanDerWaalsContact C-N 3.26Å; K355-L357 PolarHBondContact O-N 2.86Å; K355-V358 WeakPolarHBondContact O-CB 3.41Å; K355-V358 PolarHBondContact O-N 3.48Å; K355-V358 VanDerWaalsContact O-N 3.14Å; K355-E359 PolarHBondContact O-N 3.37Å
356	S	86.9	Confident	85.4	Confident	21 Å²	21	62.1 Å²	62.1	15%	0.147	31%	0.313	C	S	.	.	H	α-helix	trans	-62.1	-36.6	177.1	74.2	0	0	0	0	111.7	D353 L354 E359 R360	D353-S356 PolarHBondContact O-N 3.48Å; D353-S356 PolarHBondContact O-OG 2.91Å; L354-S356 PolarHBondContact O-N 3.1Å; S356-E359 PolarHBondContact O-N 2.96Å; S356-R360 WeakPolarHBondContact O-CB 3.12Å; S356-R360 WeakPolarHBondContact O-CG 3.32Å; S356-R360 PolarHBondContact O-N 2.95Å
357	L	86.3	Confident	85.2	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-70.3	-33.7	176.5	-64.7	172.7	0	0	0	112.4	L348 L351 D353 L354 K355 R361 R403 A404 V407 F479	L348-L357 HydrophobicContact CD2-CD2 4.2Å; L351-L357 HydrophobicContact CB-CD2 4.06Å; L351-L357 HydrophobicContact CD1-CD2 3.96Å; D353-L357 PolarHBondContact O-N 3.33Å; L354-L357 PolarHBondContact O-N 3.48Å; L354-L357 VanDerWaalsContact O-N 3.15Å; K355-L357 VanDerWaalsContact C-N 3.26Å; K355-L357 PolarHBondContact O-N 2.86Å; L357-R361 WeakPolarHBondContact O-CB 3.48Å; L357-R361 PolarHBondContact O-N 3.37Å; L357-R403 HydrophobicContact CD1-CG 4.05Å; L357-R403 HydrophobicContact CD2-CB 4.46Å; L357-R403 HydrophobicContact CD2-CG 3.86Å; L357-A404 HydrophobicContact CD1-CB 4.14Å; L357-V407 HydrophobicContact CD1-CB 4.28Å; L357-V407 HydrophobicContact CD1-CG2 3.97Å; L357-F479 HydrophobicContact CB-CE2 4.47Å; L357-F479 HydrophobicContact CB-CZ 3.77Å
358	V	84.7	Confident	85.2	Confident	14 Å²	14	55.7 Å²	55.7	9%	0.085	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-49.2	172.1	174	0	0	0	0	110.4	L354 K355 R360 R361 E362 A475 A478 F479	L354-V358 WeakPolarHBondContact O-CG2 3.46Å; L354-V358 PolarHBondContact O-N 3.43Å; K355-V358 WeakPolarHBondContact O-CB 3.41Å; K355-V358 PolarHBondContact O-N 3.48Å; K355-V358 VanDerWaalsContact O-N 3.14Å; V358-R360 VanDerWaalsContact C-N 3.32Å; V358-R360 PolarHBondContact O-N 3.32Å; V358-R361 WeakPolarHBondContact O-CA 3.19Å; V358-R361 WeakPolarHBondContact O-CB 3.28Å; V358-R361 PolarHBondContact O-N 3.1Å; V358-R361 VanDerWaalsContact O-N 3.08Å; V358-E362 WeakPolarHBondContact O-CG 3.42Å; V358-E362 PolarHBondContact O-N 3.01Å; V358-A475 HydrophobicContact CG2-CB 4.43Å; V358-A478 HydrophobicContact CG1-CB 3.75Å; V358-A478 HydrophobicContact CG2-CB 4.19Å; V358-F479 HydrophobicContact CB-CE2 4.43Å; V358-F479 HydrophobicContact CG2-CD2 3.53Å; V358-F479 HydrophobicContact CG2-CE2 3.3Å; V358-F479 HydrophobicContact CG2-CG 4.31Å; V358-F479 HydrophobicContact CG2-CZ 3.95Å
359	E	85.8	Confident	84.9	Confident	123 Å²	123	58 Å²	58	58%	0.575	30%	0.303	S	S	*	.	H	α-helix	trans	-59.9	-42.1	178.2	-68.5	172.4	-172.5	0	0	112	K355 S356 R361 E362 S363	K355-E359 PolarHBondContact O-N 3.37Å; S356-E359 PolarHBondContact O-N 2.96Å; E359-R361 VanDerWaalsContact C-N 3.33Å; E359-R361 PolarHBondContact O-N 2.79Å; E359-E362 PolarHBondContact O-N 3.46Å; E359-S363 PolarHBondContact O-N 3.38Å; E359-S363 PolarHBondContact O-OG 3.49Å
360	R	86.8	Confident	84.5	Confident	83 Å²	83	56.4 Å²	56.4	31%	0.313	30%	0.304	S	S	.	.	H	α-helix	trans	-65.3	-36.7	175.8	-66.1	-76.2	-177.4	-135.9	15.6	111.5	F239 L348 L351 S356 V358 S363 I364 I400	F239-R360 VanDerWaalsContact CB-CZ 3.48Å; F239-R360 VanDerWaalsContact CB-NH1 3.27Å; F239-R360 HydrophobicContact CD1-CB 4.38Å; F239-R360 HydrophobicContact CD1-CG 4.3Å; F239-R360 HydrophobicContact CE1-CB 3.65Å; F239-R360 HydrophobicContact CE1-CG 3.98Å; F239-R360 VanDerWaalsContact CG-CD 3.5Å; F239-R360 HydrophobicContact CZ-CB 4.03Å; F239-R360 HydrophobicContact CZ-CG 4.34Å; L348-R360 HydrophobicContact CD2-CB 4.47Å; L351-R360 HydrophobicContact CD1-CG 3.92Å; S356-R360 WeakPolarHBondContact O-CB 3.12Å; S356-R360 WeakPolarHBondContact O-CG 3.32Å; S356-R360 PolarHBondContact O-N 2.95Å; V358-R360 VanDerWaalsContact C-N 3.32Å; V358-R360 PolarHBondContact O-N 3.32Å; R360-S363 VanDerWaalsContact O-CB 3.3Å; R360-S363 WeakPolarHBondContact O-CB 3.45Å; R360-S363 PolarHBondContact O-N 3.2Å; R360-I364 PolarHBondContact O-N 2.86Å; R360-I364 VanDerWaalsContact O-N 3.11Å; R360-I400 HydrophobicContact CB-CD1 4.15Å
361	R	85.7	Confident	84.1	Confident	10 Å²	10	52.5 Å²	52.5	4%	0.038	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-45.2	174.3	-179.4	177.3	172.8	-94	0.4	112.1	L357 V358 E359 S363 I364 Q365 Y397 I400 A478 F479	L357-R361 WeakPolarHBondContact O-CB 3.48Å; L357-R361 PolarHBondContact O-N 3.37Å; V358-R361 WeakPolarHBondContact O-CA 3.19Å; V358-R361 WeakPolarHBondContact O-CB 3.28Å; V358-R361 PolarHBondContact O-N 3.1Å; V358-R361 VanDerWaalsContact O-N 3.08Å; E359-R361 VanDerWaalsContact C-N 3.33Å; E359-R361 PolarHBondContact O-N 2.79Å; R361-S363 PolarHBondContact O-N 2.81Å; R361-I364 PolarHBondContact O-N 3.2Å; R361-I364 VanDerWaalsContact O-N 3.14Å; R361-Q365 WeakPolarHBondContact O-CB 3.3Å; R361-Q365 PolarHBondContact O-N 3.09Å; R361-Y397 HydrophobicContact CG-CD1 4.38Å; R361-Y397 HydrophobicContact CG-CE1 4.31Å; R361-I400 HydrophobicContact CB-CD1 4.04Å; R361-I400 HydrophobicContact CB-CG2 4.23Å; R361-A478 PolarHBondContact NH1-O 2.95Å; R361-F479 HydrophobicContact CB-CE1 4.21Å; R361-F479 VanDerWaalsContact CD-CE1 3.49Å; R361-F479 HydrophobicContact CG-CE1 4.47Å; R361-F479 PolarHBondContact NH1-O 2.83Å; R361-F479 PolarHBondContact NH2-O 2.92Å
362	E	84.8	Confident	83.5	Confident	90 Å²	90	53.3 Å²	53.3	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-58.7	-37.7	175.6	-72.6	178.8	178.4	0	0	110.7	V358 E359 Q365 N366	V358-E362 WeakPolarHBondContact O-CG 3.42Å; V358-E362 PolarHBondContact O-N 3.01Å; E359-E362 PolarHBondContact O-N 3.46Å; E362-Q365 PolarHBondContact O-N 3.13Å; E362-N366 WeakPolarHBondContact O-CB 3.32Å; E362-N366 PolarHBondContact O-N 3.08Å; E362-N366 PolarHBondContact O-ND2 2.86Å
363	S	85.7	Confident	83.1	Confident	18 Å²	18	53.6 Å²	53.6	13%	0.126	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-47.7	173.6	-53.8	0	0	0	0	112.4	T240 E359 R360 R361 N366 A367	T240-S363 WeakPolarHBondContact CG2-OG 3.4Å; E359-S363 PolarHBondContact O-N 3.38Å; E359-S363 PolarHBondContact O-OG 3.49Å; R360-S363 VanDerWaalsContact O-CB 3.3Å; R360-S363 WeakPolarHBondContact O-CB 3.45Å; R360-S363 PolarHBondContact O-N 3.2Å; R361-S363 PolarHBondContact O-N 2.81Å; S363-N366 PolarHBondContact O-N 2.87Å; S363-A367 PolarHBondContact O-N 3.38Å; S363-A367 VanDerWaalsContact O-N 3.12Å
364	I	85.9	Confident	82.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-44.8	174.2	-66.6	-177.6	0	0	0	110.6	I243 Y340 R360 R361 N366 A367 L368 Y397 I400	I243-I364 HydrophobicContact CD1-CD1 4.31Å; I243-I364 HydrophobicContact CD1-CG1 3.85Å; I243-I364 HydrophobicContact CG2-CG1 4.06Å; Y340-I364 WeakPolarHBondContact OH-CD1 3.41Å; R360-I364 PolarHBondContact O-N 2.86Å; R360-I364 VanDerWaalsContact O-N 3.11Å; R361-I364 PolarHBondContact O-N 3.2Å; R361-I364 VanDerWaalsContact O-N 3.14Å; I364-N366 VanDerWaalsContact C-N 3.33Å; I364-N366 PolarHBondContact O-N 3.45Å; I364-A367 PolarHBondContact O-N 3.47Å; I364-L368 HydrophobicContact CG2-CD1 3.63Å; I364-L368 HydrophobicContact CG2-CG 4.12Å; I364-L368 WeakPolarHBondContact O-CB 3.39Å; I364-L368 WeakPolarHBondContact O-CG 3.46Å; I364-L368 PolarHBondContact O-N 3.18Å; I364-Y397 HydrophobicContact CB-CE1 4.37Å; I364-Y397 HydrophobicContact CG2-CD1 4.11Å; I364-Y397 HydrophobicContact CG2-CE1 3.79Å; I364-I400 HydrophobicContact CD1-CD1 3.27Å; I364-I400 HydrophobicContact CD1-CG1 3.88Å; I364-I400 HydrophobicContact CG1-CD1 4.1Å
365	Q	84.6	Confident	82.2	Confident	49 Å²	49	54.8 Å²	54.8	23%	0.229	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-42.6	-179.8	-179.3	-179.2	-22.6	0	0	111.9	R361 E362 L368 A369 Y397 A482	R361-Q365 WeakPolarHBondContact O-CB 3.3Å; R361-Q365 PolarHBondContact O-N 3.09Å; E362-Q365 PolarHBondContact O-N 3.13Å; Q365-L368 PolarHBondContact O-N 3.34Å; Q365-A369 WeakPolarHBondContact O-CB 3.41Å; Q365-A369 PolarHBondContact O-N 3.05Å; Q365-Y397 WeakPolarHBondContact CA-OH 3.37Å; Q365-Y397 HydrophobicContact CB-CE1 4.47Å; Q365-A482 VanDerWaalsContact CD-CB 3.44Å; Q365-A482 VanDerWaalsContact OE1-CB 3.29Å
366	N	83.7	Confident	81.8	Confident	103 Å²	103	53.5 Å²	53.5	55%	0.551	30%	0.3	S	S	*	.	H	α-helix	trans	-64	-43	177	-69.6	-21.8	0	0	0	111.2	E362 S363 I364 A369 C370	E362-N366 WeakPolarHBondContact O-CB 3.32Å; E362-N366 PolarHBondContact O-N 3.08Å; E362-N366 PolarHBondContact O-ND2 2.86Å; S363-N366 PolarHBondContact O-N 2.87Å; I364-N366 VanDerWaalsContact C-N 3.33Å; I364-N366 PolarHBondContact O-N 3.45Å; N366-A369 PolarHBondContact O-N 2.88Å; N366-C370 PolarHBondContact O-N 2.88Å; N366-C370 VanDerWaalsContact O-N 3.13Å; N366-C370 PolarHBondContact O-SG 3.18Å; N366-C370 VanDerWaalsContact O-SG 3.32Å
367	A	83.6	Confident	81.4	Confident	13 Å²	13	53 Å²	53	11%	0.107	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-44.3	176.3	0	0	0	0	0	112.2	I243 V247 S363 I364	I243-A367 HydrophobicContact CG2-CB 3.94Å; V247-A367 HydrophobicContact CB-CB 4.22Å; V247-A367 HydrophobicContact CG1-CB 4.35Å; V247-A367 HydrophobicContact CG2-CB 4.23Å; S363-A367 PolarHBondContact O-N 3.38Å; S363-A367 VanDerWaalsContact O-N 3.12Å; I364-A367 PolarHBondContact O-N 3.47Å
368	L	83.4	Confident	80.8	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.031	31%	0.311	C	S	.	.	H	α-helix	trans	-70.7	-35.6	178.3	-69.4	177.1	0	0	0	112.7	V247 I364 Q365 V371 A372 M393 F396 Y397	V247-L368 HydrophobicContact CG1-CD2 3.82Å; V247-L368 HydrophobicContact CG2-CD2 4.15Å; I364-L368 HydrophobicContact CG2-CD1 3.63Å; I364-L368 HydrophobicContact CG2-CG 4.12Å; I364-L368 WeakPolarHBondContact O-CB 3.39Å; I364-L368 WeakPolarHBondContact O-CG 3.46Å; I364-L368 PolarHBondContact O-N 3.18Å; Q365-L368 PolarHBondContact O-N 3.34Å; L368-V371 WeakPolarHBondContact O-CB 3.43Å; L368-V371 PolarHBondContact O-N 3.37Å; L368-A372 PolarHBondContact O-N 3.3Å; L368-M393 HydrophobicContact CB-CE 3.62Å; L368-M393 HydrophobicContact CD1-CE 4.24Å; L368-M393 HydrophobicContact CD2-CE 3.53Å; L368-M393 HydrophobicContact CD2-SD 3.95Å; L368-M393 HydrophobicContact CG-CE 3.97Å; L368-F396 HydrophobicContact CD1-CB 4.02Å; L368-F396 HydrophobicContact CD2-CB 4.46Å; L368-F396 HydrophobicContact CD2-CD2 4.16Å; L368-F396 HydrophobicContact CD2-CG 4.22Å; L368-Y397 HydrophobicContact CD1-CD2 4.4Å; L368-Y397 HydrophobicContact CD1-CE1 4.31Å; L368-Y397 HydrophobicContact CD1-CE2 3.67Å
369	A	82.2	Confident	80.5	Confident	50 Å²	50	60.4 Å²	60.4	41%	0.413	33%	0.331	S	S	.	.	H	α-helix	trans	-64.3	-41.8	177.3	0	0	0	0	0	111.6	Q365 N366 V371 A372 T373	Q365-A369 WeakPolarHBondContact O-CB 3.41Å; Q365-A369 PolarHBondContact O-N 3.05Å; N366-A369 PolarHBondContact O-N 2.88Å; A369-V371 PolarHBondContact O-N 3.44Å; A369-A372 PolarHBondContact O-N 3.17Å; A369-T373 WeakPolarHBondContact O-CG2 3.42Å; A369-T373 PolarHBondContact O-N 2.96Å
370	C	76.6	Confident	80.2	Confident	91 Å²	91	54.5 Å²	54.5	62%	0.615	30%	0.303	S	S	*	.	H	α-helix	trans	-54.8	-40.4	174.2	-73.4	0	0	0	0	111.8	N366 T373	N366-C370 PolarHBondContact O-N 2.88Å; N366-C370 VanDerWaalsContact O-N 3.13Å; N366-C370 PolarHBondContact O-SG 3.18Å; N366-C370 VanDerWaalsContact O-SG 3.32Å; C370-T373 PolarHBondContact O-OG1 2.95Å
371	V	75.3	Confident	79.7	Confident	9 Å²	9	50.7 Å²	50.7	6%	0.055	29%	0.289	C	S	.	.	H	α-helix	trans	-71.5	-44	178.8	166.4	0	0	0	0	112.6	V247 F251 L368 A369 T373 N374	V247-V371 HydrophobicContact CG1-CG2 3.75Å; F251-V371 HydrophobicContact CB-CG1 3.95Å; F251-V371 HydrophobicContact CB-CG2 3.9Å; F251-V371 HydrophobicContact CD1-CG1 4.19Å; F251-V371 HydrophobicContact CD1-CG2 4.25Å; F251-V371 HydrophobicContact CD2-CB 4.32Å; F251-V371 HydrophobicContact CD2-CG1 3.09Å; F251-V371 HydrophobicContact CD2-CG2 4.43Å; F251-V371 HydrophobicContact CE2-CG1 3.45Å; F251-V371 VanDerWaalsContact CE2-CG1 3.45Å; F251-V371 HydrophobicContact CG-CB 4.31Å; F251-V371 HydrophobicContact CG-CG1 3.47Å; F251-V371 VanDerWaalsContact CG-CG1 3.47Å; F251-V371 HydrophobicContact CG-CG2 3.94Å; F251-V371 HydrophobicContact CZ-CG1 4.17Å; L368-V371 WeakPolarHBondContact O-CB 3.43Å; L368-V371 PolarHBondContact O-N 3.37Å; A369-V371 PolarHBondContact O-N 3.44Å; V371-T373 PolarHBondContact O-N 3.34Å; V371-T373 VanDerWaalsContact O-N 3.08Å; V371-N374 PolarHBondContact O-N 3.07Å
372	A	73	Confident	79.3	Confident	51 Å²	51	55.8 Å²	55.8	42%	0.421	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-17.9	-176.2	0	0	0	0	0	114	L368 A369 N374	L368-A372 PolarHBondContact O-N 3.3Å; A369-A372 PolarHBondContact O-N 3.17Å; A372-N374 PolarHBondContact O-N 3.48Å
373	T	74.7	Confident	79.1	Confident	115 Å²	115	54.4 Å²	54.4	71%	0.706	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.8	176.8	62.5	0	0	0	0	114.3	A369 C370 V371 P375	A369-T373 WeakPolarHBondContact O-CG2 3.42Å; A369-T373 PolarHBondContact O-N 2.96Å; C370-T373 PolarHBondContact O-OG1 2.95Å; V371-T373 PolarHBondContact O-N 3.34Å; V371-T373 VanDerWaalsContact O-N 3.08Å; T373-P375 WeakPolarHBondContact O-CD 3.5Å
374	N	77	Confident	78.7	Confident	51 Å²	51	54 Å²	54	27%	0.273	30%	0.303	S	S	.	.			trans	-79.2	118.7	-174.7	-169.8	-27.5	0	0	0	111.7	F251 V371 A372 K376 W377	F251-N374 HydrophobicContact CZ-CB 3.82Å; V371-N374 PolarHBondContact O-N 3.07Å; A372-N374 PolarHBondContact O-N 3.48Å; N374-K376 VanDerWaalsContact C-N 3.26Å; N374-K376 PolarHBondContact O-N 2.7Å; N374-K376 WeakPolarHBondContact OD1-CB 3.33Å; N374-K376 PolarHBondContact OD1-N 3.09Å; N374-W377 HydrophobicContact CB-CB 4.33Å; N374-W377 WeakPolarHBondContact O-CB 3.36Å; N374-W377 PolarHBondContact O-N 3.06Å; N374-W377 VanDerWaalsContact O-N 3.12Å
375	P	74.4	Confident	78.1	Confident	100 Å²	100	55.8 Å²	55.8	65%	0.649	31%	0.311	S	S	*	.	H	α-helix	trans	-65.8	-27.7	-178.5	26.9	-35.4	0	0	0	113.1	T373 W377 T378	T373-P375 WeakPolarHBondContact O-CD 3.5Å; P375-W377 VanDerWaalsContact C-N 3.26Å; P375-W377 PolarHBondContact O-N 3.18Å; P375-T378 PolarHBondContact O-OG1 3.04Å
376	K	77.6	Confident	77.2	Confident	126 Å²	126	56.1 Å²	56.1	55%	0.548	33%	0.327	S	S	.	.	H	α-helix	trans	-71	-23	178	-61.6	-175.5	177.2	-177.5	0	112.4	M255 N374 T378 K379 A380	M255-K376 HydrophobicContact CE-CB 3.56Å; M255-K376 HydrophobicContact CE-CD 4.21Å; N374-K376 VanDerWaalsContact C-N 3.26Å; N374-K376 PolarHBondContact O-N 2.7Å; N374-K376 WeakPolarHBondContact OD1-CB 3.33Å; N374-K376 PolarHBondContact OD1-N 3.09Å; K376-T378 PolarHBondContact O-N 3.22Å; K376-K379 PolarHBondContact O-N 2.92Å; K376-A380 WeakPolarHBondContact O-CB 3.42Å; K376-A380 PolarHBondContact O-N 3.22Å
377	W	77.3	Confident	76.1	Confident	11 Å²	11	55.6 Å²	55.6	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-58	-48.2	-179.9	176	-129.5	0	0	0	112.3	W250 F251 I254 M255 N374 P375 K379 A380 C381 F385	W250-W377 AromaticContact CH2-CH2 3.89Å; W250-W377 HydrophobicContact CH2-CH2 3.89Å; W250-W377 HydrophobicContact CH2-CZ2 4.38Å; W250-W377 AromaticContact CZ3-CH2 3.54Å; W250-W377 HydrophobicContact CZ3-CH2 3.54Å; W250-W377 HydrophobicContact CZ3-CZ2 4.02Å; F251-W377 AromaticContact CD2-CD2 3.81Å; F251-W377 HydrophobicContact CD2-CD2 3.81Å; F251-W377 AromaticContact CD2-CE3 3.41Å; F251-W377 HydrophobicContact CD2-CE3 3.41Å; F251-W377 VanDerWaalsContact CD2-CE3 3.41Å; F251-W377 HydrophobicContact CD2-CG 4.46Å; F251-W377 HydrophobicContact CD2-CH2 4.09Å; F251-W377 HydrophobicContact CD2-CZ2 4.45Å; F251-W377 AromaticContact CD2-CZ3 3.55Å; F251-W377 HydrophobicContact CD2-CZ3 3.55Å; F251-W377 HydrophobicContact CE2-CB 3.73Å; F251-W377 AromaticContact CE2-CD2 3.39Å; F251-W377 HydrophobicContact CE2-CD2 3.39Å; F251-W377 AromaticContact CE2-CE3 3.16Å; F251-W377 HydrophobicContact CE2-CE3 3.16Å; F251-W377 AromaticContact CE2-CG 3.66Å; F251-W377 HydrophobicContact CE2-CG 3.66Å; F251-W377 AromaticContact CE2-CZ3 3.83Å; F251-W377 HydrophobicContact CE2-CZ3 3.83Å; F251-W377 HydrophobicContact CZ-CB 4.18Å; F251-W377 HydrophobicContact CZ-CE3 4.34Å; I254-W377 HydrophobicContact CB-CZ3 4Å; I254-W377 HydrophobicContact CD1-CH2 3.78Å; I254-W377 HydrophobicContact CD1-CZ3 3.98Å; I254-W377 HydrophobicContact CG2-CH2 4.45Å; I254-W377 HydrophobicContact CG2-CZ3 3.69Å; M255-W377 HydrophobicContact SD-CE3 4.26Å; N374-W377 HydrophobicContact CB-CB 4.33Å; N374-W377 WeakPolarHBondContact O-CB 3.36Å; N374-W377 PolarHBondContact O-N 3.06Å; N374-W377 VanDerWaalsContact O-N 3.12Å; P375-W377 VanDerWaalsContact C-N 3.26Å; P375-W377 PolarHBondContact O-N 3.18Å; W377-K379 VanDerWaalsContact C-N 3.33Å; W377-K379 PolarHBondContact O-N 2.85Å; W377-A380 PolarHBondContact O-N 3.31Å; W377-C381 WeakPolarHBondContact CH2-SG 3.48Å; W377-C381 WeakPolarHBondContact CZ2-SG 3.06Å; W377-C381 VanDerWaalsContact CZ3-SG 3.54Å; W377-C381 PolarHBondContact O-N 3.11Å; W377-C381 PolarHBondContact O-SG 3.45Å; W377-C381 VanDerWaalsContact O-SG 3.4Å; W377-F385 HydrophobicContact CH2-CE2 4.41Å
378	T	74.7	Confident	75	Confident	56 Å²	56	57.6 Å²	57.6	34%	0.344	34%	0.341	S	S	.	.	H	α-helix	trans	-57	-48.2	-177.6	55.4	0	0	0	0	111.7	P375 K376 C381 E382	P375-T378 PolarHBondContact O-OG1 3.04Å; K376-T378 PolarHBondContact O-N 3.22Å; T378-C381 PolarHBondContact O-N 3.32Å; T378-E382 WeakPolarHBondContact O-CG 3.43Å; T378-E382 PolarHBondContact O-N 2.96Å
379	K	78.5	Confident	74.2	Confident	113 Å²	113	61.5 Å²	61.5	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-46.2	176.8	-63.4	-173.2	177.1	-172.6	0	112.1	K376 W377 C381 E382 E383	K376-K379 PolarHBondContact O-N 2.92Å; W377-K379 VanDerWaalsContact C-N 3.33Å; W377-K379 PolarHBondContact O-N 2.85Å; K379-C381 VanDerWaalsContact C-N 3.31Å; K379-C381 PolarHBondContact O-N 3.01Å; K379-E382 PolarHBondContact O-N 3.32Å; K379-E383 VanDerWaalsContact O-CB 3.31Å; K379-E383 WeakPolarHBondContact O-CB 3.16Å; K379-E383 VanDerWaalsContact O-CG 3.28Å; K379-E383 WeakPolarHBondContact O-CG 3.22Å; K379-E383 PolarHBondContact O-N 3.39Å
380	A	78.5	Confident	73.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61	-39.5	178.9	0	0	0	0	0	112.2	M255 H258 K376 W377 L384	M255-A380 HydrophobicContact SD-CB 4.09Å; H258-A380 HydrophobicContact CB-CB 4.09Å; K376-A380 WeakPolarHBondContact O-CB 3.42Å; K376-A380 PolarHBondContact O-N 3.22Å; W377-A380 PolarHBondContact O-N 3.31Å; A380-L384 VanDerWaalsContact O-CB 3.25Å; A380-L384 WeakPolarHBondContact O-CB 3.48Å; A380-L384 WeakPolarHBondContact O-CG 3.35Å; A380-L384 PolarHBondContact O-N 3.49Å
381	C	76.9	Confident	73.1	Confident	2 Å²	2	69 Å²	69	1%	0.014	37%	0.368	C	S	.	.	H	α-helix	trans	-69.2	-41.9	176	-71.6	0	0	0	0	113.5	W377 T378 K379 E383 F385 G386 K389	W377-C381 WeakPolarHBondContact CH2-SG 3.48Å; W377-C381 WeakPolarHBondContact CZ2-SG 3.06Å; W377-C381 VanDerWaalsContact CZ3-SG 3.54Å; W377-C381 PolarHBondContact O-N 3.11Å; W377-C381 PolarHBondContact O-SG 3.45Å; W377-C381 VanDerWaalsContact O-SG 3.4Å; T378-C381 PolarHBondContact O-N 3.32Å; K379-C381 VanDerWaalsContact C-N 3.31Å; K379-C381 PolarHBondContact O-N 3.01Å; C381-E383 VanDerWaalsContact C-N 3.3Å; C381-F385 HydrophobicContact CB-CD2 3.88Å; C381-F385 HydrophobicContact CB-CE2 4.41Å; C381-F385 WeakPolarHBondContact O-CA 3.21Å; C381-F385 VanDerWaalsContact O-CB 3.29Å; C381-F385 WeakPolarHBondContact O-CB 3.4Å; C381-F385 PolarHBondContact O-N 3.02Å; C381-G386 PolarHBondContact O-N 3.33Å; C381-K389 HydrophobicContact CB-CB 4.46Å
382	E	77.9	Confident	72.9	Confident	117 Å²	117	69.2 Å²	69.2	55%	0.547	37%	0.37	S	S	.	.	H	α-helix	trans	-62.7	-43.5	176.9	-75.7	170.9	-170.3	0	0	110.5	T378 K379 G386	T378-E382 WeakPolarHBondContact O-CG 3.43Å; T378-E382 PolarHBondContact O-N 2.96Å; K379-E382 PolarHBondContact O-N 3.32Å; E382-G386 WeakPolarHBondContact O-CA 3.38Å; E382-G386 PolarHBondContact O-N 2.97Å; E382-G386 VanDerWaalsContact O-N 3.11Å
383	E	79	Confident	73.1	Confident	62 Å²	62	68.3 Å²	68.3	29%	0.29	36%	0.357	S	S	.	.	H	α-helix	trans	-71.2	-43.6	-179.1	-70.9	169.7	-163	0	0	111.6	H258 Y262 H326 K379 C381	H258-E383 IonicContact CD2-OE2 2.73Å; H258-E383 IonicContact CE1-OE2 2.65Å; H258-E383 PolarHBondContact CE1-OE2 3.37Å; H258-E383 IonicContact NE2-OE2 3.28Å; H258-E383 PolarHBondContact NE2-OE2 3.09Å; Y262-E383 HydrophobicContact CE1-CB 4.32Å; Y262-E383 HydrophobicContact CE1-CG 4.26Å; Y262-E383 WeakPolarHBondContact CE1-OE2 3.18Å; Y262-E383 HydrophobicContact CE2-CB 3.86Å; H326-E383 PolarHBondContact CE1-O 3.43Å; K379-E383 VanDerWaalsContact O-CB 3.31Å; K379-E383 WeakPolarHBondContact O-CB 3.16Å; K379-E383 VanDerWaalsContact O-CG 3.28Å; K379-E383 WeakPolarHBondContact O-CG 3.22Å; K379-E383 PolarHBondContact O-N 3.39Å; C381-E383 VanDerWaalsContact C-N 3.3Å
384	L	78.4	Confident	73	Confident	8 Å²	8	66 Å²	66	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-85.4	-37.2	-177.1	-66.1	169.1	0	0	0	114.7	I254 H258 Y262 L325 H326 T329 A380	I254-L384 HydrophobicContact CG2-CD1 3.78Å; H258-L384 HydrophobicContact CB-CD1 4.08Å; Y262-L384 HydrophobicContact CD2-CD2 4.44Å; L325-L384 HydrophobicContact CD2-CD2 3.77Å; L325-L384 HydrophobicContact CG-CD2 4.06Å; H326-L384 PolarHBondContact ND1-O 3.48Å; H326-L384 VanDerWaalsContact ND1-O 3.15Å; T329-L384 HydrophobicContact CG2-CD2 3.98Å; A380-L384 VanDerWaalsContact O-CB 3.25Å; A380-L384 WeakPolarHBondContact O-CB 3.48Å; A380-L384 WeakPolarHBondContact O-CG 3.35Å; A380-L384 PolarHBondContact O-N 3.49Å
385	F	72.7	Confident	73.1	Confident	39 Å²	39	66.2 Å²	66.2	17%	0.171	35%	0.346	C	S	.	.	H	α-helix	trans	-113.6	-8.3	-170.1	-46	-49.8	0	0	0	114.2	I254 L333 W377 C381	I254-F385 HydrophobicContact CD1-CE2 4.14Å; I254-F385 HydrophobicContact CD1-CZ 3.75Å; I254-F385 HydrophobicContact CG1-CZ 4.05Å; I254-F385 HydrophobicContact CG2-CE2 3.98Å; I254-F385 HydrophobicContact CG2-CZ 3.74Å; L333-F385 HydrophobicContact CD1-CD1 3.27Å; L333-F385 HydrophobicContact CD1-CE1 3.23Å; L333-F385 HydrophobicContact CD1-CG 4.07Å; L333-F385 HydrophobicContact CD1-CZ 4Å; L333-F385 HydrophobicContact CD2-CE1 3.91Å; L333-F385 HydrophobicContact CD2-CZ 3.91Å; L333-F385 HydrophobicContact CG-CD1 4.23Å; L333-F385 HydrophobicContact CG-CE1 3.68Å; L333-F385 HydrophobicContact CG-CZ 4.2Å; W377-F385 HydrophobicContact CH2-CE2 4.41Å; C381-F385 HydrophobicContact CB-CD2 3.88Å; C381-F385 HydrophobicContact CB-CE2 4.41Å; C381-F385 WeakPolarHBondContact O-CA 3.21Å; C381-F385 VanDerWaalsContact O-CB 3.29Å; C381-F385 WeakPolarHBondContact O-CB 3.4Å; C381-F385 PolarHBondContact O-N 3.02Å
386	G	66.8	Low	73.4	Confident	55 Å²	55	61.5 Å²	61.5	57%	0.567	32%	0.315	S	S	*	.	S	Bend	trans	75.1	35.2	171.8	0	0	0	0	0	116.1	C381 E382	C381-G386 PolarHBondContact O-N 3.33Å; E382-G386 WeakPolarHBondContact O-CA 3.38Å; E382-G386 PolarHBondContact O-N 2.97Å; E382-G386 VanDerWaalsContact O-N 3.11Å
387	S	59.4	Low	73.8	Confident	92 Å²	92	56.5 Å²	56.5	64%	0.643	29%	0.293	S	S	*	.	S	Bend	trans	105.1	-4.4	170.6	74.7	0	0	0	0	118.8	K389	S387-K389 PolarHBondContact O-N 3.25Å; S387-K389 VanDerWaalsContact O-N 3.13Å
388	D	62	Low	74.1	Confident	55 Å²	55	60 Å²	60	29%	0.294	31%	0.311	S	S	.	.			trans	-92.7	44.4	-169.5	-106.9	-25.3	0	0	0	115.9	E390 R391 V392	D388-E390 VanDerWaalsContact C-N 3.28Å; D388-E390 PolarHBondContact O-N 3.23Å; D388-R391 HydrophobicContact CB-CB 4.19Å; D388-R391 VanDerWaalsContact CG-CD 3.4Å; D388-R391 PolarHBondContact O-N 3.46Å; D388-R391 WeakPolarHBondContact OD1-CD 3.39Å; D388-R391 WeakPolarHBondContact OD1-CG 3.21Å; D388-R391 IonicContact OD1-CZ 2.85Å; D388-R391 IonicContact OD1-NE 2.62Å; D388-R391 PolarHBondContact OD1-NE 2.97Å; D388-R391 IonicContact OD1-NH1 3.26Å; D388-R391 VanDerWaalsContact OD2-CD 3.3Å; D388-R391 WeakPolarHBondContact OD2-CD 3.4Å; D388-R391 IonicContact OD2-CZ 3.67Å; D388-R391 IonicContact OD2-NE 2.77Å; D388-R391 IonicContact OD2-NH1 2.81Å; D388-R391 PolarHBondContact OD2-NH1 3.15Å; D388-V392 PolarHBondContact O-N 2.77Å
389	K	66.5	Low	74.6	Confident	88 Å²	88	57.5 Å²	57.5	38%	0.383	30%	0.296	S	S	.	.	H	α-helix	trans	-55.4	-42.3	179.9	75.8	-173.1	179.6	-177.9	0	112.4	C381 S387 M393	C381-K389 HydrophobicContact CB-CB 4.46Å; S387-K389 PolarHBondContact O-N 3.25Å; S387-K389 VanDerWaalsContact O-N 3.13Å; K389-M393 WeakPolarHBondContact O-CG 3.47Å; K389-M393 PolarHBondContact O-N 3.31Å
390	E	66.8	Low	75	Confident	137 Å²	137	52.2 Å²	52.2	64%	0.64	27%	0.273	S	S	*	.	H	α-helix	trans	-76	-34.4	-173.5	-66.9	-179.2	-172.7	0	0	111.5	D388 M393 S394	D388-E390 VanDerWaalsContact C-N 3.28Å; D388-E390 PolarHBondContact O-N 3.23Å; E390-M393 PolarHBondContact O-N 2.85Å; E390-S394 WeakPolarHBondContact O-CB 3.18Å; E390-S394 PolarHBondContact O-N 3.28Å
391	R	68.8	Low	75.3	Confident	161 Å²	161	53.6 Å²	53.6	61%	0.608	28%	0.282	S	S	*	.	H	α-helix	trans	-64.1	-46.2	175.8	-72.7	-165.6	-166.4	153.5	-5	111.1	D388 M393 S394 I395	D388-R391 HydrophobicContact CB-CB 4.19Å; D388-R391 VanDerWaalsContact CG-CD 3.4Å; D388-R391 PolarHBondContact O-N 3.46Å; D388-R391 WeakPolarHBondContact OD1-CD 3.39Å; D388-R391 WeakPolarHBondContact OD1-CG 3.21Å; D388-R391 IonicContact OD1-CZ 2.85Å; D388-R391 IonicContact OD1-NE 2.62Å; D388-R391 PolarHBondContact OD1-NE 2.97Å; D388-R391 IonicContact OD1-NH1 3.26Å; D388-R391 VanDerWaalsContact OD2-CD 3.3Å; D388-R391 WeakPolarHBondContact OD2-CD 3.4Å; D388-R391 IonicContact OD2-CZ 3.67Å; D388-R391 IonicContact OD2-NE 2.77Å; D388-R391 IonicContact OD2-NH1 2.81Å; D388-R391 PolarHBondContact OD2-NH1 3.15Å; R391-M393 VanDerWaalsContact C-N 3.33Å; R391-M393 PolarHBondContact O-N 2.87Å; R391-S394 WeakPolarHBondContact O-CB 3.5Å; R391-S394 PolarHBondContact O-N 2.62Å; R391-S394 VanDerWaalsContact O-N 3.13Å; R391-S394 PolarHBondContact O-OG 3.45Å; R391-I395 WeakPolarHBondContact O-CG1 3.43Å; R391-I395 PolarHBondContact O-N 2.96Å
392	V	71.4	Confident	75.8	Confident	15 Å²	15	57.9 Å²	57.9	9%	0.091	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-42.4	179.9	-176.3	0	0	0	0	111.1	W250 L333 L337 D388 S394 I395 F396	W250-V392 HydrophobicContact CH2-CG1 3.38Å; W250-V392 HydrophobicContact CZ2-CG1 3.62Å; L333-V392 HydrophobicContact CD2-CG1 4.46Å; L337-V392 HydrophobicContact CD1-CG1 4.24Å; D388-V392 PolarHBondContact O-N 2.77Å; V392-S394 VanDerWaalsContact C-N 3.29Å; V392-S394 PolarHBondContact O-N 2.78Å; V392-I395 PolarHBondContact O-N 3Å; V392-F396 HydrophobicContact CG1-CE2 4.46Å; V392-F396 WeakPolarHBondContact O-CD2 3.5Å
393	M	75.2	Confident	76.3	Confident	32 Å²	32	53.9 Å²	53.9	16%	0.158	28%	0.282	C	S	.	.	H	α-helix	trans	-64.9	-33.9	175.8	-61.6	-64.1	-82.4	0	0	112.1	L368 K389 E390 R391 I395 F396 Y397	L368-M393 HydrophobicContact CB-CE 3.62Å; L368-M393 HydrophobicContact CD1-CE 4.24Å; L368-M393 HydrophobicContact CD2-CE 3.53Å; L368-M393 HydrophobicContact CD2-SD 3.95Å; L368-M393 HydrophobicContact CG-CE 3.97Å; K389-M393 WeakPolarHBondContact O-CG 3.47Å; K389-M393 PolarHBondContact O-N 3.31Å; E390-M393 PolarHBondContact O-N 2.85Å; R391-M393 VanDerWaalsContact C-N 3.33Å; R391-M393 PolarHBondContact O-N 2.87Å; M393-I395 VanDerWaalsContact C-N 3.29Å; M393-I395 PolarHBondContact O-N 3.44Å; M393-F396 PolarHBondContact O-N 3.45Å; M393-Y397 WeakPolarHBondContact O-CD2 3.33Å
394	S	73.2	Confident	76.7	Confident	67 Å²	67	50.9 Å²	50.9	47%	0.469	27%	0.268	S	S	.	.	H	α-helix	trans	-65.8	-29.9	176.6	78.3	0	0	0	0	113.2	E390 R391 V392 F396 Y397 M398	E390-S394 WeakPolarHBondContact O-CB 3.18Å; E390-S394 PolarHBondContact O-N 3.28Å; R391-S394 WeakPolarHBondContact O-CB 3.5Å; R391-S394 PolarHBondContact O-N 2.62Å; R391-S394 VanDerWaalsContact O-N 3.13Å; R391-S394 PolarHBondContact O-OG 3.45Å; V392-S394 VanDerWaalsContact C-N 3.29Å; V392-S394 PolarHBondContact O-N 2.78Å; S394-F396 VanDerWaalsContact C-N 3.3Å; S394-F396 PolarHBondContact O-N 3.5Å; S394-Y397 PolarHBondContact O-N 3.29Å; S394-Y397 VanDerWaalsContact O-N 3.1Å; S394-M398 PolarHBondContact O-N 2.83Å
395	I	78.5	Confident	77.1	Confident	54 Å²	54	53.4 Å²	53.4	28%	0.277	28%	0.28	S	S	.	.	H	α-helix	trans	-67.2	-32.6	-180	-64.1	164.8	0	0	0	111	L337 T341 R391 V392 M393 Y397 M398	L337-I395 HydrophobicContact CB-CG2 3.96Å; L337-I395 HydrophobicContact CD1-CB 4.44Å; L337-I395 HydrophobicContact CD1-CD1 3.79Å; L337-I395 HydrophobicContact CD1-CG2 4.18Å; L337-I395 HydrophobicContact CD2-CB 4.32Å; L337-I395 HydrophobicContact CD2-CG2 3.94Å; L337-I395 HydrophobicContact CG-CG2 4.24Å; T341-I395 HydrophobicContact CG2-CG2 4.26Å; R391-I395 WeakPolarHBondContact O-CG1 3.43Å; R391-I395 PolarHBondContact O-N 2.96Å; V392-I395 PolarHBondContact O-N 3Å; M393-I395 VanDerWaalsContact C-N 3.29Å; M393-I395 PolarHBondContact O-N 3.44Å; I395-Y397 PolarHBondContact O-N 3.29Å; I395-M398 WeakPolarHBondContact O-CB 3.26Å; I395-M398 PolarHBondContact O-N 2.9Å; I395-M398 VanDerWaalsContact O-N 3.09Å
396	F	82.5	Confident	77.8	Confident	1 Å²	1	56.4 Å²	56.4	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-26.9	173.7	-74	-81.1	0	0	0	113.1	V247 W250 L337 Y340 L368 V392 M393 S394	V247-F396 HydrophobicContact CG2-CE1 4.49Å; W250-F396 HydrophobicContact CD2-CE2 4.43Å; W250-F396 AromaticContact CD2-CZ 3.86Å; W250-F396 HydrophobicContact CD2-CZ 3.86Å; W250-F396 HydrophobicContact CE3-CE2 4.21Å; W250-F396 AromaticContact CE3-CZ 3.96Å; W250-F396 HydrophobicContact CE3-CZ 3.96Å; W250-F396 HydrophobicContact CG-CZ 4.33Å; W250-F396 HydrophobicContact CH2-CE2 4.03Å; W250-F396 HydrophobicContact CH2-CZ 4.4Å; W250-F396 HydrophobicContact CZ2-CE2 4.18Å; W250-F396 HydrophobicContact CZ2-CZ 4.25Å; W250-F396 HydrophobicContact CZ3-CE2 4.03Å; W250-F396 HydrophobicContact CZ3-CZ 4.25Å; L337-F396 HydrophobicContact CD2-CD2 4.34Å; L337-F396 HydrophobicContact CD2-CE1 4.37Å; L337-F396 HydrophobicContact CD2-CE2 3.85Å; L337-F396 HydrophobicContact CD2-CZ 3.86Å; Y340-F396 AromaticContact CD1-CD1 3.98Å; Y340-F396 HydrophobicContact CD1-CD1 3.98Å; Y340-F396 HydrophobicContact CD1-CE1 4.47Å; Y340-F396 HydrophobicContact CD2-CD1 4.17Å; Y340-F396 HydrophobicContact CD2-CE1 4.13Å; Y340-F396 HydrophobicContact CE1-CB 4.31Å; Y340-F396 AromaticContact CE1-CD1 3.71Å; Y340-F396 HydrophobicContact CE1-CD1 3.71Å; Y340-F396 HydrophobicContact CE1-CG 4.43Å; Y340-F396 WeakPolarHBondContact CE1-O 3.45Å; Y340-F396 AromaticContact CE2-CD1 3.88Å; Y340-F396 HydrophobicContact CE2-CD1 3.88Å; Y340-F396 HydrophobicContact CE2-CE1 4.18Å; Y340-F396 HydrophobicContact CG-CD1 4.21Å; Y340-F396 HydrophobicContact CG-CE1 4.28Å; Y340-F396 AromaticContact CZ-CD1 3.65Å; L368-F396 HydrophobicContact CD1-CB 4.02Å; L368-F396 HydrophobicContact CD2-CB 4.46Å; L368-F396 HydrophobicContact CD2-CD2 4.16Å; L368-F396 HydrophobicContact CD2-CG 4.22Å; V392-F396 HydrophobicContact CG1-CE2 4.46Å; V392-F396 WeakPolarHBondContact O-CD2 3.5Å; M393-F396 PolarHBondContact O-N 3.45Å; S394-F396 VanDerWaalsContact C-N 3.3Å; S394-F396 PolarHBondContact O-N 3.5Å
397	Y	84.2	Confident	78.8	Confident	21 Å²	21	54 Å²	54	8%	0.082	27%	0.269	C	S	.	.	H	α-helix	trans	-85.7	-12.4	175.9	-66.6	-68.7	0	0	0	113.6	R361 I364 Q365 L368 M393 S394 I395 I400 S401	R361-Y397 HydrophobicContact CG-CD1 4.38Å; R361-Y397 HydrophobicContact CG-CE1 4.31Å; I364-Y397 HydrophobicContact CB-CE1 4.37Å; I364-Y397 HydrophobicContact CG2-CD1 4.11Å; I364-Y397 HydrophobicContact CG2-CE1 3.79Å; Q365-Y397 WeakPolarHBondContact CA-OH 3.37Å; Q365-Y397 HydrophobicContact CB-CE1 4.47Å; L368-Y397 HydrophobicContact CD1-CD2 4.4Å; L368-Y397 HydrophobicContact CD1-CE1 4.31Å; L368-Y397 HydrophobicContact CD1-CE2 3.67Å; M393-Y397 WeakPolarHBondContact O-CD2 3.33Å; S394-Y397 PolarHBondContact O-N 3.29Å; S394-Y397 VanDerWaalsContact O-N 3.1Å; I395-Y397 PolarHBondContact O-N 3.29Å; Y397-I400 PolarHBondContact O-N 3.13Å; Y397-S401 WeakPolarHBondContact O-CB 3.3Å; Y397-S401 PolarHBondContact O-N 2.82Å; Y397-S401 PolarHBondContact O-OG 3.26Å
398	M	84.5	Confident	80.2	Confident	86 Å²	86	49.6 Å²	49.6	42%	0.424	24%	0.238	S	C	.	.	H	α-helix	trans	-57.6	-46.4	-175.9	-174.4	-175.7	-178.7	0	0	113.1	T341 S394 I395 I400 S401 Q402	T341-M398 HydrophobicContact CG2-SD 4.4Å; S394-M398 PolarHBondContact O-N 2.83Å; I395-M398 WeakPolarHBondContact O-CB 3.26Å; I395-M398 PolarHBondContact O-N 2.9Å; I395-M398 VanDerWaalsContact O-N 3.09Å; M398-I400 PolarHBondContact O-N 3.38Å; M398-S401 PolarHBondContact O-N 3.14Å; M398-Q402 HydrophobicContact CG-CG 4.4Å; M398-Q402 WeakPolarHBondContact O-CG 3.3Å; M398-Q402 PolarHBondContact O-N 2.83Å
399	P	85.9	Confident	81.5	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.019	24%	0.241	C	C	.	.	H	α-helix	trans	-64.8	-41.4	-176.8	-23.7	37.3	0	0	0	112.8	Y340 T341 V344 L348 R403	Y340-P399 HydrophobicContact CD1-CG 4.25Å; Y340-P399 HydrophobicContact CE1-CG 4.1Å; T341-P399 HydrophobicContact CG2-CG 3.95Å; V344-P399 HydrophobicContact CB-CB 4.45Å; V344-P399 HydrophobicContact CG1-CB 4.21Å; L348-P399 HydrophobicContact CD1-CB 4.14Å; P399-R403 WeakPolarHBondContact O-CB 3.48Å; P399-R403 PolarHBondContact O-N 3.45Å
400	I	87.1	Confident	82.7	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-43.3	175.5	-69.3	-169	0	0	0	110.6	L348 R360 R361 I364 Y397 M398 Q402 R403 A404 F479	L348-I400 HydrophobicContact CD1-CB 4.33Å; L348-I400 HydrophobicContact CD1-CG1 3.48Å; L348-I400 VanDerWaalsContact CD1-CG1 3.48Å; L348-I400 HydrophobicContact CD2-CG1 4.41Å; R360-I400 HydrophobicContact CB-CD1 4.15Å; R361-I400 HydrophobicContact CB-CD1 4.04Å; R361-I400 HydrophobicContact CB-CG2 4.23Å; I364-I400 HydrophobicContact CD1-CD1 3.27Å; I364-I400 HydrophobicContact CD1-CG1 3.88Å; I364-I400 HydrophobicContact CG1-CD1 4.1Å; Y397-I400 PolarHBondContact O-N 3.13Å; M398-I400 PolarHBondContact O-N 3.38Å; I400-Q402 PolarHBondContact O-N 3.15Å; I400-R403 PolarHBondContact O-N 3.46Å; I400-A404 VanDerWaalsContact O-CB 3.3Å; I400-A404 WeakPolarHBondContact O-CB 3.09Å; I400-A404 PolarHBondContact O-N 3.34Å; I400-F479 HydrophobicContact CG2-CE1 3.83Å; I400-F479 HydrophobicContact CG2-CZ 4.35Å
401	S	84.2	Confident	83.8	Confident	28 Å²	28	44.2 Å²	44.2	20%	0.196	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-44.8	-178.1	-56.5	0	0	0	0	111.3	Y397 M398 A404 E405	Y397-S401 WeakPolarHBondContact O-CB 3.3Å; Y397-S401 PolarHBondContact O-N 2.82Å; Y397-S401 PolarHBondContact O-OG 3.26Å; M398-S401 PolarHBondContact O-N 3.14Å; S401-A404 PolarHBondContact O-N 2.92Å; S401-E405 PolarHBondContact O-N 3.44Å
402	Q	86.2	Confident	84.9	Confident	93 Å²	93	36.6 Å²	36.6	44%	0.435	19%	0.192	S	C	.	.	H	α-helix	trans	-62.7	-42	175.4	-72.5	-179.6	-19.9	0	0	112.3	M398 I400 E405 Q406	M398-Q402 HydrophobicContact CG-CG 4.4Å; M398-Q402 WeakPolarHBondContact O-CG 3.3Å; M398-Q402 PolarHBondContact O-N 2.83Å; I400-Q402 PolarHBondContact O-N 3.15Å; Q402-E405 PolarHBondContact O-N 3.05Å; Q402-Q406 WeakPolarHBondContact O-CG 3.35Å; Q402-Q406 PolarHBondContact O-N 3.39Å; Q402-Q406 VanDerWaalsContact O-N 3.13Å
403	R	89.6	Confident	85.7	Confident	32 Å²	32	40.1 Å²	40.1	12%	0.121	21%	0.208	C	C	.	.	H	α-helix	trans	-66.5	-43	177.3	-179	58	-178	162.9	2	111.8	L348 Q349 L351 N352 L357 P399 I400 E405 Q406 V407	L348-R403 HydrophobicContact CB-CB 4.37Å; L348-R403 HydrophobicContact CB-CG 4.18Å; L348-R403 PolarHBondContact O-NE 3.33Å; Q349-R403 PolarHBondContact O-NH2 3.08Å; Q349-R403 VanDerWaalsContact O-NH2 3.13Å; L351-R403 VanDerWaalsContact O-CZ 3.27Å; L351-R403 PolarHBondContact O-NE 3.49Å; L351-R403 PolarHBondContact O-NH2 2.9Å; N352-R403 PolarHBondContact OD1-NH2 3.37Å; L357-R403 HydrophobicContact CD1-CG 4.05Å; L357-R403 HydrophobicContact CD2-CB 4.46Å; L357-R403 HydrophobicContact CD2-CG 3.86Å; P399-R403 WeakPolarHBondContact O-CB 3.48Å; P399-R403 PolarHBondContact O-N 3.45Å; I400-R403 PolarHBondContact O-N 3.46Å; R403-E405 VanDerWaalsContact C-N 3.31Å; R403-E405 PolarHBondContact O-N 3.14Å; R403-Q406 WeakPolarHBondContact O-CB 3.35Å; R403-Q406 PolarHBondContact O-N 3.17Å; R403-Q406 VanDerWaalsContact O-N 3.15Å; R403-V407 HydrophobicContact CG-CG2 4.41Å; R403-V407 WeakPolarHBondContact O-CG2 3.37Å; R403-V407 PolarHBondContact O-N 2.88Å
404	A	86.3	Confident	86.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.6	-41.4	177.3	0	0	0	0	0	111.2	L357 I400 S401 Q406 V407 V408 F479 L490	L357-A404 HydrophobicContact CD1-CB 4.14Å; I400-A404 VanDerWaalsContact O-CB 3.3Å; I400-A404 WeakPolarHBondContact O-CB 3.09Å; I400-A404 PolarHBondContact O-N 3.34Å; S401-A404 PolarHBondContact O-N 2.92Å; A404-Q406 PolarHBondContact O-N 3.03Å; A404-V407 PolarHBondContact O-N 2.8Å; A404-V408 VanDerWaalsContact O-CG2 3.32Å; A404-V408 WeakPolarHBondContact O-CG2 3.42Å; A404-V408 PolarHBondContact O-N 3.01Å; A404-F479 HydrophobicContact CB-CE1 4.38Å; A404-F479 HydrophobicContact CB-CE2 4.47Å; A404-F479 HydrophobicContact CB-CZ 4.01Å; A404-L490 HydrophobicContact CB-CD1 4.02Å; A404-L490 HydrophobicContact CB-CD2 3.57Å; A404-L490 HydrophobicContact CB-CG 4.44Å
405	E	86.5	Confident	87.4	Confident	61 Å²	61	44.5 Å²	44.5	29%	0.285	21%	0.213	S	C	.	.	H	α-helix	trans	-57.9	-45.7	172.4	167.1	173.6	-177.6	0	0	112.3	S401 Q402 R403 V408 K409 L490 P493	S401-E405 PolarHBondContact O-N 3.44Å; Q402-E405 PolarHBondContact O-N 3.05Å; R403-E405 VanDerWaalsContact C-N 3.31Å; R403-E405 PolarHBondContact O-N 3.14Å; E405-V408 PolarHBondContact O-N 3.35Å; E405-K409 HydrophobicContact CG-CD 4.16Å; E405-K409 WeakPolarHBondContact O-CG 3.43Å; E405-K409 PolarHBondContact O-N 3.33Å; E405-K409 WeakPolarHBondContact OE1-CE 3.29Å; E405-K409 IonicContact OE1-NZ 2.96Å; E405-K409 PolarHBondContact OE1-NZ 3.27Å; E405-L490 HydrophobicContact CB-CD2 4.28Å; E405-P493 HydrophobicContact CB-CB 4.34Å; E405-P493 HydrophobicContact CB-CG 4.45Å; E405-P493 HydrophobicContact CG-CB 3.76Å; E405-P493 HydrophobicContact CG-CG 4.05Å
406	Q	88.2	Confident	87.9	Confident	102 Å²	102	42.2 Å²	42.2	48%	0.477	20%	0.201	S	C	.	.	H	α-helix	trans	-63.2	-42.3	177.8	-69.6	172.6	1.9	0	0	112.1	Q402 R403 A404 K409 A410	Q402-Q406 WeakPolarHBondContact O-CG 3.35Å; Q402-Q406 PolarHBondContact O-N 3.39Å; Q402-Q406 VanDerWaalsContact O-N 3.13Å; R403-Q406 WeakPolarHBondContact O-CB 3.35Å; R403-Q406 PolarHBondContact O-N 3.17Å; R403-Q406 VanDerWaalsContact O-N 3.15Å; A404-Q406 PolarHBondContact O-N 3.03Å; Q406-K409 PolarHBondContact O-N 3.24Å; Q406-A410 WeakPolarHBondContact O-CB 3.47Å; Q406-A410 PolarHBondContact O-N 3.13Å
407	V	88.9	Confident	88.1	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-43.8	178.9	169.9	0	0	0	0	110.9	N352 L354 L357 R403 A404 K409 A410 I411	N352-V407 WeakPolarHBondContact O-CG1 3.27Å; L354-V407 HydrophobicContact CD2-CB 4.33Å; L354-V407 HydrophobicContact CD2-CG1 3.88Å; L354-V407 HydrophobicContact CG-CG1 3.86Å; L357-V407 HydrophobicContact CD1-CB 4.28Å; L357-V407 HydrophobicContact CD1-CG2 3.97Å; R403-V407 HydrophobicContact CG-CG2 4.41Å; R403-V407 WeakPolarHBondContact O-CG2 3.37Å; R403-V407 PolarHBondContact O-N 2.88Å; A404-V407 PolarHBondContact O-N 2.8Å; V407-K409 PolarHBondContact O-N 2.63Å; V407-A410 PolarHBondContact O-N 2.87Å; V407-I411 HydrophobicContact CG1-CD1 3.61Å; V407-I411 HydrophobicContact CG1-CG1 4.23Å; V407-I411 VanDerWaalsContact O-CG1 3.28Å; V407-I411 WeakPolarHBondContact O-CG1 3.27Å; V407-I411 PolarHBondContact O-N 2.68Å
408	V	88.4	Confident	88.3	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.8	-48.5	174.3	169.4	0	0	0	0	110.8	L354 A404 E405 A410 I411 V412 M472 L494	L354-V408 HydrophobicContact CD1-CG2 4.26Å; L354-V408 HydrophobicContact CD2-CG2 3.93Å; A404-V408 VanDerWaalsContact O-CG2 3.32Å; A404-V408 WeakPolarHBondContact O-CG2 3.42Å; A404-V408 PolarHBondContact O-N 3.01Å; E405-V408 PolarHBondContact O-N 3.35Å; V408-A410 VanDerWaalsContact C-N 3.3Å; V408-A410 PolarHBondContact O-N 2.67Å; V408-I411 PolarHBondContact O-N 3.21Å; V408-V412 HydrophobicContact CG1-CG2 4.3Å; V408-V412 WeakPolarHBondContact O-CB 3.41Å; V408-V412 VanDerWaalsContact O-CG2 3.28Å; V408-V412 WeakPolarHBondContact O-CG2 3.46Å; V408-V412 PolarHBondContact O-N 3.13Å; V408-M472 HydrophobicContact CG1-SD 4.45Å; V408-L494 HydrophobicContact CG1-CB 3.94Å; V408-L494 HydrophobicContact CG1-CD1 3.55Å; V408-L494 HydrophobicContact CG1-CG 4.35Å
409	K	89.6	Confident	88.4	Confident	82 Å²	82	44 Å²	44	36%	0.357	22%	0.217	S	C	.	.	H	α-helix	trans	-57.2	-44	177.3	-78.1	171.3	173.4	174.2	0	112	E405 Q406 V407 Q413 A497	E405-K409 HydrophobicContact CG-CD 4.16Å; E405-K409 WeakPolarHBondContact O-CG 3.43Å; E405-K409 PolarHBondContact O-N 3.33Å; E405-K409 WeakPolarHBondContact OE1-CE 3.29Å; E405-K409 IonicContact OE1-NZ 2.96Å; E405-K409 PolarHBondContact OE1-NZ 3.27Å; Q406-K409 PolarHBondContact O-N 3.24Å; V407-K409 PolarHBondContact O-N 2.63Å; K409-Q413 WeakPolarHBondContact O-CG 3.34Å; K409-Q413 PolarHBondContact O-N 3.19Å; K409-Q413 VanDerWaalsContact O-N 3.09Å; K409-A497 HydrophobicContact CG-CB 3.85Å
410	A	90.3	Very high	88.2	Confident	55 Å²	55	45.1 Å²	45.1	46%	0.455	23%	0.225	S	C	.	.	H	α-helix	trans	-67.6	-42.8	179.5	0	0	0	0	0	112.8	Q406 V407 V408 Q413 R414	Q406-A410 WeakPolarHBondContact O-CB 3.47Å; Q406-A410 PolarHBondContact O-N 3.13Å; V407-A410 PolarHBondContact O-N 2.87Å; V408-A410 VanDerWaalsContact C-N 3.3Å; V408-A410 PolarHBondContact O-N 2.67Å; A410-Q413 PolarHBondContact O-N 3.45Å; A410-R414 VanDerWaalsContact O-CB 3.32Å; A410-R414 WeakPolarHBondContact O-CB 3.3Å; A410-R414 PolarHBondContact O-N 3.4Å
411	I	89.7	Confident	88	Confident	30 Å²	30	48.9 Å²	48.9	15%	0.154	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-51.2	177	-68.3	167.6	0	0	0	109.7	L354 V407 V408 Q413 R414 V415 M472	L354-I411 HydrophobicContact CD1-CD1 3.73Å; L354-I411 HydrophobicContact CG-CD1 3.94Å; V407-I411 HydrophobicContact CG1-CD1 3.61Å; V407-I411 HydrophobicContact CG1-CG1 4.23Å; V407-I411 VanDerWaalsContact O-CG1 3.28Å; V407-I411 WeakPolarHBondContact O-CG1 3.27Å; V407-I411 PolarHBondContact O-N 2.68Å; V408-I411 PolarHBondContact O-N 3.21Å; I411-Q413 VanDerWaalsContact C-N 3.31Å; I411-Q413 PolarHBondContact O-N 3.22Å; I411-R414 PolarHBondContact O-N 3.4Å; I411-V415 HydrophobicContact CG2-CG2 4.09Å; I411-V415 WeakPolarHBondContact O-CB 3.47Å; I411-V415 VanDerWaalsContact O-CG2 3.24Å; I411-V415 WeakPolarHBondContact O-CG2 3.32Å; I411-V415 PolarHBondContact O-N 3.41Å; I411-M472 HydrophobicContact CB-SD 4.21Å; I411-M472 HydrophobicContact CG2-CE 4.18Å; I411-M472 HydrophobicContact CG2-CG 4.26Å; I411-M472 HydrophobicContact CG2-SD 3.73Å
412	V	91.6	Very high	87.9	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-57.8	-45	-179.2	172.5	0	0	0	0	111.1	V408 F416 M472 L494 A497 T498 A501	V408-V412 HydrophobicContact CG1-CG2 4.3Å; V408-V412 WeakPolarHBondContact O-CB 3.41Å; V408-V412 VanDerWaalsContact O-CG2 3.28Å; V408-V412 WeakPolarHBondContact O-CG2 3.46Å; V408-V412 PolarHBondContact O-N 3.13Å; V412-F416 HydrophobicContact CG1-CD2 4.26Å; V412-F416 HydrophobicContact CG1-CE2 4.39Å; V412-F416 WeakPolarHBondContact O-CD2 3.37Å; V412-F416 PolarHBondContact O-N 3.42Å; V412-M472 HydrophobicContact CG2-CE 3.92Å; V412-M472 HydrophobicContact CG2-SD 3.8Å; V412-L494 HydrophobicContact CG2-CD1 3.78Å; V412-A497 HydrophobicContact CB-CB 4.36Å; V412-A497 HydrophobicContact CG1-CB 4.34Å; V412-A497 HydrophobicContact CG2-CB 4.44Å; V412-T498 HydrophobicContact CG1-CG2 4.38Å; V412-T498 HydrophobicContact CG2-CG2 4.49Å; V412-A501 HydrophobicContact CG1-CB 3.58Å
413	Q	90.1	Very high	87.4	Confident	89 Å²	89	47.1 Å²	47.1	42%	0.416	24%	0.237	S	C	.	.	H	α-helix	trans	-57.9	-57.8	174.5	-79.7	179.8	-22.7	0	0	110.6	K409 A410 I411 V415 F416 E417	K409-Q413 WeakPolarHBondContact O-CG 3.34Å; K409-Q413 PolarHBondContact O-N 3.19Å; K409-Q413 VanDerWaalsContact O-N 3.09Å; A410-Q413 PolarHBondContact O-N 3.45Å; I411-Q413 VanDerWaalsContact C-N 3.31Å; I411-Q413 PolarHBondContact O-N 3.22Å; Q413-V415 VanDerWaalsContact C-N 3.26Å; Q413-V415 PolarHBondContact O-N 3.36Å; Q413-F416 PolarHBondContact O-N 3.1Å; Q413-E417 WeakPolarHBondContact O-CG 3.19Å; Q413-E417 PolarHBondContact O-N 3.33Å
414	R	90.9	Very high	86.6	Confident	188 Å²	188	49.2 Å²	49.2	71%	0.709	26%	0.256	S	S	*	.	H	α-helix	trans	-51.9	-41.9	-178.8	178	-178.1	164.5	-172.4	-6.3	113	A410 I411 E417 A418	A410-R414 VanDerWaalsContact O-CB 3.32Å; A410-R414 WeakPolarHBondContact O-CB 3.3Å; A410-R414 PolarHBondContact O-N 3.4Å; I411-R414 PolarHBondContact O-N 3.4Å; R414-E417 PolarHBondContact O-N 3.37Å; R414-A418 WeakPolarHBondContact O-CB 3.31Å; R414-A418 PolarHBondContact O-N 3.09Å
415	V	91.6	Very high	86.1	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-47.1	179.9	169	0	0	0	0	111	I411 Q413 A418 A419 F464 V465 E468	I411-V415 HydrophobicContact CG2-CG2 4.09Å; I411-V415 WeakPolarHBondContact O-CB 3.47Å; I411-V415 VanDerWaalsContact O-CG2 3.24Å; I411-V415 WeakPolarHBondContact O-CG2 3.32Å; I411-V415 PolarHBondContact O-N 3.41Å; Q413-V415 VanDerWaalsContact C-N 3.26Å; Q413-V415 PolarHBondContact O-N 3.36Å; V415-A418 PolarHBondContact O-N 3.27Å; V415-A419 WeakPolarHBondContact O-CB 3.22Å; V415-A419 PolarHBondContact O-N 3.21Å; V415-F464 HydrophobicContact CG1-CE1 4.22Å; V415-F464 HydrophobicContact CG2-CZ 4.49Å; V415-V465 HydrophobicContact CG1-CB 4.12Å; V415-V465 HydrophobicContact CG1-CG1 4.01Å; V415-V465 HydrophobicContact CG1-CG2 3.75Å; V415-E468 HydrophobicContact CG1-CB 4.5Å; V415-E468 HydrophobicContact CG2-CB 3.68Å; V415-E468 HydrophobicContact CG2-CG 3.74Å
416	F	89.2	Confident	85.4	Confident	7 Å²	7	50.1 Å²	50.1	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-72.5	-29.5	177.8	-81.6	-77	0	0	0	113	V412 Q413 S420 Y469 A501 V502 F505 L532 F539	V412-F416 HydrophobicContact CG1-CD2 4.26Å; V412-F416 HydrophobicContact CG1-CE2 4.39Å; V412-F416 WeakPolarHBondContact O-CD2 3.37Å; V412-F416 PolarHBondContact O-N 3.42Å; Q413-F416 PolarHBondContact O-N 3.1Å; F416-S420 WeakPolarHBondContact O-CB 3.48Å; F416-S420 PolarHBondContact O-N 3.43Å; F416-S420 VanDerWaalsContact O-N 3.11Å; F416-Y469 HydrophobicContact CE2-CE2 4.42Å; F416-Y469 WeakPolarHBondContact CE2-OH 3.32Å; F416-A501 HydrophobicContact CB-CB 4.49Å; F416-A501 HydrophobicContact CD2-CB 3.63Å; F416-A501 HydrophobicContact CE2-CB 4.17Å; F416-A501 HydrophobicContact CG-CB 4.27Å; F416-V502 HydrophobicContact CE1-CG2 4Å; F416-V502 HydrophobicContact CE2-CG2 4.12Å; F416-V502 HydrophobicContact CZ-CG2 3.56Å; F416-F505 HydrophobicContact CD1-CB 4.03Å; F416-F505 HydrophobicContact CD1-CD2 4.04Å; F416-F505 HydrophobicContact CD1-CG 4.01Å; F416-L532 HydrophobicContact CE1-CD1 4.06Å; F416-F539 HydrophobicContact CZ-CE2 4.03Å
417	E	87.7	Confident	84.3	Confident	92 Å²	92	48.9 Å²	48.9	43%	0.43	26%	0.264	S	S	.	.	H	α-helix	trans	-65.4	-47.2	172.6	-39.4	-154.3	122.2	0	0	110.7	Q413 R414 A419 S420 R508	Q413-E417 WeakPolarHBondContact O-CG 3.19Å; Q413-E417 PolarHBondContact O-N 3.33Å; R414-E417 PolarHBondContact O-N 3.37Å; E417-A419 VanDerWaalsContact C-N 3.3Å; E417-A419 PolarHBondContact O-N 2.99Å; E417-S420 PolarHBondContact O-N 3.45Å; E417-S420 PolarHBondContact O-OG 2.79Å; E417-R508 VanDerWaalsContact CG-NH1 3.3Å; E417-R508 IonicContact OE1-CZ 3.69Å; E417-R508 VanDerWaalsContact OE1-CZ 3.26Å; E417-R508 IonicContact OE1-NH1 3.67Å; E417-R508 PolarHBondContact OE1-NH1 2.89Å; E417-R508 IonicContact OE1-NH2 2.74Å; E417-R508 PolarHBondContact OE1-NH2 3.39Å
418	A	86.9	Confident	83.1	Confident	52 Å²	52	56 Å²	56	43%	0.43	30%	0.302	S	S	.	.	H	α-helix	trans	-64.7	-34.3	178	0	0	0	0	0	112.7	R414 V415 S420 K461 F464	R414-A418 WeakPolarHBondContact O-CB 3.31Å; R414-A418 PolarHBondContact O-N 3.09Å; V415-A418 PolarHBondContact O-N 3.27Å; A418-S420 VanDerWaalsContact C-N 3.33Å; A418-K461 PolarHBondContact O-NZ 2.94Å; A418-F464 HydrophobicContact CB-CE1 4.07Å
419	A	86.4	Confident	81.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-73.3	-24.1	177.2	0	0	0	0	0	113.2	V415 E417 D421 F422 V465 F528	V415-A419 WeakPolarHBondContact O-CB 3.22Å; V415-A419 PolarHBondContact O-N 3.21Å; E417-A419 VanDerWaalsContact C-N 3.3Å; E417-A419 PolarHBondContact O-N 2.99Å; A419-D421 VanDerWaalsContact C-N 3.32Å; A419-D421 PolarHBondContact O-N 3.44Å; A419-F422 WeakPolarHBondContact O-CZ 3.06Å; A419-V465 HydrophobicContact CB-CG2 3.99Å; A419-F528 HydrophobicContact CB-CE1 4.35Å; A419-F528 HydrophobicContact CB-CE2 4.23Å; A419-F528 HydrophobicContact CB-CZ 3.66Å
420	S	83.6	Confident	80.8	Confident	27 Å²	27	57.4 Å²	57.4	19%	0.189	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.8	-172.1	68.3	0	0	0	0	116.2	F416 E417 A418 F422	F416-S420 WeakPolarHBondContact O-CB 3.48Å; F416-S420 PolarHBondContact O-N 3.43Å; F416-S420 VanDerWaalsContact O-N 3.11Å; E417-S420 PolarHBondContact O-N 3.45Å; E417-S420 PolarHBondContact O-OG 2.79Å; A418-S420 VanDerWaalsContact C-N 3.33Å; S420-F422 WeakPolarHBondContact O-CD2 3.43Å; S420-F422 PolarHBondContact O-N 3.04Å
421	D	82.6	Confident	79.7	Confident	82 Å²	82	54.9 Å²	54.9	44%	0.439	29%	0.292	S	S	.	.			trans	-78.7	99.3	175.9	-172.7	3.8	0	0	0	111.2	A419 D423 S424 K461	A419-D421 VanDerWaalsContact C-N 3.32Å; A419-D421 PolarHBondContact O-N 3.44Å; D421-D423 PolarHBondContact OD1-N 3.23Å; D421-S424 PolarHBondContact OD1-N 3.27Å; D421-K461 WeakPolarHBondContact O-CE 3.11Å; D421-K461 PolarHBondContact O-NZ 2.85Å
422	F	81.9	Confident	78.6	Confident	1 Å²	1	55.4 Å²	55.4	0%	0.004	30%	0.295	C	S	.	.			trans	-102.9	-15.5	175.6	-60.7	-72.5	0	0	0	113.1	A419 S420 S424 I425 K461 F505 V512 A521 H524 C525 F528	A419-F422 WeakPolarHBondContact O-CZ 3.06Å; S420-F422 WeakPolarHBondContact O-CD2 3.43Å; S420-F422 PolarHBondContact O-N 3.04Å; F422-S424 PolarHBondContact O-N 3.08Å; F422-I425 HydrophobicContact CD1-CD1 4.06Å; F422-I425 PolarHBondContact O-N 3.13Å; F422-K461 HydrophobicContact CE1-CD 4.5Å; F422-F505 AromaticContact CE2-CE2 3.93Å; F422-F505 HydrophobicContact CE2-CE2 3.93Å; F422-F505 AromaticContact CE2-CZ 3.89Å; F422-F505 HydrophobicContact CE2-CZ 3.89Å; F422-F505 HydrophobicContact CZ-CE2 4.06Å; F422-F505 AromaticContact CZ-CZ 3.89Å; F422-F505 HydrophobicContact CZ-CZ 3.89Å; F422-V512 HydrophobicContact CB-CG1 4.12Å; F422-V512 HydrophobicContact CD2-CG1 4.25Å; F422-A521 HydrophobicContact CB-CB 4.3Å; F422-H524 HydrophobicContact CD1-CB 4.26Å; F422-C525 HydrophobicContact CD2-CB 3.89Å; F422-C525 HydrophobicContact CE2-CB 4Å; F422-C525 HydrophobicContact CG-CB 4.19Å; F422-C525 HydrophobicContact CZ-CB 4.39Å; F422-F528 HydrophobicContact CE1-CB 3.62Å; F422-F528 HydrophobicContact CE1-CD1 4.13Å; F422-F528 HydrophobicContact CE1-CD2 4.29Å; F422-F528 AromaticContact CE1-CG 3.76Å; F422-F528 HydrophobicContact CE1-CG 3.76Å; F422-F528 HydrophobicContact CZ-CB 3.88Å; F422-F528 AromaticContact CZ-CD1 3.61Å; F422-F528 HydrophobicContact CZ-CD1 3.61Å; F422-F528 HydrophobicContact CZ-CD2 4.5Å; F422-F528 HydrophobicContact CZ-CE1 4.23Å; F422-F528 AromaticContact CZ-CG 3.74Å; F422-F528 HydrophobicContact CZ-CG 3.74Å
423	D	75	Confident	77.4	Confident	82 Å²	82	61.8 Å²	61.8	44%	0.439	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.8	-179.8	-69.4	-46.1	0	0	0	111.4	D421 I425 N518	D421-D423 PolarHBondContact OD1-N 3.23Å; D423-I425 VanDerWaalsContact C-N 3.29Å; D423-I425 PolarHBondContact O-N 2.81Å; D423-N518 PolarHBondContact OD1-ND2 2.99Å
424	S	73.8	Confident	76	Confident	76 Å²	76	59 Å²	59	53%	0.531	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-15.2	173.9	77.6	0	0	0	0	114.4	D421 F422	D421-S424 PolarHBondContact OD1-N 3.27Å; F422-S424 PolarHBondContact O-N 3.08Å
425	I	74.4	Confident	74.6	Confident	8 Å²	8	50 Å²	50	4%	0.041	28%	0.283	C	S	.	.	S	Bend	trans	-79.6	132.2	-175.2	-57.4	175.5	0	0	0	108.7	F422 D423 N427 E457 V458 K461 H524	F422-I425 HydrophobicContact CD1-CD1 4.06Å; F422-I425 PolarHBondContact O-N 3.13Å; D423-I425 VanDerWaalsContact C-N 3.29Å; D423-I425 PolarHBondContact O-N 2.81Å; I425-N427 PolarHBondContact O-N 3.41Å; I425-E457 HydrophobicContact CG2-CB 4.03Å; I425-E457 HydrophobicContact CG2-CG 4.39Å; I425-V458 HydrophobicContact CD1-CG2 3.77Å; I425-K461 HydrophobicContact CD1-CD 4.29Å; I425-H524 HydrophobicContact CD1-CB 4.13Å; I425-H524 WeakPolarHBondContact CG2-ND1 3.27Å
426	P	71.5	Confident	73.3	Confident	73 Å²	73	60.1 Å²	60.1	47%	0.474	32%	0.321	S	S	.	.			trans	-51.9	138.9	179.9	-24.9	32.5	0	0	0	112.6	D428	P426-D428 PolarHBondContact O-N 3.24Å; P426-D428 VanDerWaalsContact O-N 3.11Å
427	N	67	Low	72	Confident	75 Å²	75	63.8 Å²	63.8	40%	0.401	35%	0.353	S	S	.	.			trans	-76.1	9.4	-179.2	-74.6	-20.8	0	0	0	114	I425 L429 T520	I425-N427 PolarHBondContact O-N 3.41Å; N427-L429 PolarHBondContact O-N 3.4Å; N427-T520 HydrophobicContact CB-CG2 4.35Å; N427-T520 PolarHBondContact OD1-OG1 2.9Å
428	D	63.3	Low	70.7	Confident	155 Å²	155	60.2 Å²	60.2	83%	0.829	34%	0.339	S	S	*	.			trans	-73.4	82.4	177.5	-72.2	-20.8	0	0	0	109.6	P426 D430	P426-D428 PolarHBondContact O-N 3.24Å; P426-D428 VanDerWaalsContact O-N 3.11Å; D428-D430 VanDerWaalsContact C-N 3.34Å; D428-D430 PolarHBondContact O-N 2.91Å
429	L	63.1	Low	69.4	Low	43 Å²	43	60.5 Å²	60.5	23%	0.225	34%	0.338	C	S	.	.			trans	-77.7	80.5	-178.2	-166.4	75.8	0	0	0	110.1	N427 T520 V523 A644 V645	N427-L429 PolarHBondContact O-N 3.4Å; L429-T520 HydrophobicContact CB-CG2 3.88Å; L429-T520 HydrophobicContact CD1-CG2 4.11Å; L429-T520 HydrophobicContact CD2-CG2 4.22Å; L429-T520 HydrophobicContact CG-CG2 4.3Å; L429-V523 HydrophobicContact CD1-CB 4.48Å; L429-V523 HydrophobicContact CD1-CG1 4.32Å; L429-A644 HydrophobicContact CD2-CB 4.38Å; L429-A644 HydrophobicContact CG-CB 4.28Å; L429-A644 WeakPolarHBondContact O-CB 3.35Å; L429-V645 HydrophobicContact CD1-CG2 4.25Å; L429-V645 HydrophobicContact CD2-CG2 3.7Å; L429-V645 HydrophobicContact CG-CG2 4.22Å
430	D	66.3	Low	68.1	Low	67 Å²	67	67 Å²	67	36%	0.358	37%	0.373	S	S	.	.			trans	-134.1	72.4	156	-158.9	-20.1	0	0	0	110	D428 L432 Q433 A434	D428-D430 VanDerWaalsContact C-N 3.34Å; D428-D430 PolarHBondContact O-N 2.91Å; D430-L432 PolarHBondContact O-N 3.42Å; D430-L432 PolarHBondContact OD1-N 2.99Å; D430-Q433 HydrophobicContact CB-CB 3.96Å; D430-Q433 VanDerWaalsContact CG-CB 3.42Å; D430-Q433 PolarHBondContact O-N 3.14Å; D430-Q433 PolarHBondContact OD1-N 3.27Å; D430-A434 PolarHBondContact O-N 3.19Å
431	C	66.7	Low	67.1	Low	3 Å²	3	70 Å²	70	2%	0.02	39%	0.387	C	S	.	.	H	α-helix	trans	-59.9	-30	178.3	-53.3	0	0	0	0	111.5	T435 S453 A644	C431-T435 WeakPolarHBondContact O-CB 3.45Å; C431-T435 WeakPolarHBondContact O-CG2 3.15Å; C431-T435 PolarHBondContact O-N 3.25Å; C431-T435 PolarHBondContact O-OG1 2.97Å; C431-S453 VanDerWaalsContact CB-O 3.26Å; C431-S453 WeakPolarHBondContact CB-O 3.47Å; C431-A644 VanDerWaalsContact CB-O 3.22Å; C431-A644 WeakPolarHBondContact CB-O 3.14Å; C431-A644 PolarHBondContact N-O 3.02Å; C431-A644 PolarHBondContact SG-O 3.31Å
432	L	66	Low	66.1	Low	40 Å²	40	74.7 Å²	74.7	21%	0.209	41%	0.406	C	S	.	.	H	α-helix	trans	-67.9	-48.9	174.9	-93.5	179	0	0	0	111.3	D430 A434 T435 W436 A643	D430-L432 PolarHBondContact O-N 3.42Å; D430-L432 PolarHBondContact OD1-N 2.99Å; L432-A434 VanDerWaalsContact C-N 3.3Å; L432-A434 PolarHBondContact O-N 2.73Å; L432-T435 WeakPolarHBondContact CA-OG1 3.3Å; L432-T435 PolarHBondContact O-N 2.72Å; L432-T435 PolarHBondContact O-OG1 3.32Å; L432-W436 WeakPolarHBondContact O-CB 3.4Å; L432-W436 PolarHBondContact O-N 3.12Å; L432-A643 VanDerWaalsContact CD1-C 3.5Å; L432-A643 HydrophobicContact CD1-CB 3.69Å; L432-A643 WeakPolarHBondContact CD1-O 3.31Å; L432-A643 WeakPolarHBondContact CG-O 3.28Å
433	Q	67.1	Low	65.6	Low	135 Å²	135	77.2 Å²	77.2	63%	0.631	42%	0.423	S	S	*	.	H	α-helix	trans	-61.3	-42	177	-172.9	176.1	-2.8	0	0	111.3	D430 T435 W436 A437	D430-Q433 HydrophobicContact CB-CB 3.96Å; D430-Q433 VanDerWaalsContact CG-CB 3.42Å; D430-Q433 PolarHBondContact O-N 3.14Å; D430-Q433 PolarHBondContact OD1-N 3.27Å; Q433-T435 VanDerWaalsContact C-N 3.32Å; Q433-T435 PolarHBondContact O-N 3.13Å; Q433-W436 PolarHBondContact O-N 3.45Å; Q433-A437 VanDerWaalsContact O-CB 3.25Å; Q433-A437 WeakPolarHBondContact O-CB 3.25Å; Q433-A437 PolarHBondContact O-N 3.11Å
434	A	61.1	Low	65.5	Low	30 Å²	30	80.7 Å²	80.7	25%	0.248	44%	0.437	C	S	.	.	H	α-helix	trans	-59.4	-41.8	176.1	0	0	0	0	0	112.1	D430 L432 A437 A438	D430-A434 PolarHBondContact O-N 3.19Å; L432-A434 VanDerWaalsContact C-N 3.3Å; L432-A434 PolarHBondContact O-N 2.73Å; A434-A437 PolarHBondContact O-N 3.38Å; A434-A438 PolarHBondContact O-N 3.46Å; A434-A438 VanDerWaalsContact O-N 3.12Å
435	T	61	Low	65.5	Low	1 Å²	1	79 Å²	79	1%	0.006	42%	0.422	C	S	.	.	H	α-helix	trans	-75.7	-27.2	179.5	53.4	0	0	0	0	114.5	C431 L432 Q433 A438 Q449 S453 M454	C431-T435 WeakPolarHBondContact O-CB 3.45Å; C431-T435 WeakPolarHBondContact O-CG2 3.15Å; C431-T435 PolarHBondContact O-N 3.25Å; C431-T435 PolarHBondContact O-OG1 2.97Å; L432-T435 WeakPolarHBondContact CA-OG1 3.3Å; L432-T435 PolarHBondContact O-N 2.72Å; L432-T435 PolarHBondContact O-OG1 3.32Å; Q433-T435 VanDerWaalsContact C-N 3.32Å; Q433-T435 PolarHBondContact O-N 3.13Å; T435-A438 WeakPolarHBondContact O-CB 3.41Å; T435-Q449 HydrophobicContact CG2-CG 4.09Å; T435-S453 VanDerWaalsContact CG2-CA 3.46Å; T435-M454 VanDerWaalsContact CG2-O 3.27Å; T435-M454 WeakPolarHBondContact CG2-O 3.25Å
436	W	65.1	Low	65.4	Low	213 Å²	213	80.4 Å²	80.4	81%	0.807	43%	0.428	S	S	*	.	H	α-helix	trans	-81.2	-27.2	173.8	-75.2	48.9	0	0	0	112.2	L432 Q433 A438	L432-W436 WeakPolarHBondContact O-CB 3.4Å; L432-W436 PolarHBondContact O-N 3.12Å; Q433-W436 PolarHBondContact O-N 3.45Å; W436-A438 VanDerWaalsContact C-N 3.3Å
437	A	61.1	Low	65.7	Low	85 Å²	85	81.7 Å²	81.7	70%	0.702	43%	0.43	S	S	*	.	H	α-helix	trans	-74.3	-21.7	170.4	0	0	0	0	0	112.6	Q433 A434	Q433-A437 VanDerWaalsContact O-CB 3.25Å; Q433-A437 WeakPolarHBondContact O-CB 3.25Å; Q433-A437 PolarHBondContact O-N 3.11Å; A434-A437 PolarHBondContact O-N 3.38Å
438	A	59.7	Low	66.2	Low	16 Å²	16	78.8 Å²	78.8	13%	0.132	42%	0.416	C	S	.	.	S	Bend	trans	-61.8	142.4	178	0	0	0	0	0	112	A434 T435 W436 R450	A434-A438 PolarHBondContact O-N 3.46Å; A434-A438 VanDerWaalsContact O-N 3.12Å; T435-A438 WeakPolarHBondContact O-CB 3.41Å; W436-A438 VanDerWaalsContact C-N 3.3Å; A438-R450 PolarHBondContact O-NH2 3.26Å; A438-R450 VanDerWaalsContact O-NH2 3.16Å
439	S	59.9	Low	66.9	Low	58 Å²	58	71.6 Å²	71.6	41%	0.406	38%	0.378	S	S	.	.			trans	-41.6	143.6	-178.4	-178.8	0	0	0	0	112.9	D441 R450	S439-D441 WeakPolarHBondContact CB-OD2 3.22Å; S439-D441 PolarHBondContact O-N 3.01Å; S439-D441 PolarHBondContact OG-N 2.84Å; S439-D441 PolarHBondContact OG-OD2 3.29Å; S439-R450 PolarHBondContact O-NH2 3.02Å
440	N	60.3	Low	67.7	Low	137 Å²	137	73.6 Å²	73.6	73%	0.733	38%	0.382	S	S	*	.			trans	-72.4	14.9	173.5	-83.1	-23.6	0	0	0	113.9	Q442 R450	N440-Q442 PolarHBondContact O-N 3.26Å; N440-R450 PolarHBondContact OD1-NH2 3.18Å
441	D	61.2	Low	68.3	Low	91 Å²	91	76 Å²	76	49%	0.487	40%	0.395	S	S	.	.			trans	-59.4	131.6	175.2	-72.7	-39.7	0	0	0	111.1	S439 S443 H446	S439-D441 WeakPolarHBondContact CB-OD2 3.22Å; S439-D441 PolarHBondContact O-N 3.01Å; S439-D441 PolarHBondContact OG-N 2.84Å; S439-D441 PolarHBondContact OG-OD2 3.29Å; D441-S443 PolarHBondContact O-N 3.25Å; D441-H446 WeakPolarHBondContact O-CB 3.49Å
442	Q	63.5	Low	69.1	Low	180 Å²	180	76.7 Å²	76.7	84%	0.841	40%	0.398	S	S	*	.			trans	-86	20.2	179.9	-64.3	-173.4	-14	0	0	112.5	N440	N440-Q442 PolarHBondContact O-N 3.26Å
443	S	71.3	Confident	69.8	Low	53 Å²	53	74.8 Å²	74.8	37%	0.371	39%	0.388	S	S	.	.			trans	-68.1	146.5	175.2	73.5	0	0	0	0	110.1	D441 L445 H446 I447	D441-S443 PolarHBondContact O-N 3.25Å; S443-L445 PolarHBondContact O-N 3.43Å; S443-L445 VanDerWaalsContact O-N 3.1Å; S443-H446 PolarHBondContact O-N 3.37Å; S443-H446 PolarHBondContact OG-ND1 3.46Å; S443-I447 PolarHBondContact O-N 3.01Å; S443-I447 VanDerWaalsContact O-N 3.14Å
444	E	72.7	Confident	70.4	Confident	155 Å²	155	68.4 Å²	68.4	72%	0.724	36%	0.358	S	S	*	.	H	α-helix	trans	-54.1	-34.6	-178.3	-64	-176.3	163.1	0	0	111.8	I447 A448	E444-I447 PolarHBondContact O-N 3.4Å; E444-A448 WeakPolarHBondContact O-CB 3.28Å; E444-A448 PolarHBondContact O-N 3.4Å
445	L	73	Confident	71.4	Confident	40 Å²	40	67.3 Å²	67.3	21%	0.209	35%	0.348	C	S	.	.	H	α-helix	trans	-65	-42.3	176.9	-171.9	126.1	0	0	0	113.4	S443 A448 Q449 L459 Q463 C535	S443-L445 PolarHBondContact O-N 3.43Å; S443-L445 VanDerWaalsContact O-N 3.1Å; L445-A448 PolarHBondContact O-N 2.88Å; L445-Q449 WeakPolarHBondContact O-CB 3.34Å; L445-Q449 PolarHBondContact O-N 3.43Å; L445-L459 HydrophobicContact CD1-CD1 4.28Å; L445-L459 HydrophobicContact CD2-CD1 3.95Å; L445-L459 HydrophobicContact CD2-CD2 3.8Å; L445-L459 HydrophobicContact CD2-CG 4.18Å; L445-L459 HydrophobicContact CG-CD1 4.05Å; L445-Q463 HydrophobicContact CD1-CG 4.13Å; L445-C535 HydrophobicContact CD1-CB 4.41Å
446	H	72.9	Confident	72.3	Confident	39 Å²	39	69.7 Å²	69.7	18%	0.181	37%	0.365	C	S	.	.	H	α-helix	trans	-70.8	-33.4	176.2	-71.8	102.1	0	0	0	111.8	D441 S443 Q449 R450	D441-H446 WeakPolarHBondContact O-CB 3.49Å; S443-H446 PolarHBondContact O-N 3.37Å; S443-H446 PolarHBondContact OG-ND1 3.46Å; H446-Q449 PolarHBondContact O-N 2.94Å; H446-R450 WeakPolarHBondContact O-CG 3.2Å; H446-R450 PolarHBondContact O-N 3.12Å
447	I	76.6	Confident	73.2	Confident	99 Å²	99	63.4 Å²	63.4	51%	0.508	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-45.8	173.2	-62.8	170.3	0	0	0	109.8	S443 E444 R450 L451	S443-I447 PolarHBondContact O-N 3.01Å; S443-I447 VanDerWaalsContact O-N 3.14Å; E444-I447 PolarHBondContact O-N 3.4Å; I447-R450 PolarHBondContact O-N 2.98Å; I447-L451 WeakPolarHBondContact O-CB 3.36Å; I447-L451 PolarHBondContact O-N 3.45Å
448	A	77.5	Confident	74.4	Confident	14 Å²	14	59.3 Å²	59.3	12%	0.116	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-41.3	176.7	0	0	0	0	0	112.1	E444 L445 R450 L451 L452 C535	E444-A448 WeakPolarHBondContact O-CB 3.28Å; E444-A448 PolarHBondContact O-N 3.4Å; L445-A448 PolarHBondContact O-N 2.88Å; A448-R450 VanDerWaalsContact C-N 3.32Å; A448-R450 PolarHBondContact O-N 3.2Å; A448-L451 PolarHBondContact O-N 2.74Å; A448-L452 WeakPolarHBondContact O-CB 3.47Å; A448-L452 PolarHBondContact O-N 2.96Å; A448-C535 VanDerWaalsContact CB-SG 3.55Å
449	Q	79.8	Confident	75.6	Confident	4 Å²	4	59 Å²	59	2%	0.019	31%	0.307	C	S	.	.	H	α-helix	trans	-55.3	-47.5	174.1	-174.5	-174.5	7.2	0	0	111.1	T435 L445 H446 S453 M454 L459	T435-Q449 HydrophobicContact CG2-CG 4.09Å; L445-Q449 WeakPolarHBondContact O-CB 3.34Å; L445-Q449 PolarHBondContact O-N 3.43Å; H446-Q449 PolarHBondContact O-N 2.94Å; Q449-S453 VanDerWaalsContact O-CA 3.31Å; Q449-S453 WeakPolarHBondContact O-CA 3.45Å; Q449-S453 PolarHBondContact O-N 3.03Å; Q449-M454 HydrophobicContact CG-CB 4.18Å; Q449-M454 WeakPolarHBondContact CG-O 3.49Å; Q449-M454 PolarHBondContact NE2-O 3.03Å; Q449-M454 VanDerWaalsContact NE2-O 3.15Å; Q449-M454 PolarHBondContact O-N 3.32Å; Q449-L459 HydrophobicContact CB-CD2 4.13Å; Q449-L459 VanDerWaalsContact CD-CD2 3.41Å; Q449-L459 HydrophobicContact CG-CD2 3.92Å; Q449-L459 VanDerWaalsContact OE1-CD2 3.32Å
450	R	78.2	Confident	76.8	Confident	86 Å²	86	62.1 Å²	62.1	33%	0.325	32%	0.316	S	S	.	.	H	α-helix	trans	-66.2	-43	177.9	-72	171.6	177.9	-177.8	-6.4	112.4	A438 S439 N440 H446 I447 A448 L452 S453	A438-R450 PolarHBondContact O-NH2 3.26Å; A438-R450 VanDerWaalsContact O-NH2 3.16Å; S439-R450 PolarHBondContact O-NH2 3.02Å; N440-R450 PolarHBondContact OD1-NH2 3.18Å; H446-R450 WeakPolarHBondContact O-CG 3.2Å; H446-R450 PolarHBondContact O-N 3.12Å; I447-R450 PolarHBondContact O-N 2.98Å; A448-R450 VanDerWaalsContact C-N 3.32Å; A448-R450 PolarHBondContact O-N 3.2Å; R450-L452 VanDerWaalsContact C-N 3.31Å; R450-L452 PolarHBondContact O-N 3.15Å; R450-S453 PolarHBondContact O-N 3.42Å
451	L	79.9	Confident	78.2	Confident	118 Å²	118	57.4 Å²	57.4	62%	0.618	29%	0.288	S	S	*	.	H	α-helix	trans	-62.1	-39	179.1	-177.7	68.8	0	0	0	112.3	I447 A448 H648	I447-L451 WeakPolarHBondContact O-CB 3.36Å; I447-L451 PolarHBondContact O-N 3.45Å; A448-L451 PolarHBondContact O-N 2.74Å; L451-H648 PolarHBondContact O-CD2 3.47Å; L451-H648 PolarHBondContact O-NE2 2.91Å
452	L	82.7	Confident	79.5	Confident	17 Å²	17	53.1 Å²	53.1	9%	0.089	27%	0.265	C	S	.	.	H	α-helix	trans	-90.2	-8.1	179.1	-68.2	-178	0	0	0	113.3	A448 R450 M454 K527 Q530 T534 S649	A448-L452 WeakPolarHBondContact O-CB 3.47Å; A448-L452 PolarHBondContact O-N 2.96Å; R450-L452 VanDerWaalsContact C-N 3.31Å; R450-L452 PolarHBondContact O-N 3.15Å; L452-M454 HydrophobicContact CB-CG 3.57Å; L452-M454 HydrophobicContact CD1-CG 4.25Å; L452-M454 HydrophobicContact CD1-SD 4.3Å; L452-M454 PolarHBondContact O-N 3.36Å; L452-K527 WeakPolarHBondContact O-CD 3.26Å; L452-K527 WeakPolarHBondContact O-CE 3.16Å; L452-K527 PolarHBondContact O-NZ 3.39Å; L452-Q530 HydrophobicContact CD1-CB 3.9Å; L452-Q530 HydrophobicContact CD2-CB 4.06Å; L452-T534 HydrophobicContact CD1-CG2 4.3Å; L452-T534 WeakPolarHBondContact CD1-OG1 3.39Å; L452-S649 PolarHBondContact O-OG 3.25Å
453	S	80.4	Confident	80.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	56	-168.3	-61.2	0	0	0	0	111.9	C431 T435 Q449 R450 H648	C431-S453 VanDerWaalsContact CB-O 3.26Å; C431-S453 WeakPolarHBondContact CB-O 3.47Å; T435-S453 VanDerWaalsContact CG2-CA 3.46Å; Q449-S453 VanDerWaalsContact O-CA 3.31Å; Q449-S453 WeakPolarHBondContact O-CA 3.45Å; Q449-S453 PolarHBondContact O-N 3.03Å; R450-S453 PolarHBondContact O-N 3.42Å; S453-H648 PolarHBondContact OG-CE1 2.86Å; S453-H648 PolarHBondContact OG-NE2 2.72Å; S453-H648 VanDerWaalsContact OG-NE2 3.12Å
454	M	81	Confident	81.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.246	C	C	.	.			trans	-88.4	130.5	179.6	-62.7	-130.6	-61.4	0	0	111.6	T435 Q449 L452 V458 L459 K527	T435-M454 VanDerWaalsContact CG2-O 3.27Å; T435-M454 WeakPolarHBondContact CG2-O 3.25Å; Q449-M454 HydrophobicContact CG-CB 4.18Å; Q449-M454 WeakPolarHBondContact CG-O 3.49Å; Q449-M454 PolarHBondContact NE2-O 3.03Å; Q449-M454 VanDerWaalsContact NE2-O 3.15Å; Q449-M454 PolarHBondContact O-N 3.32Å; L452-M454 HydrophobicContact CB-CG 3.57Å; L452-M454 HydrophobicContact CD1-CG 4.25Å; L452-M454 HydrophobicContact CD1-SD 4.3Å; L452-M454 PolarHBondContact O-N 3.36Å; M454-V458 HydrophobicContact CE-CG1 4.32Å; M454-V458 HydrophobicContact SD-CG1 3.97Å; M454-L459 HydrophobicContact CE-CB 4.49Å; M454-L459 HydrophobicContact CE-CD1 4.06Å; M454-K527 HydrophobicContact CG-CB 4.39Å; M454-K527 VanDerWaalsContact SD-C 3.6Å; M454-K527 HydrophobicContact SD-CB 3.92Å
455	P	80.7	Confident	82.7	Confident	7 Å²	7	43 Å²	43	5%	0.045	21%	0.211	C	C	.	.			trans	-65.7	152.7	171.3	29.7	-33.5	0	0	0	110.6	E457 V458 L459	P455-E457 VanDerWaalsContact C-N 3.26Å; P455-E457 PolarHBondContact O-N 3.21Å; P455-V458 HydrophobicContact CG-CB 3.88Å; P455-V458 HydrophobicContact CG-CG2 3.59Å; P455-V458 PolarHBondContact O-N 2.94Å; P455-V458 VanDerWaalsContact O-N 3.16Å; P455-L459 PolarHBondContact O-N 3.47Å
456	S	80.5	Confident	83.6	Confident	51 Å²	51	42 Å²	42	36%	0.357	21%	0.206	S	C	.	.	H	α-helix	trans	-60	-36.8	-173.8	-61.8	0	0	0	0	112.3	V458 L459 E460	S456-V458 VanDerWaalsContact C-N 3.34Å; S456-V458 PolarHBondContact O-N 3.28Å; S456-L459 WeakPolarHBondContact O-CB 3.46Å; S456-L459 PolarHBondContact O-N 2.94Å; S456-E460 WeakPolarHBondContact O-CG 3.49Å; S456-E460 PolarHBondContact O-N 3.2Å
457	E	84.2	Confident	84.5	Confident	81 Å²	81	41.8 Å²	41.8	38%	0.379	21%	0.214	S	C	.	.	H	α-helix	trans	-65.1	-37	179.4	-58.6	80.3	-179.5	0	0	112	I425 P455 K461	I425-E457 HydrophobicContact CG2-CB 4.03Å; I425-E457 HydrophobicContact CG2-CG 4.39Å; P455-E457 VanDerWaalsContact C-N 3.26Å; P455-E457 PolarHBondContact O-N 3.21Å; E457-K461 PolarHBondContact O-N 2.82Å
458	V	86	Confident	85.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-74	-35.9	175.6	173.5	0	0	0	0	110.7	I425 M454 P455 S456 K461 C462 H524 K527 F528	I425-V458 HydrophobicContact CD1-CG2 3.77Å; M454-V458 HydrophobicContact CE-CG1 4.32Å; M454-V458 HydrophobicContact SD-CG1 3.97Å; P455-V458 HydrophobicContact CG-CB 3.88Å; P455-V458 HydrophobicContact CG-CG2 3.59Å; P455-V458 PolarHBondContact O-N 2.94Å; P455-V458 VanDerWaalsContact O-N 3.16Å; S456-V458 VanDerWaalsContact C-N 3.34Å; S456-V458 PolarHBondContact O-N 3.28Å; V458-K461 PolarHBondContact O-N 3.39Å; V458-C462 PolarHBondContact O-N 3.06Å; V458-C462 PolarHBondContact O-SG 3.35Å; V458-H524 HydrophobicContact CG2-CB 3.84Å; V458-K527 HydrophobicContact CG1-CB 4.23Å; V458-F528 HydrophobicContact CG1-CB 3.83Å; V458-F528 HydrophobicContact CG1-CD2 4.39Å
459	L	84.8	Confident	85.8	Confident	10 Å²	10	39.4 Å²	39.4	5%	0.052	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-42.5	174.6	-177.7	63	0	0	0	111.5	L445 Q449 M454 P455 S456 K461 C462 Q463	L445-L459 HydrophobicContact CD1-CD1 4.28Å; L445-L459 HydrophobicContact CD2-CD1 3.95Å; L445-L459 HydrophobicContact CD2-CD2 3.8Å; L445-L459 HydrophobicContact CD2-CG 4.18Å; L445-L459 HydrophobicContact CG-CD1 4.05Å; Q449-L459 HydrophobicContact CB-CD2 4.13Å; Q449-L459 VanDerWaalsContact CD-CD2 3.41Å; Q449-L459 HydrophobicContact CG-CD2 3.92Å; Q449-L459 VanDerWaalsContact OE1-CD2 3.32Å; M454-L459 HydrophobicContact CE-CB 4.49Å; M454-L459 HydrophobicContact CE-CD1 4.06Å; P455-L459 PolarHBondContact O-N 3.47Å; S456-L459 WeakPolarHBondContact O-CB 3.46Å; S456-L459 PolarHBondContact O-N 2.94Å; L459-K461 VanDerWaalsContact C-N 3.29Å; L459-K461 PolarHBondContact O-N 3.47Å; L459-C462 CarbonylContact O-C 3.59Å; L459-C462 WeakPolarHBondContact O-CA 3.26Å; L459-C462 WeakPolarHBondContact O-CB 3.14Å; L459-C462 PolarHBondContact O-N 2.69Å; L459-Q463 HydrophobicContact CG-CG 4.47Å; L459-Q463 WeakPolarHBondContact O-CG 3.44Å; L459-Q463 PolarHBondContact O-N 2.64Å
460	E	86.2	Confident	86.3	Confident	123 Å²	123	43.9 Å²	43.9	58%	0.575	22%	0.218	S	C	*	.	H	α-helix	trans	-58	-41.8	174.2	-76.8	178.1	-175.7	0	0	111.3	S456 C462 Q463 F464	S456-E460 WeakPolarHBondContact O-CG 3.49Å; S456-E460 PolarHBondContact O-N 3.2Å; E460-C462 PolarHBondContact O-N 2.81Å; E460-Q463 PolarHBondContact O-N 3.44Å; E460-F464 WeakPolarHBondContact O-CB 3.35Å; E460-F464 PolarHBondContact O-N 2.91Å
461	K	89.2	Confident	86.8	Confident	37 Å²	37	42.8 Å²	42.8	16%	0.161	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-41.1	172.5	-75	176.4	177	-85.4	0	112.3	A418 D421 F422 I425 E457 V458 L459 F464 V465 F528	A418-K461 PolarHBondContact O-NZ 2.94Å; D421-K461 WeakPolarHBondContact O-CE 3.11Å; D421-K461 PolarHBondContact O-NZ 2.85Å; F422-K461 HydrophobicContact CE1-CD 4.5Å; I425-K461 HydrophobicContact CD1-CD 4.29Å; E457-K461 PolarHBondContact O-N 2.82Å; V458-K461 PolarHBondContact O-N 3.39Å; L459-K461 VanDerWaalsContact C-N 3.29Å; L459-K461 PolarHBondContact O-N 3.47Å; K461-F464 PolarHBondContact O-N 2.87Å; K461-V465 WeakPolarHBondContact O-CG2 3.44Å; K461-V465 PolarHBondContact O-N 2.89Å; K461-V465 VanDerWaalsContact O-N 3.1Å; K461-F528 HydrophobicContact CB-CD2 4.1Å; K461-F528 HydrophobicContact CB-CE2 3.92Å
462	C	89.2	Confident	87.1	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-65.9	-41.4	176	-64.8	0	0	0	0	111.9	V458 L459 E460 V465 D466 F528 C536	V458-C462 PolarHBondContact O-N 3.06Å; V458-C462 PolarHBondContact O-SG 3.35Å; L459-C462 CarbonylContact O-C 3.59Å; L459-C462 WeakPolarHBondContact O-CA 3.26Å; L459-C462 WeakPolarHBondContact O-CB 3.14Å; L459-C462 PolarHBondContact O-N 2.69Å; E460-C462 PolarHBondContact O-N 2.81Å; C462-V465 PolarHBondContact O-N 3.11Å; C462-D466 WeakPolarHBondContact O-CB 3.43Å; C462-D466 PolarHBondContact O-N 2.94Å; C462-F528 WeakPolarHBondContact SG-CD2 3.2Å; C462-C536 PolarHBondContact O-SG 3.22Å; C462-C536 VanDerWaalsContact O-SG 3.33Å
463	Q	89.8	Confident	87.2	Confident	90 Å²	90	37 Å²	37	42%	0.421	19%	0.19	S	C	.	.	H	α-helix	trans	-65.2	-38.3	176	-72.9	176.8	-24.1	0	0	112.1	L445 L459 E460 D466 G467	L445-Q463 HydrophobicContact CD1-CG 4.13Å; L459-Q463 HydrophobicContact CG-CG 4.47Å; L459-Q463 WeakPolarHBondContact O-CG 3.44Å; L459-Q463 PolarHBondContact O-N 2.64Å; E460-Q463 PolarHBondContact O-N 3.44Å; Q463-D466 PolarHBondContact O-N 3.43Å; Q463-G467 PolarHBondContact O-N 3.37Å
464	F	92.1	Very high	87.4	Confident	85 Å²	85	41.4 Å²	41.4	37%	0.373	21%	0.214	S	C	.	.	H	α-helix	trans	-59.2	-51.1	173.2	168.1	-106.8	0	0	0	110.9	V415 A418 E460 K461 D466 G467 E468	V415-F464 HydrophobicContact CG1-CE1 4.22Å; V415-F464 HydrophobicContact CG2-CZ 4.49Å; A418-F464 HydrophobicContact CB-CE1 4.07Å; E460-F464 WeakPolarHBondContact O-CB 3.35Å; E460-F464 PolarHBondContact O-N 2.91Å; K461-F464 PolarHBondContact O-N 2.87Å; F464-D466 PolarHBondContact O-N 3.42Å; F464-G467 PolarHBondContact O-N 3.47Å; F464-E468 HydrophobicContact CD2-CG 4.32Å; F464-E468 HydrophobicContact CE2-CG 3.87Å; F464-E468 HydrophobicContact CZ-CG 4.06Å; F464-E468 WeakPolarHBondContact O-CG 3.4Å; F464-E468 PolarHBondContact O-N 3.13Å; F464-E468 VanDerWaalsContact O-N 3.08Å
465	V	91.8	Very high	87.4	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.1	-51.4	176.8	175.6	0	0	0	0	110.4	V415 A419 K461 C462 G467 E468 Y469 F528 L532	V415-V465 HydrophobicContact CG1-CB 4.12Å; V415-V465 HydrophobicContact CG1-CG1 4.01Å; V415-V465 HydrophobicContact CG1-CG2 3.75Å; A419-V465 HydrophobicContact CB-CG2 3.99Å; K461-V465 WeakPolarHBondContact O-CG2 3.44Å; K461-V465 PolarHBondContact O-N 2.89Å; K461-V465 VanDerWaalsContact O-N 3.1Å; C462-V465 PolarHBondContact O-N 3.11Å; V465-G467 VanDerWaalsContact C-N 3.31Å; V465-G467 PolarHBondContact O-N 2.89Å; V465-E468 PolarHBondContact O-N 3.46Å; V465-Y469 HydrophobicContact CG1-CD2 3.77Å; V465-Y469 HydrophobicContact CG1-CE2 3.75Å; V465-Y469 VanDerWaalsContact O-CD2 3.27Å; V465-Y469 WeakPolarHBondContact O-CD2 3.09Å; V465-Y469 PolarHBondContact O-N 2.95Å; V465-F528 HydrophobicContact CG2-CE2 4.36Å; V465-F528 HydrophobicContact CG2-CZ 4.05Å; V465-L532 HydrophobicContact CB-CD2 4.17Å; V465-L532 HydrophobicContact CG1-CD2 3.88Å; V465-L532 HydrophobicContact CG2-CD2 4.43Å
466	D	92.4	Very high	87.4	Confident	21 Å²	21	41.9 Å²	41.9	11%	0.112	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-36.4	-177.6	-161.3	58	0	0	0	113	C462 Q463 F464 Y469 K470 C536 D537 H538 F539	C462-D466 WeakPolarHBondContact O-CB 3.43Å; C462-D466 PolarHBondContact O-N 2.94Å; Q463-D466 PolarHBondContact O-N 3.43Å; F464-D466 PolarHBondContact O-N 3.42Å; D466-Y469 PolarHBondContact O-N 3.19Å; D466-K470 PolarHBondContact O-N 2.94Å; D466-C536 HydrophobicContact CB-CB 3.94Å; D466-C536 WeakPolarHBondContact OD1-CA 3.21Å; D466-C536 WeakPolarHBondContact OD1-CB 3.48Å; D466-D537 PolarHBondContact OD1-N 3.3Å; D466-H538 WeakPolarHBondContact OD1-CA 3.44Å; D466-H538 VanDerWaalsContact OD1-CB 3.29Å; D466-H538 WeakPolarHBondContact OD1-CB 3.29Å; D466-H538 IonicContact OD1-CG 3.93Å; D466-H538 PolarHBondContact OD1-N 3.14Å; D466-H538 IonicContact OD1-ND1 2.64Å; D466-H538 IonicContact OD2-CE1 3.25Å; D466-H538 IonicContact OD2-CG 3.4Å; D466-H538 IonicContact OD2-ND1 2.74Å; D466-H538 PolarHBondContact OD2-ND1 2.93Å; D466-F539 PolarHBondContact OD1-N 3.47Å
467	G	91.5	Very high	87.4	Confident	33 Å²	33	42.5 Å²	42.5	34%	0.34	22%	0.217	S	C	.	.	H	α-helix	trans	-62.9	-41.1	174.3	0	0	0	0	0	112.8	Q463 F464 V465 K470 T471	Q463-G467 PolarHBondContact O-N 3.37Å; F464-G467 PolarHBondContact O-N 3.47Å; V465-G467 VanDerWaalsContact C-N 3.31Å; V465-G467 PolarHBondContact O-N 2.89Å; G467-K470 WeakPolarHBondContact O-CB 2.94Å; G467-K470 PolarHBondContact O-N 3.2Å; G467-T471 WeakPolarHBondContact O-CG2 3.5Å; G467-T471 PolarHBondContact O-N 3.37Å
468	E	91.2	Very high	87.1	Confident	64 Å²	64	40.1 Å²	40.1	30%	0.299	21%	0.211	S	C	.	.	H	α-helix	trans	-69.3	-34.9	174.9	-66.4	-69.9	140.7	0	0	111.8	V415 F464 V465 K470 T471 M472	V415-E468 HydrophobicContact CG1-CB 4.5Å; V415-E468 HydrophobicContact CG2-CB 3.68Å; V415-E468 HydrophobicContact CG2-CG 3.74Å; F464-E468 HydrophobicContact CD2-CG 4.32Å; F464-E468 HydrophobicContact CE2-CG 3.87Å; F464-E468 HydrophobicContact CZ-CG 4.06Å; F464-E468 WeakPolarHBondContact O-CG 3.4Å; F464-E468 PolarHBondContact O-N 3.13Å; F464-E468 VanDerWaalsContact O-N 3.08Å; V465-E468 PolarHBondContact O-N 3.46Å; E468-K470 VanDerWaalsContact C-N 3.34Å; E468-T471 PolarHBondContact O-N 2.83Å; E468-T471 PolarHBondContact O-OG1 3.27Å; E468-M472 WeakPolarHBondContact O-CE 3.45Å; E468-M472 WeakPolarHBondContact O-CG 3.32Å; E468-M472 PolarHBondContact O-N 3.5Å
469	Y	90.8	Very high	86.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-37.7	170.9	-86.4	-82.2	0	0	0	112.5	F416 V465 D466 M472 L473 L494 T498 F539 A542	F416-Y469 HydrophobicContact CE2-CE2 4.42Å; F416-Y469 WeakPolarHBondContact CE2-OH 3.32Å; V465-Y469 HydrophobicContact CG1-CD2 3.77Å; V465-Y469 HydrophobicContact CG1-CE2 3.75Å; V465-Y469 VanDerWaalsContact O-CD2 3.27Å; V465-Y469 WeakPolarHBondContact O-CD2 3.09Å; V465-Y469 PolarHBondContact O-N 2.95Å; D466-Y469 PolarHBondContact O-N 3.19Å; Y469-M472 HydrophobicContact CD1-CE 3.8Å; Y469-M472 HydrophobicContact CD2-CE 4.22Å; Y469-M472 HydrophobicContact CE1-CE 3.88Å; Y469-M472 HydrophobicContact CE2-CE 4.29Å; Y469-M472 HydrophobicContact CG-CE 3.97Å; Y469-M472 PolarHBondContact O-N 3.45Å; Y469-L473 WeakPolarHBondContact O-CB 3.49Å; Y469-L473 VanDerWaalsContact O-CG 3.23Å; Y469-L473 WeakPolarHBondContact O-CG 3.42Å; Y469-L473 PolarHBondContact O-N 3.49Å; Y469-L494 HydrophobicContact CE1-CD1 4.23Å; Y469-T498 HydrophobicContact CE1-CG2 3.51Å; Y469-T498 WeakPolarHBondContact OH-CG2 3.42Å; Y469-F539 HydrophobicContact CD1-CD2 4.36Å; Y469-F539 HydrophobicContact CD2-CB 4.18Å; Y469-F539 AromaticContact CD2-CD2 3.87Å; Y469-F539 HydrophobicContact CD2-CD2 3.87Å; Y469-F539 HydrophobicContact CE1-CD2 4.03Å; Y469-F539 AromaticContact CE2-CD2 3.52Å; Y469-F539 HydrophobicContact CE2-CD2 3.52Å; Y469-F539 HydrophobicContact CE2-CE2 4.14Å; Y469-F539 HydrophobicContact CG-CB 4.27Å; Y469-F539 HydrophobicContact CG-CD2 4.29Å; Y469-F539 AromaticContact CZ-CD2 3.59Å; Y469-F539 AromaticContact CZ-CE2 3.96Å; Y469-A542 HydrophobicContact CD1-CB 3.97Å; Y469-A542 HydrophobicContact CE1-CB 4.19Å
470	K	90	Very high	85.7	Confident	98 Å²	98	41 Å²	41	43%	0.426	22%	0.216	S	C	.	.	H	α-helix	trans	-61.2	-48.6	173.7	-178.1	179.8	178.5	175	0	111.6	D466 G467 E468 M472 L473 D474 H538	D466-K470 PolarHBondContact O-N 2.94Å; G467-K470 WeakPolarHBondContact O-CB 2.94Å; G467-K470 PolarHBondContact O-N 3.2Å; E468-K470 VanDerWaalsContact C-N 3.34Å; K470-M472 VanDerWaalsContact C-N 3.29Å; K470-M472 PolarHBondContact O-N 2.84Å; K470-L473 PolarHBondContact O-N 2.89Å; K470-D474 WeakPolarHBondContact O-CB 2.93Å; K470-D474 VanDerWaalsContact O-CG 3.27Å; K470-D474 PolarHBondContact O-N 3.43Å; K470-H538 HydrophobicContact CB-CB 4.25Å
471	T	87.6	Confident	84.4	Confident	62 Å²	62	40.4 Å²	40.4	38%	0.38	22%	0.221	S	C	.	.	H	α-helix	trans	-62.6	-37.4	179.1	60.2	0	0	0	0	112.1	G467 E468 A475	G467-T471 WeakPolarHBondContact O-CG2 3.5Å; G467-T471 PolarHBondContact O-N 3.37Å; E468-T471 PolarHBondContact O-N 2.83Å; E468-T471 PolarHBondContact O-OG1 3.27Å; T471-A475 WeakPolarHBondContact O-CB 3.42Å; T471-A475 PolarHBondContact O-N 2.99Å; T471-A475 VanDerWaalsContact O-N 3.09Å
472	M	86.7	Confident	82.7	Confident	1 Å²	1	40 Å²	40	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-64.5	-45.5	173.5	-73.8	-171.5	-74.9	0	0	111.8	L354 V408 I411 V412 E468 Y469 K470 A475 L476 L494	L354-M472 HydrophobicContact CD1-CB 4.35Å; L354-M472 HydrophobicContact CD1-CG 3.79Å; V408-M472 HydrophobicContact CG1-SD 4.45Å; I411-M472 HydrophobicContact CB-SD 4.21Å; I411-M472 HydrophobicContact CG2-CE 4.18Å; I411-M472 HydrophobicContact CG2-CG 4.26Å; I411-M472 HydrophobicContact CG2-SD 3.73Å; V412-M472 HydrophobicContact CG2-CE 3.92Å; V412-M472 HydrophobicContact CG2-SD 3.8Å; E468-M472 WeakPolarHBondContact O-CE 3.45Å; E468-M472 WeakPolarHBondContact O-CG 3.32Å; E468-M472 PolarHBondContact O-N 3.5Å; Y469-M472 HydrophobicContact CD1-CE 3.8Å; Y469-M472 HydrophobicContact CD2-CE 4.22Å; Y469-M472 HydrophobicContact CE1-CE 3.88Å; Y469-M472 HydrophobicContact CE2-CE 4.29Å; Y469-M472 HydrophobicContact CG-CE 3.97Å; Y469-M472 PolarHBondContact O-N 3.45Å; K470-M472 VanDerWaalsContact C-N 3.29Å; K470-M472 PolarHBondContact O-N 2.84Å; M472-A475 PolarHBondContact O-N 3.3Å; M472-L476 VanDerWaalsContact O-CG 3.26Å; M472-L476 WeakPolarHBondContact O-CG 3.31Å; M472-L476 PolarHBondContact O-N 3.21Å; M472-L494 HydrophobicContact CE-CD1 4.33Å; M472-L494 HydrophobicContact SD-CD1 3.93Å
473	L	85.1	Confident	80.9	Confident	13 Å²	13	46.6 Å²	46.6	7%	0.068	25%	0.251	C	S	.	.	H	α-helix	trans	-66.3	-43.5	179.7	-73.6	168	0	0	0	112.7	Y469 K470 A475 L476 D477 L494 H538 S541	Y469-L473 WeakPolarHBondContact O-CB 3.49Å; Y469-L473 VanDerWaalsContact O-CG 3.23Å; Y469-L473 WeakPolarHBondContact O-CG 3.42Å; Y469-L473 PolarHBondContact O-N 3.49Å; K470-L473 PolarHBondContact O-N 2.89Å; L473-A475 VanDerWaalsContact C-N 3.27Å; L473-A475 PolarHBondContact O-N 3.39Å; L473-L476 HydrophobicContact CD2-CD1 4.39Å; L473-L476 WeakPolarHBondContact O-CB 3.02Å; L473-L476 PolarHBondContact O-N 2.95Å; L473-L476 VanDerWaalsContact O-N 3.13Å; L473-D477 PolarHBondContact O-N 2.94Å; L473-L494 HydrophobicContact CD2-CD2 4.48Å; L473-H538 HydrophobicContact CD1-CB 4.11Å; L473-H538 WeakPolarHBondContact CD1-O 3.35Å; L473-S541 WeakPolarHBondContact CD1-OG 3.5Å
474	D	85.1	Confident	78.8	Confident	92 Å²	92	50.7 Å²	50.7	49%	0.492	27%	0.27	S	S	.	.	H	α-helix	trans	-59.4	-41.3	175.1	-69.5	-19.9	0	0	0	110.6	K470 D477 A478	K470-D474 WeakPolarHBondContact O-CB 2.93Å; K470-D474 VanDerWaalsContact O-CG 3.27Å; K470-D474 PolarHBondContact O-N 3.43Å; D474-D477 PolarHBondContact O-N 3.36Å; D474-A478 PolarHBondContact O-N 2.86Å; D474-A478 VanDerWaalsContact O-N 3.09Å
475	A	81	Confident	76.8	Confident	10 Å²	10	51.7 Å²	51.7	8%	0.083	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-43.5	174.5	0	0	0	0	0	111.8	L354 V358 T471 M472 L473 D477 A478 F479	L354-A475 HydrophobicContact CB-CB 3.8Å; L354-A475 HydrophobicContact CD1-CB 4.25Å; V358-A475 HydrophobicContact CG2-CB 4.43Å; T471-A475 WeakPolarHBondContact O-CB 3.42Å; T471-A475 PolarHBondContact O-N 2.99Å; T471-A475 VanDerWaalsContact O-N 3.09Å; M472-A475 PolarHBondContact O-N 3.3Å; L473-A475 VanDerWaalsContact C-N 3.27Å; L473-A475 PolarHBondContact O-N 3.39Å; A475-D477 VanDerWaalsContact C-N 3.32Å; A475-D477 PolarHBondContact O-N 2.88Å; A475-A478 WeakPolarHBondContact O-CB 3.34Å; A475-A478 PolarHBondContact O-N 3.5Å; A475-F479 WeakPolarHBondContact O-CD2 3.28Å; A475-F479 PolarHBondContact O-N 3.49Å
476	L	79.9	Confident	74.8	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-60.7	-40.8	176.5	-73.1	177.5	0	0	0	112.2	M472 L473 A478 F479 C480 L490 L494	M472-L476 VanDerWaalsContact O-CG 3.26Å; M472-L476 WeakPolarHBondContact O-CG 3.31Å; M472-L476 PolarHBondContact O-N 3.21Å; L473-L476 HydrophobicContact CD2-CD1 4.39Å; L473-L476 WeakPolarHBondContact O-CB 3.02Å; L473-L476 PolarHBondContact O-N 2.95Å; L473-L476 VanDerWaalsContact O-N 3.13Å; L476-A478 VanDerWaalsContact C-N 3.34Å; L476-F479 WeakPolarHBondContact O-CB 3.22Å; L476-F479 PolarHBondContact O-N 3.39Å; L476-C480 PolarHBondContact O-N 2.98Å; L476-C480 VanDerWaalsContact O-N 3.08Å; L476-C480 PolarHBondContact O-SG 3.04Å; L476-L490 HydrophobicContact CD2-CB 3.31Å; L476-L490 HydrophobicContact CD2-CD1 4.09Å; L476-L490 HydrophobicContact CD2-CG 4.27Å; L476-L494 HydrophobicContact CD1-CB 4.5Å; L476-L494 HydrophobicContact CD1-CD2 3.51Å
477	D	81	Confident	72.7	Confident	63 Å²	63	53.3 Å²	53.3	34%	0.337	30%	0.3	S	S	.	.	H	α-helix	trans	-63.6	-41.5	175.7	-84.2	-32.5	0	0	0	111.1	L473 D474 A475 F479 C480 R546	L473-D477 PolarHBondContact O-N 2.94Å; D474-D477 PolarHBondContact O-N 3.36Å; A475-D477 VanDerWaalsContact C-N 3.32Å; A475-D477 PolarHBondContact O-N 2.88Å; D477-F479 VanDerWaalsContact C-N 3.34Å; D477-F479 PolarHBondContact O-N 3.29Å; D477-C480 WeakPolarHBondContact O-CB 3.41Å; D477-C480 PolarHBondContact O-N 3Å; D477-R546 IonicContact OD1-CZ 3.7Å; D477-R546 IonicContact OD1-NH2 3.9Å; D477-R546 PolarHBondContact OD1-NH2 3.41Å
478	A	78.5	Confident	71.1	Confident	31 Å²	31	58.7 Å²	58.7	26%	0.256	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-35.5	172.8	0	0	0	0	0	112.8	V358 R361 D474 A475 L476 C480 T481	V358-A478 HydrophobicContact CG1-CB 3.75Å; V358-A478 HydrophobicContact CG2-CB 4.19Å; R361-A478 PolarHBondContact NH1-O 2.95Å; D474-A478 PolarHBondContact O-N 2.86Å; D474-A478 VanDerWaalsContact O-N 3.09Å; A475-A478 WeakPolarHBondContact O-CB 3.34Å; A475-A478 PolarHBondContact O-N 3.5Å; L476-A478 VanDerWaalsContact C-N 3.34Å; A478-C480 PolarHBondContact O-N 3.39Å; A478-T481 PolarHBondContact O-OG1 2.69Å
479	F	74.8	Confident	69.7	Low	10 Å²	10	60.2 Å²	60.2	4%	0.044	33%	0.327	C	S	.	.	H	α-helix	trans	-64.8	-21.9	170.8	-90	-78.1	0	0	0	113	L357 V358 R361 I400 A404 A475 L476 D477 L490	L357-F479 HydrophobicContact CB-CE2 4.47Å; L357-F479 HydrophobicContact CB-CZ 3.77Å; V358-F479 HydrophobicContact CB-CE2 4.43Å; V358-F479 HydrophobicContact CG2-CD2 3.53Å; V358-F479 HydrophobicContact CG2-CE2 3.3Å; V358-F479 HydrophobicContact CG2-CG 4.31Å; V358-F479 HydrophobicContact CG2-CZ 3.95Å; R361-F479 HydrophobicContact CB-CE1 4.21Å; R361-F479 VanDerWaalsContact CD-CE1 3.49Å; R361-F479 HydrophobicContact CG-CE1 4.47Å; R361-F479 PolarHBondContact NH1-O 2.83Å; R361-F479 PolarHBondContact NH2-O 2.92Å; I400-F479 HydrophobicContact CG2-CE1 3.83Å; I400-F479 HydrophobicContact CG2-CZ 4.35Å; A404-F479 HydrophobicContact CB-CE1 4.38Å; A404-F479 HydrophobicContact CB-CE2 4.47Å; A404-F479 HydrophobicContact CB-CZ 4.01Å; A475-F479 WeakPolarHBondContact O-CD2 3.28Å; A475-F479 PolarHBondContact O-N 3.49Å; L476-F479 WeakPolarHBondContact O-CB 3.22Å; L476-F479 PolarHBondContact O-N 3.39Å; D477-F479 VanDerWaalsContact C-N 3.34Å; D477-F479 PolarHBondContact O-N 3.29Å; F479-L490 HydrophobicContact CB-CD1 4.1Å; F479-L490 HydrophobicContact CD1-CD1 3.85Å; F479-L490 HydrophobicContact CD2-CD1 4.09Å; F479-L490 HydrophobicContact CE1-CD1 4.33Å; F479-L490 HydrophobicContact CG-CD1 3.76Å
480	C	65.9	Low	68.7	Low	18 Å²	18	60.8 Å²	60.8	12%	0.122	33%	0.329	C	S	.	.	H	α-helix	trans	-92.6	-15.3	-173.2	-71.6	0	0	0	0	115.4	L476 D477 A478 A482 R546	L476-C480 PolarHBondContact O-N 2.98Å; L476-C480 VanDerWaalsContact O-N 3.08Å; L476-C480 PolarHBondContact O-SG 3.04Å; D477-C480 WeakPolarHBondContact O-CB 3.41Å; D477-C480 PolarHBondContact O-N 3Å; A478-C480 PolarHBondContact O-N 3.39Å; C480-A482 PolarHBondContact O-N 3.11Å; C480-R546 PolarHBondContact SG-NH1 2.93Å; C480-R546 VanDerWaalsContact SG-NH1 3.37Å
481	T	58.5	Low	68.2	Low	111 Å²	111	56.9 Å²	56.9	68%	0.681	31%	0.313	S	S	*	.	S	Bend	trans	-67.7	1.1	-164.8	50.8	0	0	0	0	116.9	A478	A478-T481 PolarHBondContact O-OG1 2.69Å
482	A	53.7	Low	67.8	Low	29 Å²	29	59.6 Å²	59.6	24%	0.24	32%	0.321	C	S	.	.	S	Bend	trans	-121.9	-36.1	-170.8	0	0	0	0	0	116	Q365 C480	Q365-A482 VanDerWaalsContact CD-CB 3.44Å; Q365-A482 VanDerWaalsContact OE1-CB 3.29Å; C480-A482 PolarHBondContact O-N 3.11Å
483	Y	51.1	Low	67.6	Low	140 Å²	140	60.1 Å²	60.1	55%	0.549	33%	0.325	S	S	.	.			trans	-150.6	117	-175.1	-76.7	-84	0	0	0	110.3	S485 S486	Y483-S485 VanDerWaalsContact C-N 3.25Å; Y483-S485 PolarHBondContact O-N 3.44Å; Y483-S486 PolarHBondContact O-N 2.72Å
484	E	46.2	Very low	67.7	Low	175 Å²	175	59.6 Å²	59.6	82%	0.818	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-58.4	-33.3	-173.8	-71	-177.2	155.9	0	0	113.2	S486 S487	E484-S486 PolarHBondContact O-N 2.88Å; E484-S487 VanDerWaalsContact O-CB 3.3Å; E484-S487 WeakPolarHBondContact O-CB 3.31Å; E484-S487 PolarHBondContact O-N 2.78Å; E484-S487 PolarHBondContact O-OG 3Å
485	S	49.6	Very low	67.8	Low	106 Å²	106	55.5 Å²	55.5	74%	0.741	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-63.7	-24.4	-177.7	-45.6	0	0	0	0	113.3	Y483	Y483-S485 VanDerWaalsContact C-N 3.25Å; Y483-S485 PolarHBondContact O-N 3.44Å
486	S	49.4	Very low	68.1	Low	33 Å²	33	58.5 Å²	58.5	23%	0.231	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-86.6	-12.1	178.1	-51.9	0	0	0	0	113.5	Y483 E484 Q488 L489	Y483-S486 PolarHBondContact O-N 2.72Å; E484-S486 PolarHBondContact O-N 2.88Å; S486-Q488 VanDerWaalsContact C-N 3.27Å; S486-Q488 PolarHBondContact O-N 3.03Å; S486-L489 WeakPolarHBondContact O-CB 3.45Å; S486-L489 PolarHBondContact O-N 3.02Å; S486-L489 VanDerWaalsContact O-N 3.11Å
487	S	49	Very low	68.5	Low	22 Å²	22	58.7 Å²	58.7	15%	0.154	32%	0.32	C	S	.	.	H	α-helix	trans	-63.2	-33.6	-175.5	65.2	0	0	0	0	113.2	E484 L489	E484-S487 VanDerWaalsContact O-CB 3.3Å; E484-S487 WeakPolarHBondContact O-CB 3.31Å; E484-S487 PolarHBondContact O-N 2.78Å; E484-S487 PolarHBondContact O-OG 3Å; S487-L489 VanDerWaalsContact C-N 3.33Å
488	Q	57	Low	68.9	Low	147 Å²	147	55.7 Å²	55.7	69%	0.687	30%	0.304	S	S	*	.	H	α-helix	trans	-75	-24.4	178.5	-64.4	-179.4	-0.1	0	0	112.2	S486 L490 E492	S486-Q488 VanDerWaalsContact C-N 3.27Å; S486-Q488 PolarHBondContact O-N 3.03Å; Q488-L490 PolarHBondContact O-N 3.1Å; Q488-E492 PolarHBondContact O-N 3.15Å
489	L	62.8	Low	69.5	Low	96 Å²	96	55.3 Å²	55.3	50%	0.503	30%	0.299	S	S	.	.	H	α-helix	trans	-66.7	-32	-169.2	-77.7	167	0	0	0	113.9	S486 S487 P493	S486-L489 WeakPolarHBondContact O-CB 3.45Å; S486-L489 PolarHBondContact O-N 3.02Å; S486-L489 VanDerWaalsContact O-N 3.11Å; S487-L489 VanDerWaalsContact C-N 3.33Å; L489-P493 WeakPolarHBondContact O-CD 3.34Å; L489-P493 WeakPolarHBondContact O-CG 3.27Å
490	L	70.3	Confident	70.3	Confident	11 Å²	11	56.7 Å²	56.7	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-103.7	-22.5	-178.6	-73.9	164.6	0	0	0	113.8	A404 E405 L476 F479 Q488 L494	A404-L490 HydrophobicContact CB-CD1 4.02Å; A404-L490 HydrophobicContact CB-CD2 3.57Å; A404-L490 HydrophobicContact CB-CG 4.44Å; E405-L490 HydrophobicContact CB-CD2 4.28Å; L476-L490 HydrophobicContact CD2-CB 3.31Å; L476-L490 HydrophobicContact CD2-CD1 4.09Å; L476-L490 HydrophobicContact CD2-CG 4.27Å; F479-L490 HydrophobicContact CB-CD1 4.1Å; F479-L490 HydrophobicContact CD1-CD1 3.85Å; F479-L490 HydrophobicContact CD2-CD1 4.09Å; F479-L490 HydrophobicContact CE1-CD1 4.33Å; F479-L490 HydrophobicContact CG-CD1 3.76Å; Q488-L490 PolarHBondContact O-N 3.1Å; L490-L494 WeakPolarHBondContact O-CB 3.14Å; L490-L494 PolarHBondContact O-N 2.71Å
491	Q	77.8	Confident	71.5	Confident	17 Å²	17	56 Å²	56	8%	0.079	31%	0.307	C	S	.	.	H	α-helix	trans	-69.8	-42.5	177.2	-71.1	-170.9	-17.4	0	0	112.4	L494 V495	Q491-L494 PolarHBondContact O-N 3.39Å; Q491-V495 WeakPolarHBondContact O-CG2 3.28Å; Q491-V495 PolarHBondContact O-N 2.79Å
492	E	81	Confident	73.1	Confident	119 Å²	119	50.8 Å²	50.8	56%	0.556	28%	0.275	S	S	*	.	H	α-helix	trans	-63.9	-43.6	177.6	178.1	173.7	-161.2	0	0	111.9	Q488 L494 V495 T496	Q488-E492 PolarHBondContact O-N 3.15Å; E492-L494 PolarHBondContact O-N 3.36Å; E492-V495 PolarHBondContact O-N 3.46Å; E492-T496 HydrophobicContact CG-CG2 4.42Å; E492-T496 WeakPolarHBondContact O-CB 3.46Å; E492-T496 VanDerWaalsContact O-CG2 3.29Å; E492-T496 WeakPolarHBondContact O-CG2 3.42Å; E492-T496 PolarHBondContact O-N 3.13Å; E492-T496 PolarHBondContact O-OG1 2.97Å
493	P	82.1	Confident	74.9	Confident	12 Å²	12	54 Å²	54	8%	0.078	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-39.2	169.9	-28.4	36	0	0	0	114.9	E405 L489 T496 A497	E405-P493 HydrophobicContact CB-CB 4.34Å; E405-P493 HydrophobicContact CB-CG 4.45Å; E405-P493 HydrophobicContact CG-CB 3.76Å; E405-P493 HydrophobicContact CG-CG 4.05Å; L489-P493 WeakPolarHBondContact O-CD 3.34Å; L489-P493 WeakPolarHBondContact O-CG 3.27Å; P493-T496 VanDerWaalsContact CA-OG1 3.27Å; P493-T496 WeakPolarHBondContact CA-OG1 3.47Å; P493-T496 PolarHBondContact O-OG1 3.06Å; P493-T496 VanDerWaalsContact O-OG1 3.04Å; P493-A497 WeakPolarHBondContact O-CB 3.34Å; P493-A497 PolarHBondContact O-N 2.84Å
494	L	86.2	Confident	76.7	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-52.8	174.7	176.4	63.3	0	0	0	110	V408 V412 Y469 M472 L473 L476 L490 Q491 E492 T496 A497 T498 A542	V408-L494 HydrophobicContact CG1-CB 3.94Å; V408-L494 HydrophobicContact CG1-CD1 3.55Å; V408-L494 HydrophobicContact CG1-CG 4.35Å; V412-L494 HydrophobicContact CG2-CD1 3.78Å; Y469-L494 HydrophobicContact CE1-CD1 4.23Å; M472-L494 HydrophobicContact CE-CD1 4.33Å; M472-L494 HydrophobicContact SD-CD1 3.93Å; L473-L494 HydrophobicContact CD2-CD2 4.48Å; L476-L494 HydrophobicContact CD1-CB 4.5Å; L476-L494 HydrophobicContact CD1-CD2 3.51Å; L490-L494 WeakPolarHBondContact O-CB 3.14Å; L490-L494 PolarHBondContact O-N 2.71Å; Q491-L494 PolarHBondContact O-N 3.39Å; E492-L494 PolarHBondContact O-N 3.36Å; L494-T496 PolarHBondContact O-N 3.48Å; L494-A497 PolarHBondContact O-N 3.45Å; L494-T498 HydrophobicContact CD1-CG2 4.08Å; L494-T498 HydrophobicContact CG-CG2 4.29Å; L494-T498 WeakPolarHBondContact O-CG2 3.28Å; L494-T498 PolarHBondContact O-N 3.29Å; L494-A542 HydrophobicContact CD2-CB 4.07Å
495	V	87.8	Confident	78.9	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.03	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-44.6	-178.6	172.1	0	0	0	0	111.4	Q491 E492 A497 T498 V499 A542 F543 H549 A552	Q491-V495 WeakPolarHBondContact O-CG2 3.28Å; Q491-V495 PolarHBondContact O-N 2.79Å; E492-V495 PolarHBondContact O-N 3.46Å; V495-A497 PolarHBondContact O-N 2.84Å; V495-T498 WeakPolarHBondContact CA-OG1 3.42Å; V495-T498 PolarHBondContact O-N 2.98Å; V495-T498 PolarHBondContact O-OG1 3.27Å; V495-V499 WeakPolarHBondContact O-CG2 3.29Å; V495-V499 PolarHBondContact O-N 3.02Å; V495-A542 WeakPolarHBondContact CG2-O 3.24Å; V495-F543 HydrophobicContact CG1-CD1 4.02Å; V495-F543 HydrophobicContact CG1-CE1 4.05Å; V495-F543 HydrophobicContact CG2-CD1 4.34Å; V495-H549 HydrophobicContact CG1-CB 4.19Å; V495-A552 HydrophobicContact CG1-CB 3.83Å
496	T	87.3	Confident	80.8	Confident	74 Å²	74	37.9 Å²	37.9	45%	0.454	21%	0.205	S	C	.	.	H	α-helix	trans	-65	-40	177.5	53.4	0	0	0	0	112.2	E492 P493 L494 V499 A500	E492-T496 HydrophobicContact CG-CG2 4.42Å; E492-T496 WeakPolarHBondContact O-CB 3.46Å; E492-T496 VanDerWaalsContact O-CG2 3.29Å; E492-T496 WeakPolarHBondContact O-CG2 3.42Å; E492-T496 PolarHBondContact O-N 3.13Å; E492-T496 PolarHBondContact O-OG1 2.97Å; P493-T496 VanDerWaalsContact CA-OG1 3.27Å; P493-T496 WeakPolarHBondContact CA-OG1 3.47Å; P493-T496 PolarHBondContact O-OG1 3.06Å; P493-T496 VanDerWaalsContact O-OG1 3.04Å; L494-T496 PolarHBondContact O-N 3.48Å; T496-V499 PolarHBondContact O-N 3.38Å; T496-A500 PolarHBondContact O-N 3.08Å; T496-A500 VanDerWaalsContact O-N 3.1Å
497	A	87.9	Confident	82.7	Confident	11 Å²	11	42.4 Å²	42.4	9%	0.091	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-42.7	174.2	0	0	0	0	0	112	K409 V412 P493 L494 V495 A500 A501	K409-A497 HydrophobicContact CG-CB 3.85Å; V412-A497 HydrophobicContact CB-CB 4.36Å; V412-A497 HydrophobicContact CG1-CB 4.34Å; V412-A497 HydrophobicContact CG2-CB 4.44Å; P493-A497 WeakPolarHBondContact O-CB 3.34Å; P493-A497 PolarHBondContact O-N 2.84Å; L494-A497 PolarHBondContact O-N 3.45Å; V495-A497 PolarHBondContact O-N 2.84Å; A497-A500 PolarHBondContact O-N 3.27Å; A497-A501 VanDerWaalsContact O-CB 3.31Å; A497-A501 WeakPolarHBondContact O-CB 3.31Å; A497-A501 PolarHBondContact O-N 3.41Å
498	T	90.7	Very high	84.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-44.6	177.6	64.7	0	0	0	0	112	V412 Y469 L494 V495 A500 A501 V502 F543	V412-T498 HydrophobicContact CG1-CG2 4.38Å; V412-T498 HydrophobicContact CG2-CG2 4.49Å; Y469-T498 HydrophobicContact CE1-CG2 3.51Å; Y469-T498 WeakPolarHBondContact OH-CG2 3.42Å; L494-T498 HydrophobicContact CD1-CG2 4.08Å; L494-T498 HydrophobicContact CG-CG2 4.29Å; L494-T498 WeakPolarHBondContact O-CG2 3.28Å; L494-T498 PolarHBondContact O-N 3.29Å; V495-T498 WeakPolarHBondContact CA-OG1 3.42Å; V495-T498 PolarHBondContact O-N 2.98Å; V495-T498 PolarHBondContact O-OG1 3.27Å; T498-A500 VanDerWaalsContact C-N 3.35Å; T498-A500 PolarHBondContact O-N 2.94Å; T498-A501 PolarHBondContact O-N 3.43Å; T498-V502 WeakPolarHBondContact O-CB 3.38Å; T498-V502 VanDerWaalsContact O-CG2 3.29Å; T498-V502 WeakPolarHBondContact O-CG2 3.33Å; T498-V502 PolarHBondContact O-N 3.35Å; T498-F543 HydrophobicContact CG2-CZ 4.4Å; T498-F543 WeakPolarHBondContact OG1-CE1 3.46Å; T498-F543 WeakPolarHBondContact OG1-CZ 3.4Å
499	V	90.4	Very high	85.8	Confident	24 Å²	24	39.2 Å²	39.2	15%	0.145	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-46.1	178.7	172.4	0	0	0	0	110.2	V495 T496 V502 Q503 F543 A552 I556	V495-V499 WeakPolarHBondContact O-CG2 3.29Å; V495-V499 PolarHBondContact O-N 3.02Å; T496-V499 PolarHBondContact O-N 3.38Å; V499-V502 PolarHBondContact O-N 2.71Å; V499-Q503 WeakPolarHBondContact O-CG 3.38Å; V499-Q503 PolarHBondContact O-N 3.42Å; V499-Q503 VanDerWaalsContact O-N 3.08Å; V499-F543 HydrophobicContact CG2-CE1 4.49Å; V499-A552 HydrophobicContact CG2-CB 4.04Å; V499-I556 HydrophobicContact CG2-CD1 3.77Å; V499-I556 HydrophobicContact CG2-CG1 4.18Å
500	A	91.2	Very high	86.7	Confident	39 Å²	39	39.6 Å²	39.6	32%	0.322	20%	0.2	S	C	.	.	H	α-helix	trans	-63.6	-43	177.9	0	0	0	0	0	112	T496 A497 T498 Q503 Q504	T496-A500 PolarHBondContact O-N 3.08Å; T496-A500 VanDerWaalsContact O-N 3.1Å; A497-A500 PolarHBondContact O-N 3.27Å; T498-A500 VanDerWaalsContact C-N 3.35Å; T498-A500 PolarHBondContact O-N 2.94Å; A500-Q503 PolarHBondContact O-N 3.48Å; A500-Q504 WeakPolarHBondContact O-CG 3.32Å; A500-Q504 PolarHBondContact O-N 3.03Å
501	A	91.2	Very high	87	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.025	23%	0.23	C	C	.	.	H	α-helix	trans	-67.2	-38.7	179.6	0	0	0	0	0	112.5	V412 F416 A497 T498 Q503 Q504 F505	V412-A501 HydrophobicContact CG1-CB 3.58Å; F416-A501 HydrophobicContact CB-CB 4.49Å; F416-A501 HydrophobicContact CD2-CB 3.63Å; F416-A501 HydrophobicContact CE2-CB 4.17Å; F416-A501 HydrophobicContact CG-CB 4.27Å; A497-A501 VanDerWaalsContact O-CB 3.31Å; A497-A501 WeakPolarHBondContact O-CB 3.31Å; A497-A501 PolarHBondContact O-N 3.41Å; T498-A501 PolarHBondContact O-N 3.43Å; A501-Q503 VanDerWaalsContact C-N 3.34Å; A501-Q504 PolarHBondContact O-N 2.9Å; A501-F505 VanDerWaalsContact O-CB 3.24Å; A501-F505 WeakPolarHBondContact O-CB 3.34Å; A501-F505 PolarHBondContact O-N 2.81Å
502	V	91.7	Very high	86.8	Confident	1 Å²	1	46 Å²	46	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-38.4	174.5	171.1	0	0	0	0	111.3	F416 T498 V499 F505 A506 F539 I556 V559 L560	F416-V502 HydrophobicContact CE1-CG2 4Å; F416-V502 HydrophobicContact CE2-CG2 4.12Å; F416-V502 HydrophobicContact CZ-CG2 3.56Å; T498-V502 WeakPolarHBondContact O-CB 3.38Å; T498-V502 VanDerWaalsContact O-CG2 3.29Å; T498-V502 WeakPolarHBondContact O-CG2 3.33Å; T498-V502 PolarHBondContact O-N 3.35Å; V499-V502 PolarHBondContact O-N 2.71Å; V502-F505 PolarHBondContact O-N 3.13Å; V502-A506 WeakPolarHBondContact O-CB 3.42Å; V502-A506 PolarHBondContact O-N 2.82Å; V502-F539 HydrophobicContact CG2-CZ 4.34Å; V502-I556 HydrophobicContact CB-CG1 4.32Å; V502-I556 HydrophobicContact CG1-CG1 4.31Å; V502-I556 HydrophobicContact CG1-CG2 4.25Å; V502-I556 HydrophobicContact CG2-CD1 4.37Å; V502-I556 HydrophobicContact CG2-CG1 4.34Å; V502-I556 HydrophobicContact CG2-CG2 4.33Å; V502-V559 HydrophobicContact CG1-CG1 4.11Å; V502-L560 HydrophobicContact CG1-CD2 4.05Å; V502-L560 HydrophobicContact CG1-CG 4.15Å
503	Q	91.4	Very high	86	Confident	96 Å²	96	41 Å²	41	45%	0.449	21%	0.21	S	C	.	.	H	α-helix	trans	-64.6	-45.9	175.1	-73.8	174.7	-25	0	0	111.5	V499 A500 A501 F505 A506 E507	V499-Q503 WeakPolarHBondContact O-CG 3.38Å; V499-Q503 PolarHBondContact O-N 3.42Å; V499-Q503 VanDerWaalsContact O-N 3.08Å; A500-Q503 PolarHBondContact O-N 3.48Å; A501-Q503 VanDerWaalsContact C-N 3.34Å; Q503-F505 VanDerWaalsContact C-N 3.35Å; Q503-F505 PolarHBondContact O-N 3.04Å; Q503-A506 PolarHBondContact O-N 3.31Å; Q503-E507 WeakPolarHBondContact O-CG 3.49Å; Q503-E507 PolarHBondContact O-N 2.86Å
504	Q	90.5	Very high	85.2	Confident	69 Å²	69	44.1 Å²	44.1	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-64	-39.7	175.3	-70.8	178.6	11.1	0	0	112.3	A500 A501 A506 E507 R508	A500-Q504 WeakPolarHBondContact O-CG 3.32Å; A500-Q504 PolarHBondContact O-N 3.03Å; A501-Q504 PolarHBondContact O-N 2.9Å; Q504-A506 VanDerWaalsContact C-N 3.32Å; Q504-A506 PolarHBondContact O-N 3.45Å; Q504-E507 PolarHBondContact O-N 2.71Å; Q504-R508 VanDerWaalsContact O-CG 3.28Å; Q504-R508 WeakPolarHBondContact O-CG 3.26Å; Q504-R508 PolarHBondContact O-N 3.47Å
505	F	91.5	Very high	84.1	Confident	3 Å²	3	51.3 Å²	51.3	1%	0.013	27%	0.266	C	S	.	.	H	α-helix	trans	-58.2	-46.6	172.7	170.6	-95.2	0	0	0	110.4	F416 F422 A501 V502 Q503 E507 R508 C509 F528 L560 L563	F416-F505 HydrophobicContact CD1-CB 4.03Å; F416-F505 HydrophobicContact CD1-CD2 4.04Å; F416-F505 HydrophobicContact CD1-CG 4.01Å; F422-F505 AromaticContact CE2-CE2 3.93Å; F422-F505 HydrophobicContact CE2-CE2 3.93Å; F422-F505 AromaticContact CE2-CZ 3.89Å; F422-F505 HydrophobicContact CE2-CZ 3.89Å; F422-F505 HydrophobicContact CZ-CE2 4.06Å; F422-F505 AromaticContact CZ-CZ 3.89Å; F422-F505 HydrophobicContact CZ-CZ 3.89Å; A501-F505 VanDerWaalsContact O-CB 3.24Å; A501-F505 WeakPolarHBondContact O-CB 3.34Å; A501-F505 PolarHBondContact O-N 2.81Å; V502-F505 PolarHBondContact O-N 3.13Å; Q503-F505 VanDerWaalsContact C-N 3.35Å; Q503-F505 PolarHBondContact O-N 3.04Å; F505-E507 PolarHBondContact O-N 2.73Å; F505-R508 PolarHBondContact O-N 3.08Å; F505-C509 WeakPolarHBondContact CE2-SG 3.45Å; F505-C509 WeakPolarHBondContact CZ-SG 3.24Å; F505-C509 WeakPolarHBondContact O-CB 3.31Å; F505-C509 PolarHBondContact O-N 3.31Å; F505-C509 PolarHBondContact O-SG 2.98Å; F505-F528 HydrophobicContact CE1-CD1 4.35Å; F505-F528 HydrophobicContact CE1-CE1 4.29Å; F505-F528 HydrophobicContact CE2-CD1 4.27Å; F505-F528 AromaticContact CE2-CE1 3.87Å; F505-F528 HydrophobicContact CE2-CE1 3.87Å; F505-F528 AromaticContact CZ-CD1 3.62Å; F505-F528 HydrophobicContact CZ-CD1 3.62Å; F505-F528 AromaticContact CZ-CE1 3.58Å; F505-F528 HydrophobicContact CZ-CE1 3.58Å; F505-L560 HydrophobicContact CE1-CD2 4.43Å; F505-L563 HydrophobicContact CD1-CD2 4.11Å; F505-L563 HydrophobicContact CE1-CD2 3.73Å
506	A	90.1	Very high	82.6	Confident	12 Å²	12	63.6 Å²	63.6	10%	0.099	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-41.7	178.7	0	0	0	0	0	112.6	V502 Q503 Q504 C509 Q510 V559 L563	V502-A506 WeakPolarHBondContact O-CB 3.42Å; V502-A506 PolarHBondContact O-N 2.82Å; Q503-A506 PolarHBondContact O-N 3.31Å; Q504-A506 VanDerWaalsContact C-N 3.32Å; Q504-A506 PolarHBondContact O-N 3.45Å; A506-C509 PolarHBondContact O-N 3.34Å; A506-Q510 WeakPolarHBondContact O-CG 3.45Å; A506-Q510 PolarHBondContact O-N 3.04Å; A506-V559 HydrophobicContact CB-CG1 3.64Å; A506-L563 HydrophobicContact CB-CD2 4.13Å
507	E	88.8	Confident	81.3	Confident	127 Å²	127	62.6 Å²	62.6	59%	0.593	32%	0.316	S	S	*	.	H	α-helix	trans	-62.5	-47.5	174.8	-72	174.8	-178.2	0	0	112.2	Q503 Q504 F505 C509 Q510	Q503-E507 WeakPolarHBondContact O-CG 3.49Å; Q503-E507 PolarHBondContact O-N 2.86Å; Q504-E507 PolarHBondContact O-N 2.71Å; F505-E507 PolarHBondContact O-N 2.73Å; E507-C509 VanDerWaalsContact C-N 3.32Å; E507-C509 PolarHBondContact O-N 2.83Å; E507-Q510 WeakPolarHBondContact O-CB 3.21Å; E507-Q510 PolarHBondContact O-N 3.47Å
508	R	85.4	Confident	80.2	Confident	102 Å²	102	63.9 Å²	63.9	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-41.4	177.8	-69.3	175.2	-156.6	-164	4.8	111.8	E417 Q504 F505 Q510	E417-R508 VanDerWaalsContact CG-NH1 3.3Å; E417-R508 IonicContact OE1-CZ 3.69Å; E417-R508 VanDerWaalsContact OE1-CZ 3.26Å; E417-R508 IonicContact OE1-NH1 3.67Å; E417-R508 PolarHBondContact OE1-NH1 2.89Å; E417-R508 IonicContact OE1-NH2 2.74Å; E417-R508 PolarHBondContact OE1-NH2 3.39Å; Q504-R508 VanDerWaalsContact O-CG 3.28Å; Q504-R508 WeakPolarHBondContact O-CG 3.26Å; Q504-R508 PolarHBondContact O-N 3.47Å; F505-R508 PolarHBondContact O-N 3.08Å; R508-Q510 PolarHBondContact O-N 2.87Å
509	C	85.6	Confident	79.6	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-71.4	-11.8	-178.6	-71	0	0	0	0	113.6	F505 A506 E507 H511 V512 L563 K567	F505-C509 WeakPolarHBondContact CE2-SG 3.45Å; F505-C509 WeakPolarHBondContact CZ-SG 3.24Å; F505-C509 WeakPolarHBondContact O-CB 3.31Å; F505-C509 PolarHBondContact O-N 3.31Å; F505-C509 PolarHBondContact O-SG 2.98Å; A506-C509 PolarHBondContact O-N 3.34Å; E507-C509 VanDerWaalsContact C-N 3.32Å; E507-C509 PolarHBondContact O-N 2.83Å; C509-H511 PolarHBondContact O-N 2.89Å; C509-V512 HydrophobicContact CB-CG2 4.43Å; C509-V512 WeakPolarHBondContact O-CB 3.46Å; C509-V512 PolarHBondContact O-N 3.29Å; C509-V512 VanDerWaalsContact O-N 3.13Å; C509-L563 HydrophobicContact CB-CD1 4.16Å; C509-L563 HydrophobicContact CB-CD2 4.04Å; C509-K567 WeakPolarHBondContact O-CE 3.48Å; C509-K567 PolarHBondContact O-NZ 3.45Å
510	Q	82.2	Confident	79.2	Confident	104 Å²	104	65.3 Å²	65.3	49%	0.486	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-34.3	177.9	-68.1	-176.4	3.2	0	0	112.4	A506 E507 R508 K567	A506-Q510 WeakPolarHBondContact O-CG 3.45Å; A506-Q510 PolarHBondContact O-N 3.04Å; E507-Q510 WeakPolarHBondContact O-CB 3.21Å; E507-Q510 PolarHBondContact O-N 3.47Å; R508-Q510 PolarHBondContact O-N 2.87Å; Q510-K567 PolarHBondContact O-NZ 3.47Å
511	H	75.4	Confident	79	Confident	148 Å²	148	63.4 Å²	63.4	69%	0.685	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-7.3	-179.1	-58.7	-53	0	0	0	114.9	C509 G513 S514	C509-H511 PolarHBondContact O-N 2.89Å; H511-G513 PolarHBondContact O-N 2.98Å; H511-S514 PolarHBondContact O-N 3.45Å; H511-S514 PolarHBondContact O-OG 3.46Å
512	V	74.7	Confident	78.8	Confident	15 Å²	15	63.3 Å²	63.3	9%	0.091	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	128.5	179.7	174.2	0	0	0	0	109.4	F422 C509 A521 K567	F422-V512 HydrophobicContact CB-CG1 4.12Å; F422-V512 HydrophobicContact CD2-CG1 4.25Å; C509-V512 HydrophobicContact CB-CG2 4.43Å; C509-V512 WeakPolarHBondContact O-CB 3.46Å; C509-V512 PolarHBondContact O-N 3.29Å; C509-V512 VanDerWaalsContact O-N 3.13Å; V512-A521 HydrophobicContact CG1-CB 4.03Å; V512-K567 PolarHBondContact O-NZ 3.21Å
513	G	64.6	Low	78.6	Confident	13 Å²	13	63.3 Å²	63.3	13%	0.134	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	4.7	178.8	0	0	0	0	0	116	H511 Q515 N518	H511-G513 PolarHBondContact O-N 2.98Å; G513-Q515 VanDerWaalsContact C-N 3.27Å; G513-Q515 PolarHBondContact O-N 2.96Å; G513-N518 WeakPolarHBondContact CA-O 3.44Å
514	S	64.2	Low	78.5	Confident	78 Å²	78	58.9 Å²	58.9	55%	0.545	29%	0.293	S	S	.	.			trans	-71.4	-18.1	177.8	-54.6	0	0	0	0	113.9	H511	H511-S514 PolarHBondContact O-N 3.45Å; H511-S514 PolarHBondContact O-OG 3.46Å
515	Q	64.6	Low	78.4	Confident	153 Å²	153	55.6 Å²	55.6	72%	0.715	28%	0.278	S	S	*	.	S	Bend	trans	-79.9	135.7	178	-61.1	-170.7	10.3	0	0	111.1	G513 G517 N518	G513-Q515 VanDerWaalsContact C-N 3.27Å; G513-Q515 PolarHBondContact O-N 2.96Å; Q515-G517 PolarHBondContact O-N 3.13Å; Q515-N518 PolarHBondContact O-N 3.35Å; Q515-N518 VanDerWaalsContact O-N 3.16Å
516	R	54.9	Low	78.4	Confident	264 Å²	264	55.4 Å²	55.4	100%	0.996	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	92.5	174.8	-73.5	-175.2	179.2	179.9	-0.4	109.8
517	G	59.5	Low	78.4	Confident	52 Å²	52	54.9 Å²	54.9	54%	0.536	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	151.8	-33.8	-177.8	0	0	0	0	0	113.2	Q515	Q515-G517 PolarHBondContact O-N 3.13Å
518	N	66.8	Low	78.5	Confident	38 Å²	38	48.8 Å²	48.8	20%	0.203	24%	0.244	C	C	.	.			trans	-103.7	35.5	-175.9	-76.1	7.3	0	0	0	113	D423 G513 Q515 T520 A521	D423-N518 PolarHBondContact OD1-ND2 2.99Å; G513-N518 WeakPolarHBondContact CA-O 3.44Å; Q515-N518 PolarHBondContact O-N 3.35Å; Q515-N518 VanDerWaalsContact O-N 3.16Å; N518-T520 PolarHBondContact O-N 2.75Å; N518-A521 HydrophobicContact CB-CB 4.09Å; N518-A521 WeakPolarHBondContact O-CB 3.09Å; N518-A521 PolarHBondContact O-N 3.48Å
519	V	78	Confident	78.9	Confident	38 Å²	38	44 Å²	44	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-26.7	176.6	-161.2	0	0	0	0	111	A522 V523 W571 A574	V519-A522 PolarHBondContact O-N 3.1Å; V519-V523 PolarHBondContact O-N 3.35Å; V519-W571 HydrophobicContact CG1-CB 3.94Å; V519-W571 HydrophobicContact CG1-CG 4.07Å; V519-A574 HydrophobicContact CB-CB 4.39Å; V519-A574 HydrophobicContact CG1-CB 3.59Å; V519-A574 HydrophobicContact CG2-CB 3.79Å
520	T	81.8	Confident	79.2	Confident	16 Å²	16	45 Å²	45	10%	0.098	23%	0.231	C	C	.	.	H	α-helix	trans	-60.7	-41.2	170.6	48.1	0	0	0	0	112.6	N427 L429 N518 A522 V523 H524	N427-T520 HydrophobicContact CB-CG2 4.35Å; N427-T520 PolarHBondContact OD1-OG1 2.9Å; L429-T520 HydrophobicContact CB-CG2 3.88Å; L429-T520 HydrophobicContact CD1-CG2 4.11Å; L429-T520 HydrophobicContact CD2-CG2 4.22Å; L429-T520 HydrophobicContact CG-CG2 4.3Å; N518-T520 PolarHBondContact O-N 2.75Å; T520-A522 VanDerWaalsContact C-N 3.29Å; T520-A522 PolarHBondContact O-N 2.89Å; T520-V523 WeakPolarHBondContact O-CA 3.49Å; T520-V523 WeakPolarHBondContact O-CB 3.38Å; T520-V523 PolarHBondContact O-N 3.05Å; T520-H524 VanDerWaalsContact O-CG 3.31Å; T520-H524 PolarHBondContact O-N 2.97Å; T520-H524 PolarHBondContact O-ND1 3.23Å
521	A	85.5	Confident	79.5	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-35.7	178.7	0	0	0	0	0	112	F422 V512 N518 V523 H524 C525	F422-A521 HydrophobicContact CB-CB 4.3Å; V512-A521 HydrophobicContact CG1-CB 4.03Å; N518-A521 HydrophobicContact CB-CB 4.09Å; N518-A521 WeakPolarHBondContact O-CB 3.09Å; N518-A521 PolarHBondContact O-N 3.48Å; A521-V523 VanDerWaalsContact C-N 3.34Å; A521-V523 PolarHBondContact O-N 3.39Å; A521-H524 PolarHBondContact O-N 3.42Å; A521-C525 WeakPolarHBondContact O-CB 3.48Å; A521-C525 PolarHBondContact O-N 3.19Å
522	A	87.8	Confident	80.3	Confident	1 Å²	1	33 Å²	33	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-42	172.8	0	0	0	0	0	111.4	V519 T520 C525 A526 K567	V519-A522 PolarHBondContact O-N 3.1Å; T520-A522 VanDerWaalsContact C-N 3.29Å; T520-A522 PolarHBondContact O-N 2.89Å; A522-C525 PolarHBondContact O-N 3.31Å; A522-A526 PolarHBondContact O-N 2.93Å; A522-K567 HydrophobicContact CB-CB 4.37Å; A522-K567 HydrophobicContact CB-CD 4.11Å; A522-K567 WeakPolarHBondContact O-CB 3.28Å
523	V	88.2	Confident	81	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-47.2	174.4	174.8	0	0	0	0	110.8	L429 V519 T520 A521 C525 A526 K527 Y568 W571 V645	L429-V523 HydrophobicContact CD1-CB 4.48Å; L429-V523 HydrophobicContact CD1-CG1 4.32Å; V519-V523 PolarHBondContact O-N 3.35Å; T520-V523 WeakPolarHBondContact O-CA 3.49Å; T520-V523 WeakPolarHBondContact O-CB 3.38Å; T520-V523 PolarHBondContact O-N 3.05Å; A521-V523 VanDerWaalsContact C-N 3.34Å; A521-V523 PolarHBondContact O-N 3.39Å; V523-C525 VanDerWaalsContact C-N 3.3Å; V523-C525 PolarHBondContact O-N 3.38Å; V523-A526 PolarHBondContact O-N 2.82Å; V523-A526 VanDerWaalsContact O-N 3.15Å; V523-K527 HydrophobicContact CG1-CG 4.19Å; V523-K527 VanDerWaalsContact O-CG 3.26Å; V523-K527 WeakPolarHBondContact O-CG 3.45Å; V523-K527 PolarHBondContact O-N 3.34Å; V523-Y568 HydrophobicContact CG1-CE1 4.45Å; V523-W571 HydrophobicContact CG2-CB 4.02Å; V523-W571 VanDerWaalsContact CG2-CD1 3.44Å; V523-W571 HydrophobicContact CG2-CD2 4.14Å; V523-W571 HydrophobicContact CG2-CG 3.6Å; V523-V645 HydrophobicContact CG1-CB 4.37Å; V523-V645 HydrophobicContact CG1-CG1 3.63Å; V523-V645 HydrophobicContact CG1-CG2 4.12Å; V523-V645 HydrophobicContact CG2-CG1 4.24Å; V523-V645 HydrophobicContact CG2-CG2 3.99Å
524	H	87.9	Confident	82.1	Confident	3 Å²	3	36.6 Å²	36.6	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-59.1	-40.9	178.3	-62.2	157.1	0	0	0	112.2	F422 I425 V458 T520 A521 K527 F528	F422-H524 HydrophobicContact CD1-CB 4.26Å; I425-H524 HydrophobicContact CD1-CB 4.13Å; I425-H524 WeakPolarHBondContact CG2-ND1 3.27Å; V458-H524 HydrophobicContact CG2-CB 3.84Å; T520-H524 VanDerWaalsContact O-CG 3.31Å; T520-H524 PolarHBondContact O-N 2.97Å; T520-H524 PolarHBondContact O-ND1 3.23Å; A521-H524 PolarHBondContact O-N 3.42Å; H524-K527 PolarHBondContact O-N 3Å; H524-F528 WeakPolarHBondContact O-CB 3.18Å; H524-F528 PolarHBondContact O-N 3.26Å
525	C	90	Very high	83.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62	-45.6	174.1	-176.6	0	0	0	0	111.9	F422 A521 A522 V523 K527 F528 C529 K567	F422-C525 HydrophobicContact CD2-CB 3.89Å; F422-C525 HydrophobicContact CE2-CB 4Å; F422-C525 HydrophobicContact CG-CB 4.19Å; F422-C525 HydrophobicContact CZ-CB 4.39Å; A521-C525 WeakPolarHBondContact O-CB 3.48Å; A521-C525 PolarHBondContact O-N 3.19Å; A522-C525 PolarHBondContact O-N 3.31Å; V523-C525 VanDerWaalsContact C-N 3.3Å; V523-C525 PolarHBondContact O-N 3.38Å; C525-K527 PolarHBondContact O-N 2.83Å; C525-F528 PolarHBondContact O-N 3.31Å; C525-C529 PolarHBondContact O-N 3.34Å; C525-C529 PolarHBondContact O-SG 2.99Å; C525-K567 HydrophobicContact CB-CG 4.41Å
526	A	91.1	Very high	84.2	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.8	-42.3	177.1	0	0	0	0	0	112	A522 V523 C529 Q530 K567 Y568	A522-A526 PolarHBondContact O-N 2.93Å; V523-A526 PolarHBondContact O-N 2.82Å; V523-A526 VanDerWaalsContact O-N 3.15Å; A526-C529 WeakPolarHBondContact O-CB 3.49Å; A526-C529 PolarHBondContact O-N 3.43Å; A526-Q530 WeakPolarHBondContact O-CG 3.33Å; A526-Q530 PolarHBondContact O-N 3.11Å; A526-Q530 VanDerWaalsContact O-N 3.1Å; A526-K567 HydrophobicContact CB-CB 4.05Å; A526-Y568 HydrophobicContact CB-CD1 4.19Å; A526-Y568 HydrophobicContact CB-CD2 3.91Å; A526-Y568 HydrophobicContact CB-CE1 3.9Å; A526-Y568 HydrophobicContact CB-CE2 3.64Å; A526-Y568 HydrophobicContact CB-CG 4.16Å
527	K	89.7	Confident	85.7	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.9	-46.8	175.2	-67.2	-65.2	-177.1	179.9	0	111.4	L452 M454 V458 V523 H524 C525 C529 Q530 G531 Y568 V645 S649	L452-K527 WeakPolarHBondContact O-CD 3.26Å; L452-K527 WeakPolarHBondContact O-CE 3.16Å; L452-K527 PolarHBondContact O-NZ 3.39Å; M454-K527 HydrophobicContact CG-CB 4.39Å; M454-K527 VanDerWaalsContact SD-C 3.6Å; M454-K527 HydrophobicContact SD-CB 3.92Å; V458-K527 HydrophobicContact CG1-CB 4.23Å; V523-K527 HydrophobicContact CG1-CG 4.19Å; V523-K527 VanDerWaalsContact O-CG 3.26Å; V523-K527 WeakPolarHBondContact O-CG 3.45Å; V523-K527 PolarHBondContact O-N 3.34Å; H524-K527 PolarHBondContact O-N 3Å; C525-K527 PolarHBondContact O-N 2.83Å; K527-C529 VanDerWaalsContact C-N 3.29Å; K527-C529 PolarHBondContact O-N 3.3Å; K527-Q530 CarbonylContact O-C 3.49Å; K527-Q530 WeakPolarHBondContact O-CB 3.27Å; K527-Q530 PolarHBondContact O-N 2.85Å; K527-Q530 VanDerWaalsContact O-N 3.1Å; K527-G531 PolarHBondContact O-N 3.35Å; K527-Y568 WeakPolarHBondContact CD-OH 3.31Å; K527-Y568 VanDerWaalsContact CE-OH 3.31Å; K527-Y568 WeakPolarHBondContact CE-OH 3.29Å; K527-V645 WeakPolarHBondContact CE-O 3.4Å; K527-V645 PolarHBondContact NZ-O 2.88Å; K527-S649 PolarHBondContact NZ-OG 3.4Å
528	F	91.5	Very high	87.1	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-56.3	-43.8	176.1	178.2	-100.4	0	0	0	111.7	A419 F422 V458 K461 C462 V465 F505 H524 C525 Q530 G531 L532	A419-F528 HydrophobicContact CB-CE1 4.35Å; A419-F528 HydrophobicContact CB-CE2 4.23Å; A419-F528 HydrophobicContact CB-CZ 3.66Å; F422-F528 HydrophobicContact CE1-CB 3.62Å; F422-F528 HydrophobicContact CE1-CD1 4.13Å; F422-F528 HydrophobicContact CE1-CD2 4.29Å; F422-F528 AromaticContact CE1-CG 3.76Å; F422-F528 HydrophobicContact CE1-CG 3.76Å; F422-F528 HydrophobicContact CZ-CB 3.88Å; F422-F528 AromaticContact CZ-CD1 3.61Å; F422-F528 HydrophobicContact CZ-CD1 3.61Å; F422-F528 HydrophobicContact CZ-CD2 4.5Å; F422-F528 HydrophobicContact CZ-CE1 4.23Å; F422-F528 AromaticContact CZ-CG 3.74Å; F422-F528 HydrophobicContact CZ-CG 3.74Å; V458-F528 HydrophobicContact CG1-CB 3.83Å; V458-F528 HydrophobicContact CG1-CD2 4.39Å; K461-F528 HydrophobicContact CB-CD2 4.1Å; K461-F528 HydrophobicContact CB-CE2 3.92Å; C462-F528 WeakPolarHBondContact SG-CD2 3.2Å; V465-F528 HydrophobicContact CG2-CE2 4.36Å; V465-F528 HydrophobicContact CG2-CZ 4.05Å; F505-F528 HydrophobicContact CE1-CD1 4.35Å; F505-F528 HydrophobicContact CE1-CE1 4.29Å; F505-F528 HydrophobicContact CE2-CD1 4.27Å; F505-F528 AromaticContact CE2-CE1 3.87Å; F505-F528 HydrophobicContact CE2-CE1 3.87Å; F505-F528 AromaticContact CZ-CD1 3.62Å; F505-F528 HydrophobicContact CZ-CD1 3.62Å; F505-F528 AromaticContact CZ-CE1 3.58Å; F505-F528 HydrophobicContact CZ-CE1 3.58Å; H524-F528 WeakPolarHBondContact O-CB 3.18Å; H524-F528 PolarHBondContact O-N 3.26Å; C525-F528 PolarHBondContact O-N 3.31Å; F528-Q530 VanDerWaalsContact C-N 3.35Å; F528-Q530 PolarHBondContact O-N 2.88Å; F528-G531 PolarHBondContact O-N 3.46Å; F528-L532 HydrophobicContact CD1-CD1 4.04Å; F528-L532 HydrophobicContact CD1-CG 4.29Å; F528-L532 HydrophobicContact CE1-CD1 3.44Å; F528-L532 VanDerWaalsContact CE1-CD1 3.44Å; F528-L532 HydrophobicContact CE1-CD2 4.36Å; F528-L532 HydrophobicContact CE1-CG 3.89Å; F528-L532 HydrophobicContact CE2-CD2 4.21Å; F528-L532 HydrophobicContact CE2-CG 4.32Å; F528-L532 HydrophobicContact CZ-CD1 3.8Å; F528-L532 HydrophobicContact CZ-CD2 3.87Å; F528-L532 HydrophobicContact CZ-CG 3.89Å; F528-L532 WeakPolarHBondContact O-CG 3.33Å; F528-L532 PolarHBondContact O-N 2.95Å
529	C	93.3	Very high	88.2	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.7	-42.3	175.9	-64.5	0	0	0	0	112.6	C525 A526 K527 L533 L560	C525-C529 PolarHBondContact O-N 3.34Å; C525-C529 PolarHBondContact O-SG 2.99Å; A526-C529 WeakPolarHBondContact O-CB 3.49Å; A526-C529 PolarHBondContact O-N 3.43Å; K527-C529 VanDerWaalsContact C-N 3.29Å; K527-C529 PolarHBondContact O-N 3.3Å; C529-L533 WeakPolarHBondContact O-CG 3.21Å; C529-L560 HydrophobicContact CB-CB 4.35Å; C529-L560 HydrophobicContact CB-CD2 4.32Å
530	Q	91.7	Very high	88.6	Confident	22 Å²	22	18.9 Å²	18.9	10%	0.103	10%	0.098	C	C	.	.	H	α-helix	trans	-66.1	-41.4	174.4	-67.6	-179.9	-28.9	0	0	111.3	L452 A526 K527 F528 L533 T534 Y568 S649	L452-Q530 HydrophobicContact CD1-CB 3.9Å; L452-Q530 HydrophobicContact CD2-CB 4.06Å; A526-Q530 WeakPolarHBondContact O-CG 3.33Å; A526-Q530 PolarHBondContact O-N 3.11Å; A526-Q530 VanDerWaalsContact O-N 3.1Å; K527-Q530 CarbonylContact O-C 3.49Å; K527-Q530 WeakPolarHBondContact O-CB 3.27Å; K527-Q530 PolarHBondContact O-N 2.85Å; K527-Q530 VanDerWaalsContact O-N 3.1Å; F528-Q530 VanDerWaalsContact C-N 3.35Å; F528-Q530 PolarHBondContact O-N 2.88Å; Q530-L533 WeakPolarHBondContact O-CB 3.31Å; Q530-L533 PolarHBondContact O-N 2.82Å; Q530-L533 VanDerWaalsContact O-N 3.09Å; Q530-T534 PolarHBondContact O-N 3.48Å; Q530-T534 VanDerWaalsContact O-N 3.14Å; Q530-T534 PolarHBondContact O-OG1 3.4Å; Q530-Y568 PolarHBondContact OE1-OH 3.2Å; Q530-S649 PolarHBondContact NE2-O 2.88Å; Q530-S649 VanDerWaalsContact NE2-O 3.11Å
531	G	88.9	Confident	88.8	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61	-42.4	177.6	0	0	0	0	0	113	K527 F528 L533 T534 C535	K527-G531 PolarHBondContact O-N 3.35Å; F528-G531 PolarHBondContact O-N 3.46Å; G531-L533 PolarHBondContact O-N 3.36Å; G531-T534 PolarHBondContact O-N 3.2Å; G531-C535 WeakPolarHBondContact O-CA 3.3Å; G531-C535 VanDerWaalsContact O-CB 3.31Å; G531-C535 WeakPolarHBondContact O-CB 3.39Å; G531-C535 PolarHBondContact O-N 3.12Å
532	L	91.3	Very high	88.7	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59.1	-32.2	173.5	-73.6	-177.8	0	0	0	112.7	F416 V465 F528 F539 L560	F416-L532 HydrophobicContact CE1-CD1 4.06Å; V465-L532 HydrophobicContact CB-CD2 4.17Å; V465-L532 HydrophobicContact CG1-CD2 3.88Å; V465-L532 HydrophobicContact CG2-CD2 4.43Å; F528-L532 HydrophobicContact CD1-CD1 4.04Å; F528-L532 HydrophobicContact CD1-CG 4.29Å; F528-L532 HydrophobicContact CE1-CD1 3.44Å; F528-L532 VanDerWaalsContact CE1-CD1 3.44Å; F528-L532 HydrophobicContact CE1-CD2 4.36Å; F528-L532 HydrophobicContact CE1-CG 3.89Å; F528-L532 HydrophobicContact CE2-CD2 4.21Å; F528-L532 HydrophobicContact CE2-CG 4.32Å; F528-L532 HydrophobicContact CZ-CD1 3.8Å; F528-L532 HydrophobicContact CZ-CD2 3.87Å; F528-L532 HydrophobicContact CZ-CG 3.89Å; F528-L532 WeakPolarHBondContact O-CG 3.33Å; F528-L532 PolarHBondContact O-N 2.95Å; L532-F539 WeakPolarHBondContact O-CD1 3.49Å; L532-L560 HydrophobicContact CB-CD1 4.23Å; L532-L560 HydrophobicContact CD1-CD1 4.32Å; L532-L560 HydrophobicContact CD1-CD2 4.38Å
533	L	90.5	Very high	88.4	Confident	33 Å²	33	19.8 Å²	19.8	17%	0.173	11%	0.105	C	C	.	.	H	α-helix	trans	-82.2	-25.6	-179.2	-66.7	175.6	0	0	0	113.4	C529 Q530 G531 W553 T557 L560	C529-L533 WeakPolarHBondContact O-CG 3.21Å; Q530-L533 WeakPolarHBondContact O-CB 3.31Å; Q530-L533 PolarHBondContact O-N 2.82Å; Q530-L533 VanDerWaalsContact O-N 3.09Å; G531-L533 PolarHBondContact O-N 3.36Å; L533-W553 HydrophobicContact CD2-CH2 3.93Å; L533-W553 HydrophobicContact CD2-CZ2 4.1Å; L533-T557 HydrophobicContact CD1-CG2 4.38Å; L533-T557 HydrophobicContact CD2-CG2 4.27Å; L533-L560 HydrophobicContact CD1-CB 4.19Å; L533-L560 HydrophobicContact CD2-CD1 3.86Å; L533-L560 HydrophobicContact CG-CB 4.44Å; L533-L560 HydrophobicContact CG-CD1 4.09Å
534	T	86.8	Confident	87.9	Confident	70 Å²	70	23.8 Å²	23.8	43%	0.429	12%	0.123	S	C	.	.	H	α-helix	trans	-113.8	-35.5	-173	59.7	0	0	0	0	114.9	L452 Q530 G531	L452-T534 HydrophobicContact CD1-CG2 4.3Å; L452-T534 WeakPolarHBondContact CD1-OG1 3.39Å; Q530-T534 PolarHBondContact O-N 3.48Å; Q530-T534 VanDerWaalsContact O-N 3.14Å; Q530-T534 PolarHBondContact O-OG1 3.4Å; G531-T534 PolarHBondContact O-N 3.2Å
535	C	85.3	Confident	86.5	Confident	10 Å²	10	26.6 Å²	26.6	7%	0.068	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-16.4	-171.3	-56.5	0	0	0	0	113.2	L445 A448 G531	L445-C535 HydrophobicContact CD1-CB 4.41Å; A448-C535 VanDerWaalsContact CB-SG 3.55Å; G531-C535 WeakPolarHBondContact O-CA 3.3Å; G531-C535 VanDerWaalsContact O-CB 3.31Å; G531-C535 WeakPolarHBondContact O-CB 3.39Å; G531-C535 PolarHBondContact O-N 3.12Å
536	C	87.6	Confident	84.9	Confident	3 Å²	3	33 Å²	33	2%	0.02	16%	0.164	C	C	.	.			trans	-105.7	82.6	-173.1	-56.9	0	0	0	0	111.1	C462 D466 F539 K540	C462-C536 PolarHBondContact O-SG 3.22Å; C462-C536 VanDerWaalsContact O-SG 3.33Å; D466-C536 HydrophobicContact CB-CB 3.94Å; D466-C536 WeakPolarHBondContact OD1-CA 3.21Å; D466-C536 WeakPolarHBondContact OD1-CB 3.48Å; C536-F539 HydrophobicContact CB-CB 3.65Å; C536-F539 HydrophobicContact CB-CD1 4.5Å; C536-F539 HydrophobicContact CB-CG 4.45Å; C536-K540 PolarHBondContact O-N 3.08Å; C536-K540 VanDerWaalsContact O-N 3.11Å
537	D	86.9	Confident	83.3	Confident	88 Å²	88	34.3 Å²	34.3	47%	0.471	17%	0.173	S	C	.	.	H	α-helix	trans	-70.5	-34.7	-178.4	-73.8	-39.9	0	0	0	112.9	D466 K540 S541	D466-D537 PolarHBondContact OD1-N 3.3Å; D537-K540 PolarHBondContact O-N 3.44Å; D537-S541 VanDerWaalsContact O-CB 3.28Å; D537-S541 WeakPolarHBondContact O-CB 3.37Å; D537-S541 PolarHBondContact O-N 2.76Å
538	H	88.2	Confident	82.1	Confident	64 Å²	64	43.1 Å²	43.1	30%	0.296	21%	0.211	S	C	.	.	H	α-helix	trans	-69.6	-42.4	177.7	-56.3	93	0	0	0	110.1	D466 K470 L473 K540 S541 A542	D466-H538 WeakPolarHBondContact OD1-CA 3.44Å; D466-H538 VanDerWaalsContact OD1-CB 3.29Å; D466-H538 WeakPolarHBondContact OD1-CB 3.29Å; D466-H538 IonicContact OD1-CG 3.93Å; D466-H538 PolarHBondContact OD1-N 3.14Å; D466-H538 IonicContact OD1-ND1 2.64Å; D466-H538 IonicContact OD2-CE1 3.25Å; D466-H538 IonicContact OD2-CG 3.4Å; D466-H538 IonicContact OD2-ND1 2.74Å; D466-H538 PolarHBondContact OD2-ND1 2.93Å; K470-H538 HydrophobicContact CB-CB 4.25Å; L473-H538 HydrophobicContact CD1-CB 4.11Å; L473-H538 WeakPolarHBondContact CD1-O 3.35Å; H538-K540 VanDerWaalsContact C-N 3.29Å; H538-K540 PolarHBondContact O-N 3.48Å; H538-S541 WeakPolarHBondContact CA-OG 3.43Å; H538-S541 PolarHBondContact O-N 3.05Å; H538-S541 VanDerWaalsContact O-N 3.09Å; H538-S541 PolarHBondContact O-OG 2.66Å; H538-A542 PolarHBondContact O-N 3.18Å
539	F	89.6	Confident	81.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-53.6	-47	170.8	173	-110.3	0	0	0	111.8	F416 D466 Y469 V502 L532 C536 A542 F543 W553 I556	F416-F539 HydrophobicContact CZ-CE2 4.03Å; D466-F539 PolarHBondContact OD1-N 3.47Å; Y469-F539 HydrophobicContact CD1-CD2 4.36Å; Y469-F539 HydrophobicContact CD2-CB 4.18Å; Y469-F539 AromaticContact CD2-CD2 3.87Å; Y469-F539 HydrophobicContact CD2-CD2 3.87Å; Y469-F539 HydrophobicContact CE1-CD2 4.03Å; Y469-F539 AromaticContact CE2-CD2 3.52Å; Y469-F539 HydrophobicContact CE2-CD2 3.52Å; Y469-F539 HydrophobicContact CE2-CE2 4.14Å; Y469-F539 HydrophobicContact CG-CB 4.27Å; Y469-F539 HydrophobicContact CG-CD2 4.29Å; Y469-F539 AromaticContact CZ-CD2 3.59Å; Y469-F539 AromaticContact CZ-CE2 3.96Å; V502-F539 HydrophobicContact CG2-CZ 4.34Å; L532-F539 WeakPolarHBondContact O-CD1 3.49Å; C536-F539 HydrophobicContact CB-CB 3.65Å; C536-F539 HydrophobicContact CB-CD1 4.5Å; C536-F539 HydrophobicContact CB-CG 4.45Å; F539-A542 WeakPolarHBondContact O-CB 3.22Å; F539-A542 PolarHBondContact O-N 3.08Å; F539-F543 HydrophobicContact CE1-CE2 4.5Å; F539-F543 HydrophobicContact CE2-CE2 4.18Å; F539-F543 HydrophobicContact CE2-CZ 4.5Å; F539-F543 HydrophobicContact CZ-CE2 4.17Å; F539-F543 WeakPolarHBondContact O-CD2 3.25Å; F539-F543 VanDerWaalsContact O-CE2 3.31Å; F539-F543 WeakPolarHBondContact O-CE2 3.12Å; F539-W553 HydrophobicContact CD1-CH2 4.45Å; F539-W553 HydrophobicContact CD1-CZ3 4.09Å; F539-W553 HydrophobicContact CE1-CH2 4.31Å; F539-W553 AromaticContact CE1-CZ3 3.78Å; F539-W553 HydrophobicContact CE1-CZ3 3.78Å; F539-I556 HydrophobicContact CE1-CG2 4.32Å; F539-I556 HydrophobicContact CZ-CG2 4.01Å
540	K	88.1	Confident	80.8	Confident	87 Å²	87	48.9 Å²	48.9	38%	0.378	24%	0.243	S	C	.	.	H	α-helix	trans	-64.5	-41.9	175.8	-178.1	178.7	175.4	-173.4	0	111.9	C536 D537 H538 A542 F543 F544 W553	C536-K540 PolarHBondContact O-N 3.08Å; C536-K540 VanDerWaalsContact O-N 3.11Å; D537-K540 PolarHBondContact O-N 3.44Å; H538-K540 VanDerWaalsContact C-N 3.29Å; H538-K540 PolarHBondContact O-N 3.48Å; K540-A542 PolarHBondContact O-N 2.9Å; K540-F543 PolarHBondContact O-N 3.2Å; K540-F543 VanDerWaalsContact O-N 3.14Å; K540-F544 HydrophobicContact CG-CD2 4.09Å; K540-F544 HydrophobicContact CG-CE2 3.74Å; K540-F544 WeakPolarHBondContact O-CD2 3.07Å; K540-W553 HydrophobicContact CB-CH2 3.93Å; K540-W553 HydrophobicContact CB-CZ2 4.5Å; K540-W553 HydrophobicContact CB-CZ3 4.17Å; K540-W553 HydrophobicContact CD-CH2 4.37Å; K540-W553 HydrophobicContact CD-CZ2 4.17Å; K540-W553 HydrophobicContact CG-CH2 3.85Å; K540-W553 HydrophobicContact CG-CZ2 3.93Å; K540-W553 HydrophobicContact CG-CZ3 4.2Å
541	S	84.8	Confident	80.5	Confident	29 Å²	29	51.4 Å²	51.4	20%	0.203	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-26.7	-178	79.3	0	0	0	0	112.8	L473 D537 H538 F543 F544 V545	L473-S541 WeakPolarHBondContact CD1-OG 3.5Å; D537-S541 VanDerWaalsContact O-CB 3.28Å; D537-S541 WeakPolarHBondContact O-CB 3.37Å; D537-S541 PolarHBondContact O-N 2.76Å; H538-S541 WeakPolarHBondContact CA-OG 3.43Å; H538-S541 PolarHBondContact O-N 3.05Å; H538-S541 VanDerWaalsContact O-N 3.09Å; H538-S541 PolarHBondContact O-OG 2.66Å; S541-F543 PolarHBondContact O-N 2.91Å; S541-F544 PolarHBondContact O-N 2.92Å; S541-V545 WeakPolarHBondContact O-CB 3.49Å; S541-V545 WeakPolarHBondContact O-CG2 3.07Å; S541-V545 PolarHBondContact O-N 3.41Å
542	A	83	Confident	80.3	Confident	7 Å²	7	51.9 Å²	51.9	6%	0.058	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-23.7	173.1	0	0	0	0	0	113.8	Y469 L494 V495 H538 F539 K540	Y469-A542 HydrophobicContact CD1-CB 3.97Å; Y469-A542 HydrophobicContact CE1-CB 4.19Å; L494-A542 HydrophobicContact CD2-CB 4.07Å; V495-A542 WeakPolarHBondContact CG2-O 3.24Å; H538-A542 PolarHBondContact O-N 3.18Å; F539-A542 WeakPolarHBondContact O-CB 3.22Å; F539-A542 PolarHBondContact O-N 3.08Å; K540-A542 PolarHBondContact O-N 2.9Å
543	F	82.5	Confident	80.3	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-9.4	177.7	-59.6	-82.1	0	0	0	114.8	V495 T498 V499 F539 K540 S541 S547 H549 A552 W553 I556	V495-F543 HydrophobicContact CG1-CD1 4.02Å; V495-F543 HydrophobicContact CG1-CE1 4.05Å; V495-F543 HydrophobicContact CG2-CD1 4.34Å; T498-F543 HydrophobicContact CG2-CZ 4.4Å; T498-F543 WeakPolarHBondContact OG1-CE1 3.46Å; T498-F543 WeakPolarHBondContact OG1-CZ 3.4Å; V499-F543 HydrophobicContact CG2-CE1 4.49Å; F539-F543 HydrophobicContact CE1-CE2 4.5Å; F539-F543 HydrophobicContact CE2-CE2 4.18Å; F539-F543 HydrophobicContact CE2-CZ 4.5Å; F539-F543 HydrophobicContact CZ-CE2 4.17Å; F539-F543 WeakPolarHBondContact O-CD2 3.25Å; F539-F543 VanDerWaalsContact O-CE2 3.31Å; F539-F543 WeakPolarHBondContact O-CE2 3.12Å; K540-F543 PolarHBondContact O-N 3.2Å; K540-F543 VanDerWaalsContact O-N 3.14Å; S541-F543 PolarHBondContact O-N 2.91Å; F543-S547 CarbonylContact C-O 3.54Å; F543-H549 PolarHBondContact O-N 3.31Å; F543-A552 HydrophobicContact CD1-CB 4.13Å; F543-A552 HydrophobicContact CE1-CB 4.37Å; F543-W553 HydrophobicContact CB-CB 4.18Å; F543-W553 HydrophobicContact CD2-CD2 4.48Å; F543-W553 AromaticContact CD2-CE3 3.44Å; F543-W553 HydrophobicContact CD2-CE3 3.44Å; F543-W553 VanDerWaalsContact CD2-CE3 3.44Å; F543-W553 AromaticContact CD2-CZ3 3.91Å; F543-W553 HydrophobicContact CD2-CZ3 3.91Å; F543-W553 AromaticContact CE2-CE3 3.8Å; F543-W553 HydrophobicContact CE2-CE3 3.8Å; F543-W553 HydrophobicContact CE2-CZ3 4.02Å; F543-W553 HydrophobicContact CG-CB 4.25Å; F543-W553 AromaticContact CG-CE3 3.99Å; F543-W553 HydrophobicContact CG-CE3 3.99Å; F543-I556 HydrophobicContact CD1-CD1 4.47Å; F543-I556 HydrophobicContact CE1-CD1 3.33Å; F543-I556 HydrophobicContact CE2-CD1 4.07Å; F543-I556 HydrophobicContact CZ-CD1 3.08Å
544	F	76.7	Confident	80.2	Confident	84 Å²	84	57.3 Å²	57.3	37%	0.368	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-24.7	-171.4	-64.9	-71.1	0	0	0	114.3	K540 S541 R546 T550 W553	K540-F544 HydrophobicContact CG-CD2 4.09Å; K540-F544 HydrophobicContact CG-CE2 3.74Å; K540-F544 WeakPolarHBondContact O-CD2 3.07Å; S541-F544 PolarHBondContact O-N 2.92Å; F544-R546 VanDerWaalsContact C-N 3.26Å; F544-R546 PolarHBondContact O-N 3.38Å; F544-T550 HydrophobicContact CE1-CG2 4.31Å; F544-W553 HydrophobicContact CE2-CD2 4.46Å; F544-W553 HydrophobicContact CE2-CG 4.32Å; F544-W553 HydrophobicContact CZ-CB 4.44Å; F544-W553 HydrophobicContact CZ-CG 4.12Å
545	V	60	Low	80.4	Confident	61 Å²	61	60.1 Å²	60.1	37%	0.37	30%	0.296	S	S	.	.	S	Bend	trans	-57.6	-29.7	-161.5	161.1	0	0	0	0	113.9	S541	S541-V545 WeakPolarHBondContact O-CB 3.49Å; S541-V545 WeakPolarHBondContact O-CG2 3.07Å; S541-V545 PolarHBondContact O-N 3.41Å
546	R	55	Low	80.7	Confident	136 Å²	136	59.8 Å²	59.8	51%	0.513	29%	0.294	S	S	.	.	S	Bend	trans	-148	-13.3	164.1	-56.6	-177.2	-176.5	163.4	8	115.9	D477 C480 F544	D477-R546 IonicContact OD1-CZ 3.7Å; D477-R546 IonicContact OD1-NH2 3.9Å; D477-R546 PolarHBondContact OD1-NH2 3.41Å; C480-R546 PolarHBondContact SG-NH1 2.93Å; C480-R546 VanDerWaalsContact SG-NH1 3.37Å; F544-R546 VanDerWaalsContact C-N 3.26Å; F544-R546 PolarHBondContact O-N 3.38Å
547	S	57.8	Low	80.9	Confident	26 Å²	26	61.1 Å²	61.1	18%	0.182	30%	0.302	C	S	.	.	S	Bend	trans	-110.6	133.5	171.9	48.8	0	0	0	0	109.8	F543 H549	F543-S547 CarbonylContact C-O 3.54Å; S547-H549 WeakPolarHBondContact CB-CD2 3.46Å; S547-H549 VanDerWaalsContact CB-NE2 3.26Å; S547-H549 WeakPolarHBondContact CB-NE2 3.26Å; S547-H549 PolarHBondContact O-N 2.84Å; S547-H549 PolarHBondContact OG-CD2 3.16Å; S547-H549 PolarHBondContact OG-NE2 2.98Å
548	K	65.6	Low	81.3	Confident	185 Å²	185	60.4 Å²	60.4	80%	0.804	30%	0.301	S	S	*	.			trans	-82.3	62.2	178.1	-67.6	179.8	-179.2	176.5	0	110.4	T550	K548-T550 PolarHBondContact O-N 3.42Å
549	H	75.4	Confident	81.6	Confident	52 Å²	52	58.8 Å²	58.8	24%	0.241	30%	0.295	C	S	.	.			trans	-76.2	50.4	176.9	-64.3	-71.8	0	0	0	112.4	V495 F543 S547 S551 A552 W553	V495-H549 HydrophobicContact CG1-CB 4.19Å; F543-H549 PolarHBondContact O-N 3.31Å; S547-H549 WeakPolarHBondContact CB-CD2 3.46Å; S547-H549 VanDerWaalsContact CB-NE2 3.26Å; S547-H549 WeakPolarHBondContact CB-NE2 3.26Å; S547-H549 PolarHBondContact O-N 2.84Å; S547-H549 PolarHBondContact OG-CD2 3.16Å; S547-H549 PolarHBondContact OG-NE2 2.98Å; H549-S551 PolarHBondContact O-N 2.88Å; H549-A552 HydrophobicContact CB-CB 3.9Å; H549-A552 PolarHBondContact O-N 2.72Å; H549-W553 PolarHBondContact O-N 3.4Å
550	T	80.9	Confident	81.8	Confident	69 Å²	69	58.8 Å²	58.8	42%	0.423	30%	0.295	S	S	.	.	H	α-helix	trans	-52.3	-39.6	175.1	52.2	0	0	0	0	111.3	F544 K548 W553 H554	F544-T550 HydrophobicContact CE1-CG2 4.31Å; K548-T550 PolarHBondContact O-N 3.42Å; T550-W553 PolarHBondContact O-N 3.41Å; T550-H554 WeakPolarHBondContact O-CB 3.39Å; T550-H554 PolarHBondContact O-CD2 2.92Å; T550-H554 VanDerWaalsContact O-CG 3.28Å; T550-H554 PolarHBondContact O-N 2.94Å
551	S	85.2	Confident	82.1	Confident	75 Å²	75	57.8 Å²	57.8	52%	0.524	29%	0.294	S	S	.	.	H	α-helix	trans	-65.1	-38.8	176.7	62.6	0	0	0	0	113.3	H549 K555	H549-S551 PolarHBondContact O-N 2.88Å; S551-K555 VanDerWaalsContact O-CG 3.3Å; S551-K555 WeakPolarHBondContact O-CG 3.44Å; S551-K555 PolarHBondContact O-N 2.99Å
552	A	86.4	Confident	82.6	Confident	10 Å²	10	62 Å²	62	8%	0.083	31%	0.311	C	S	.	.	H	α-helix	trans	-69.1	-43.2	176.5	0	0	0	0	0	111.1	V495 V499 F543 H549 H554 K555 I556	V495-A552 HydrophobicContact CG1-CB 3.83Å; V499-A552 HydrophobicContact CG2-CB 4.04Å; F543-A552 HydrophobicContact CD1-CB 4.13Å; F543-A552 HydrophobicContact CE1-CB 4.37Å; H549-A552 HydrophobicContact CB-CB 3.9Å; H549-A552 PolarHBondContact O-N 2.72Å; A552-H554 VanDerWaalsContact C-N 3.35Å; A552-H554 PolarHBondContact O-N 2.63Å; A552-K555 WeakPolarHBondContact O-CB 3.39Å; A552-K555 PolarHBondContact O-N 3.27Å; A552-I556 PolarHBondContact O-N 3.08Å
553	W	90.2	Very high	83.1	Confident	29 Å²	29	62.2 Å²	62.2	11%	0.11	31%	0.311	C	S	.	.	H	α-helix	trans	-59.5	-44.3	173.8	178	-109.3	0	0	0	112.1	L533 F539 K540 F543 F544 H549 T550 K555 I556 T557	L533-W553 HydrophobicContact CD2-CH2 3.93Å; L533-W553 HydrophobicContact CD2-CZ2 4.1Å; F539-W553 HydrophobicContact CD1-CH2 4.45Å; F539-W553 HydrophobicContact CD1-CZ3 4.09Å; F539-W553 HydrophobicContact CE1-CH2 4.31Å; F539-W553 AromaticContact CE1-CZ3 3.78Å; F539-W553 HydrophobicContact CE1-CZ3 3.78Å; K540-W553 HydrophobicContact CB-CH2 3.93Å; K540-W553 HydrophobicContact CB-CZ2 4.5Å; K540-W553 HydrophobicContact CB-CZ3 4.17Å; K540-W553 HydrophobicContact CD-CH2 4.37Å; K540-W553 HydrophobicContact CD-CZ2 4.17Å; K540-W553 HydrophobicContact CG-CH2 3.85Å; K540-W553 HydrophobicContact CG-CZ2 3.93Å; K540-W553 HydrophobicContact CG-CZ3 4.2Å; F543-W553 HydrophobicContact CB-CB 4.18Å; F543-W553 HydrophobicContact CD2-CD2 4.48Å; F543-W553 AromaticContact CD2-CE3 3.44Å; F543-W553 HydrophobicContact CD2-CE3 3.44Å; F543-W553 VanDerWaalsContact CD2-CE3 3.44Å; F543-W553 AromaticContact CD2-CZ3 3.91Å; F543-W553 HydrophobicContact CD2-CZ3 3.91Å; F543-W553 AromaticContact CE2-CE3 3.8Å; F543-W553 HydrophobicContact CE2-CE3 3.8Å; F543-W553 HydrophobicContact CE2-CZ3 4.02Å; F543-W553 HydrophobicContact CG-CB 4.25Å; F543-W553 AromaticContact CG-CE3 3.99Å; F543-W553 HydrophobicContact CG-CE3 3.99Å; F544-W553 HydrophobicContact CE2-CD2 4.46Å; F544-W553 HydrophobicContact CE2-CG 4.32Å; F544-W553 HydrophobicContact CZ-CB 4.44Å; F544-W553 HydrophobicContact CZ-CG 4.12Å; H549-W553 PolarHBondContact O-N 3.4Å; T550-W553 PolarHBondContact O-N 3.41Å; W553-K555 VanDerWaalsContact C-N 3.33Å; W553-K555 PolarHBondContact O-N 3.22Å; W553-I556 PolarHBondContact O-N 3.16Å; W553-T557 PolarHBondContact NE1-OG1 3.32Å; W553-T557 VanDerWaalsContact O-CB 3.32Å; W553-T557 WeakPolarHBondContact O-CB 3.37Å; W553-T557 PolarHBondContact O-N 3.34Å; W553-T557 PolarHBondContact O-OG1 3.21Å
554	H	89.2	Confident	83.6	Confident	118 Å²	118	62.3 Å²	62.3	55%	0.546	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-39.9	175.2	-75	-53	0	0	0	112.3	T550 A552 T558	T550-H554 WeakPolarHBondContact O-CB 3.39Å; T550-H554 PolarHBondContact O-CD2 2.92Å; T550-H554 VanDerWaalsContact O-CG 3.28Å; T550-H554 PolarHBondContact O-N 2.94Å; A552-H554 VanDerWaalsContact C-N 3.35Å; A552-H554 PolarHBondContact O-N 2.63Å; H554-T558 WeakPolarHBondContact O-CB 3.49Å; H554-T558 PolarHBondContact O-N 3.3Å; H554-T558 PolarHBondContact O-OG1 3.14Å
555	K	89.9	Confident	84.4	Confident	130 Å²	130	61.8 Å²	61.8	57%	0.565	31%	0.31	S	S	*	.	H	α-helix	trans	-60.9	-50.5	175	-74	172.8	-177.1	-176.8	0	111.3	S551 A552 W553 T557 T558 V559	S551-K555 VanDerWaalsContact O-CG 3.3Å; S551-K555 WeakPolarHBondContact O-CG 3.44Å; S551-K555 PolarHBondContact O-N 2.99Å; A552-K555 WeakPolarHBondContact O-CB 3.39Å; A552-K555 PolarHBondContact O-N 3.27Å; W553-K555 VanDerWaalsContact C-N 3.33Å; W553-K555 PolarHBondContact O-N 3.22Å; K555-T557 PolarHBondContact O-N 2.83Å; K555-T558 WeakPolarHBondContact O-CB 3.21Å; K555-T558 PolarHBondContact O-N 3Å; K555-V559 WeakPolarHBondContact O-CG2 3.41Å; K555-V559 PolarHBondContact O-N 3.46Å
556	I	92	Very high	85.9	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.015	31%	0.312	C	S	.	.	H	α-helix	trans	-61.9	-46.1	179	-75.6	169.5	0	0	0	111.4	V499 V502 F539 F543 A552 W553 T558 V559 L560	V499-I556 HydrophobicContact CG2-CD1 3.77Å; V499-I556 HydrophobicContact CG2-CG1 4.18Å; V502-I556 HydrophobicContact CB-CG1 4.32Å; V502-I556 HydrophobicContact CG1-CG1 4.31Å; V502-I556 HydrophobicContact CG1-CG2 4.25Å; V502-I556 HydrophobicContact CG2-CD1 4.37Å; V502-I556 HydrophobicContact CG2-CG1 4.34Å; V502-I556 HydrophobicContact CG2-CG2 4.33Å; F539-I556 HydrophobicContact CE1-CG2 4.32Å; F539-I556 HydrophobicContact CZ-CG2 4.01Å; F543-I556 HydrophobicContact CD1-CD1 4.47Å; F543-I556 HydrophobicContact CE1-CD1 3.33Å; F543-I556 HydrophobicContact CE2-CD1 4.07Å; F543-I556 HydrophobicContact CZ-CD1 3.08Å; A552-I556 PolarHBondContact O-N 3.08Å; W553-I556 PolarHBondContact O-N 3.16Å; I556-T558 PolarHBondContact O-N 2.69Å; I556-V559 PolarHBondContact O-N 2.79Å; I556-L560 HydrophobicContact CG2-CD1 3.79Å; I556-L560 HydrophobicContact CG2-CG 4.29Å; I556-L560 WeakPolarHBondContact O-CB 3.37Å; I556-L560 WeakPolarHBondContact O-CG 3.4Å; I556-L560 PolarHBondContact O-N 2.96Å
557	T	92.4	Very high	87.6	Confident	31 Å²	31	56.7 Å²	56.7	19%	0.19	29%	0.288	C	S	.	.	H	α-helix	trans	-58.5	-39.7	177	-57.4	0	0	0	0	111.1	L533 W553 K555 N561	L533-T557 HydrophobicContact CD1-CG2 4.38Å; L533-T557 HydrophobicContact CD2-CG2 4.27Å; W553-T557 PolarHBondContact NE1-OG1 3.32Å; W553-T557 VanDerWaalsContact O-CB 3.32Å; W553-T557 WeakPolarHBondContact O-CB 3.37Å; W553-T557 PolarHBondContact O-N 3.34Å; W553-T557 PolarHBondContact O-OG1 3.21Å; K555-T557 PolarHBondContact O-N 2.83Å; T557-N561 WeakPolarHBondContact CG2-ND2 3.24Å; T557-N561 VanDerWaalsContact O-CB 3.31Å; T557-N561 WeakPolarHBondContact O-CB 2.94Å; T557-N561 VanDerWaalsContact O-CG 3.31Å; T557-N561 PolarHBondContact O-N 2.97Å; T557-N561 PolarHBondContact O-ND2 3.4Å
558	T	93.8	Very high	89.3	Confident	72 Å²	72	55.4 Å²	55.4	44%	0.442	28%	0.279	S	S	.	.	H	α-helix	trans	-65.9	-47	177	-56.3	0	0	0	0	111.1	H554 K555 I556 N561 Q562	H554-T558 WeakPolarHBondContact O-CB 3.49Å; H554-T558 PolarHBondContact O-N 3.3Å; H554-T558 PolarHBondContact O-OG1 3.14Å; K555-T558 WeakPolarHBondContact O-CB 3.21Å; K555-T558 PolarHBondContact O-N 3Å; I556-T558 PolarHBondContact O-N 2.69Å; T558-N561 PolarHBondContact O-N 3.1Å; T558-Q562 HydrophobicContact CG2-CG 4.46Å; T558-Q562 WeakPolarHBondContact O-CB 3.29Å; T558-Q562 VanDerWaalsContact O-CG 3.25Å; T558-Q562 WeakPolarHBondContact O-CG 3.38Å; T558-Q562 PolarHBondContact O-N 3.06Å
559	V	94.5	Very high	90.5	Very high	31 Å²	31	48 Å²	48	19%	0.188	25%	0.25	C	S	.	.	H	α-helix	trans	-62.3	-48.2	179.9	171.8	0	0	0	0	111.5	V502 A506 K555 I556 N561 Q562 L563	V502-V559 HydrophobicContact CG1-CG1 4.11Å; A506-V559 HydrophobicContact CB-CG1 3.64Å; K555-V559 WeakPolarHBondContact O-CG2 3.41Å; K555-V559 PolarHBondContact O-N 3.46Å; I556-V559 PolarHBondContact O-N 2.79Å; V559-N561 PolarHBondContact O-N 2.59Å; V559-Q562 PolarHBondContact O-N 2.87Å; V559-L563 WeakPolarHBondContact O-CB 3.48Å; V559-L563 PolarHBondContact O-N 3.34Å
560	L	94.8	Very high	91.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.2	-40.1	-179.8	-69.9	177.7	0	0	0	112.2	V502 F505 C529 L532 L533 I556 L563 S564	V502-L560 HydrophobicContact CG1-CD2 4.05Å; V502-L560 HydrophobicContact CG1-CG 4.15Å; F505-L560 HydrophobicContact CE1-CD2 4.43Å; C529-L560 HydrophobicContact CB-CB 4.35Å; C529-L560 HydrophobicContact CB-CD2 4.32Å; L532-L560 HydrophobicContact CB-CD1 4.23Å; L532-L560 HydrophobicContact CD1-CD1 4.32Å; L532-L560 HydrophobicContact CD1-CD2 4.38Å; L533-L560 HydrophobicContact CD1-CB 4.19Å; L533-L560 HydrophobicContact CD2-CD1 3.86Å; L533-L560 HydrophobicContact CG-CB 4.44Å; L533-L560 HydrophobicContact CG-CD1 4.09Å; I556-L560 HydrophobicContact CG2-CD1 3.79Å; I556-L560 HydrophobicContact CG2-CG 4.29Å; I556-L560 WeakPolarHBondContact O-CB 3.37Å; I556-L560 WeakPolarHBondContact O-CG 3.4Å; I556-L560 PolarHBondContact O-N 2.96Å; L560-L563 PolarHBondContact O-N 2.93Å; L560-S564 WeakPolarHBondContact O-CB 3.4Å; L560-S564 PolarHBondContact O-N 3.44Å
561	N	94.3	Very high	91.6	Very high	65 Å²	65	44.6 Å²	44.6	35%	0.348	23%	0.229	S	C	.	.	H	α-helix	trans	-65.3	-45.7	175.2	-77.9	-49.8	0	0	0	111.6	T557 T558 V559 L563 S564 E565	T557-N561 WeakPolarHBondContact CG2-ND2 3.24Å; T557-N561 VanDerWaalsContact O-CB 3.31Å; T557-N561 WeakPolarHBondContact O-CB 2.94Å; T557-N561 VanDerWaalsContact O-CG 3.31Å; T557-N561 PolarHBondContact O-N 2.97Å; T557-N561 PolarHBondContact O-ND2 3.4Å; T558-N561 PolarHBondContact O-N 3.1Å; V559-N561 PolarHBondContact O-N 2.59Å; N561-L563 VanDerWaalsContact C-N 3.32Å; N561-L563 PolarHBondContact O-N 3.35Å; N561-S564 PolarHBondContact O-N 3.43Å; N561-S564 PolarHBondContact O-OG 3.48Å; N561-E565 WeakPolarHBondContact O-CG 3.49Å; N561-E565 PolarHBondContact O-N 3.27Å
562	Q	94.3	Very high	91.8	Very high	118 Å²	118	41 Å²	41	55%	0.551	21%	0.205	S	C	*	.	H	α-helix	trans	-59.5	-42.5	176.7	-75.7	174	-8.6	0	0	112.2	T558 V559 E565 H566	T558-Q562 HydrophobicContact CG2-CG 4.46Å; T558-Q562 WeakPolarHBondContact O-CB 3.29Å; T558-Q562 VanDerWaalsContact O-CG 3.25Å; T558-Q562 WeakPolarHBondContact O-CG 3.38Å; T558-Q562 PolarHBondContact O-N 3.06Å; V559-Q562 PolarHBondContact O-N 2.87Å; Q562-E565 PolarHBondContact O-N 3.18Å; Q562-H566 WeakPolarHBondContact O-CB 3.4Å; Q562-H566 PolarHBondContact O-N 3.1Å
563	L	93.4	Very high	91.9	Very high	11 Å²	11	45.5 Å²	45.5	6%	0.058	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-44.2	175.6	-178.2	61.4	0	0	0	111.3	F505 A506 C509 V559 L560 N561 E565 H566 K567	F505-L563 HydrophobicContact CD1-CD2 4.11Å; F505-L563 HydrophobicContact CE1-CD2 3.73Å; A506-L563 HydrophobicContact CB-CD2 4.13Å; C509-L563 HydrophobicContact CB-CD1 4.16Å; C509-L563 HydrophobicContact CB-CD2 4.04Å; V559-L563 WeakPolarHBondContact O-CB 3.48Å; V559-L563 PolarHBondContact O-N 3.34Å; L560-L563 PolarHBondContact O-N 2.93Å; N561-L563 VanDerWaalsContact C-N 3.32Å; N561-L563 PolarHBondContact O-N 3.35Å; L563-E565 VanDerWaalsContact C-N 3.34Å; L563-E565 PolarHBondContact O-N 3.31Å; L563-H566 PolarHBondContact O-N 3.17Å; L563-K567 HydrophobicContact CD1-CG 4.22Å; L563-K567 WeakPolarHBondContact O-CB 3.3Å; L563-K567 WeakPolarHBondContact O-CG 3.33Å; L563-K567 PolarHBondContact O-N 3.12Å
564	S	92.9	Very high	91.8	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-60.8	-42.4	177.1	77.7	0	0	0	0	112.2	L560 N561 K567 Y568	L560-S564 WeakPolarHBondContact O-CB 3.4Å; L560-S564 PolarHBondContact O-N 3.44Å; N561-S564 PolarHBondContact O-N 3.43Å; N561-S564 PolarHBondContact O-OG 3.48Å; S564-K567 PolarHBondContact O-N 3.17Å; S564-Y568 WeakPolarHBondContact O-CD2 3.4Å; S564-Y568 PolarHBondContact O-N 3.39Å
565	E	93.7	Very high	91.7	Very high	73 Å²	73	40.5 Å²	40.5	34%	0.341	21%	0.211	S	C	.	.	H	α-helix	trans	-66.5	-40.9	177.4	-72.8	-177.4	171.5	0	0	111.8	N561 Q562 L563 S569 P651 H653 L654	N561-E565 WeakPolarHBondContact O-CG 3.49Å; N561-E565 PolarHBondContact O-N 3.27Å; Q562-E565 PolarHBondContact O-N 3.18Å; L563-E565 VanDerWaalsContact C-N 3.34Å; L563-E565 PolarHBondContact O-N 3.31Å; E565-S569 WeakPolarHBondContact O-CB 3.46Å; E565-S569 PolarHBondContact O-N 3.46Å; E565-S569 PolarHBondContact O-OG 3.08Å; E565-P651 HydrophobicContact CG-CG 4.36Å; E565-H653 IonicContact OE1-CE1 3.97Å; E565-H653 PolarHBondContact OE1-CE1 3.37Å; E565-L654 HydrophobicContact CB-CD1 4.35Å; E565-L654 HydrophobicContact CG-CD1 4.35Å
566	H	92.3	Very high	91.6	Very high	90 Å²	90	35.1 Å²	35.1	42%	0.417	19%	0.19	S	C	.	.	H	α-helix	trans	-61.7	-46.7	176.5	-175	63.5	0	0	0	111.4	Q562 L563 S569 E570	Q562-H566 WeakPolarHBondContact O-CB 3.4Å; Q562-H566 PolarHBondContact O-N 3.1Å; L563-H566 PolarHBondContact O-N 3.17Å; H566-S569 WeakPolarHBondContact O-CB 3.47Å; H566-S569 PolarHBondContact O-N 3.29Å; H566-S569 VanDerWaalsContact O-N 3.12Å; H566-E570 IonicContact CD2-OE1 2.94Å; H566-E570 IonicContact NE2-OE1 3.55Å; H566-E570 PolarHBondContact NE2-OE1 3.23Å; H566-E570 PolarHBondContact O-N 2.64Å
567	K	91.6	Very high	91.4	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.1	-38.6	-179.9	-69.1	-68.8	146	-161.3	0	113.1	C509 Q510 V512 A522 C525 A526 L563 S564 S569 E570 W571	C509-K567 WeakPolarHBondContact O-CE 3.48Å; C509-K567 PolarHBondContact O-NZ 3.45Å; Q510-K567 PolarHBondContact O-NZ 3.47Å; V512-K567 PolarHBondContact O-NZ 3.21Å; A522-K567 HydrophobicContact CB-CB 4.37Å; A522-K567 HydrophobicContact CB-CD 4.11Å; A522-K567 WeakPolarHBondContact O-CB 3.28Å; C525-K567 HydrophobicContact CB-CG 4.41Å; A526-K567 HydrophobicContact CB-CB 4.05Å; L563-K567 HydrophobicContact CD1-CG 4.22Å; L563-K567 WeakPolarHBondContact O-CB 3.3Å; L563-K567 WeakPolarHBondContact O-CG 3.33Å; L563-K567 PolarHBondContact O-N 3.12Å; S564-K567 PolarHBondContact O-N 3.17Å; K567-S569 VanDerWaalsContact C-N 3.29Å; K567-S569 PolarHBondContact O-N 2.98Å; K567-E570 WeakPolarHBondContact CD-OE2 3.26Å; K567-E570 VanDerWaalsContact NZ-CD 3.35Å; K567-E570 IonicContact NZ-OE1 2.59Å; K567-E570 PolarHBondContact NZ-OE1 3.03Å; K567-E570 IonicContact NZ-OE2 3.35Å; K567-E570 PolarHBondContact NZ-OE2 3.26Å; K567-E570 PolarHBondContact O-N 3.23Å; K567-W571 PolarHBondContact O-N 2.87Å; K567-W571 VanDerWaalsContact O-N 3.11Å
568	Y	92.1	Very high	91.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-35.2	169.9	-78.5	-49.8	0	0	0	112.7	V523 A526 K527 Q530 S564 W571 I572 V645 V650 L654	V523-Y568 HydrophobicContact CG1-CE1 4.45Å; A526-Y568 HydrophobicContact CB-CD1 4.19Å; A526-Y568 HydrophobicContact CB-CD2 3.91Å; A526-Y568 HydrophobicContact CB-CE1 3.9Å; A526-Y568 HydrophobicContact CB-CE2 3.64Å; A526-Y568 HydrophobicContact CB-CG 4.16Å; K527-Y568 WeakPolarHBondContact CD-OH 3.31Å; K527-Y568 VanDerWaalsContact CE-OH 3.31Å; K527-Y568 WeakPolarHBondContact CE-OH 3.29Å; Q530-Y568 PolarHBondContact OE1-OH 3.2Å; S564-Y568 WeakPolarHBondContact O-CD2 3.4Å; S564-Y568 PolarHBondContact O-N 3.39Å; Y568-W571 PolarHBondContact O-N 2.9Å; Y568-I572 WeakPolarHBondContact O-CB 3.33Å; Y568-I572 VanDerWaalsContact O-CG1 3.25Å; Y568-I572 WeakPolarHBondContact O-CG1 3.39Å; Y568-I572 PolarHBondContact O-N 3.43Å; Y568-V645 HydrophobicContact CE1-CG1 4.06Å; Y568-V650 HydrophobicContact CD1-CG1 4.39Å; Y568-V650 HydrophobicContact CD1-CG2 4.08Å; Y568-V650 HydrophobicContact CD2-CG1 4.33Å; Y568-V650 HydrophobicContact CE1-CG2 3.76Å; Y568-V650 HydrophobicContact CE2-CG2 4.4Å; Y568-V650 HydrophobicContact CG-CG1 4.2Å; Y568-L654 HydrophobicContact CD2-CD1 4.24Å; Y568-L654 HydrophobicContact CG-CD1 4.28Å
569	S	91.3	Very high	90.9	Very high	28 Å²	28	37.9 Å²	37.9	20%	0.196	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-40.8	176.5	-60.9	0	0	0	0	112	E565 H566 K567 I572 L573	E565-S569 WeakPolarHBondContact O-CB 3.46Å; E565-S569 PolarHBondContact O-N 3.46Å; E565-S569 PolarHBondContact O-OG 3.08Å; H566-S569 WeakPolarHBondContact O-CB 3.47Å; H566-S569 PolarHBondContact O-N 3.29Å; H566-S569 VanDerWaalsContact O-N 3.12Å; K567-S569 VanDerWaalsContact C-N 3.29Å; K567-S569 PolarHBondContact O-N 2.98Å; S569-I572 PolarHBondContact O-N 3.3Å; S569-L573 WeakPolarHBondContact O-CG 3.48Å; S569-L573 PolarHBondContact O-N 2.79Å
570	E	89	Confident	90.7	Very high	43 Å²	43	36.8 Å²	36.8	20%	0.201	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-46.4	173	-71.5	178.3	166.7	0	0	111.7	H566 K567 I572 L573 A574	H566-E570 IonicContact CD2-OE1 2.94Å; H566-E570 IonicContact NE2-OE1 3.55Å; H566-E570 PolarHBondContact NE2-OE1 3.23Å; H566-E570 PolarHBondContact O-N 2.64Å; K567-E570 WeakPolarHBondContact CD-OE2 3.26Å; K567-E570 VanDerWaalsContact NZ-CD 3.35Å; K567-E570 IonicContact NZ-OE1 2.59Å; K567-E570 PolarHBondContact NZ-OE1 3.03Å; K567-E570 IonicContact NZ-OE2 3.35Å; K567-E570 PolarHBondContact NZ-OE2 3.26Å; K567-E570 PolarHBondContact O-N 3.23Å; E570-I572 VanDerWaalsContact C-N 3.35Å; E570-I572 PolarHBondContact O-N 3.49Å; E570-L573 PolarHBondContact O-N 3.23Å; E570-A574 PolarHBondContact O-N 2.88Å
571	W	89.5	Confident	90.3	Very high	7 Å²	7	40 Å²	40	3%	0.027	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-44	175.2	168.7	83.1	0	0	0	112.1	V519 V523 K567 Y568 L573 A574 V575 I641 V645 L658	V519-W571 HydrophobicContact CG1-CB 3.94Å; V519-W571 HydrophobicContact CG1-CG 4.07Å; V523-W571 HydrophobicContact CG2-CB 4.02Å; V523-W571 VanDerWaalsContact CG2-CD1 3.44Å; V523-W571 HydrophobicContact CG2-CD2 4.14Å; V523-W571 HydrophobicContact CG2-CG 3.6Å; K567-W571 PolarHBondContact O-N 2.87Å; K567-W571 VanDerWaalsContact O-N 3.11Å; Y568-W571 PolarHBondContact O-N 2.9Å; W571-L573 VanDerWaalsContact C-N 3.33Å; W571-L573 PolarHBondContact O-N 3.05Å; W571-A574 PolarHBondContact O-N 3.27Å; W571-V575 HydrophobicContact CD2-CG2 4.21Å; W571-V575 HydrophobicContact CG-CG2 4.41Å; W571-V575 HydrophobicContact CZ2-CG2 4.09Å; W571-V575 WeakPolarHBondContact O-CG2 3.44Å; W571-V575 PolarHBondContact O-N 3.43Å; W571-I641 HydrophobicContact CH2-CG2 4.39Å; W571-I641 HydrophobicContact CZ2-CG2 3.54Å; W571-V645 HydrophobicContact CH2-CB 4.36Å; W571-V645 HydrophobicContact CH2-CG2 4.23Å; W571-V645 HydrophobicContact CZ2-CB 4.06Å; W571-V645 HydrophobicContact CZ2-CG1 4.48Å; W571-V645 HydrophobicContact CZ2-CG2 3.46Å; W571-V645 VanDerWaalsContact CZ2-CG2 3.46Å; W571-L658 HydrophobicContact CH2-CD2 4.36Å
572	I	90.6	Very high	90	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-60.5	-42.5	176.8	-73.3	163.7	0	0	0	111.4	Y568 S569 E570 V575 A576 L654 Q657 L658	Y568-I572 WeakPolarHBondContact O-CB 3.33Å; Y568-I572 VanDerWaalsContact O-CG1 3.25Å; Y568-I572 WeakPolarHBondContact O-CG1 3.39Å; Y568-I572 PolarHBondContact O-N 3.43Å; S569-I572 PolarHBondContact O-N 3.3Å; E570-I572 VanDerWaalsContact C-N 3.35Å; E570-I572 PolarHBondContact O-N 3.49Å; I572-V575 PolarHBondContact O-N 3.12Å; I572-A576 WeakPolarHBondContact O-CB 3.48Å; I572-A576 PolarHBondContact O-N 3.37Å; I572-L654 HydrophobicContact CD1-CB 3.6Å; I572-L654 HydrophobicContact CD1-CD2 4.45Å; I572-L654 VanDerWaalsContact CD1-O 3.23Å; I572-L654 WeakPolarHBondContact CD1-O 3.37Å; I572-Q657 HydrophobicContact CG2-CG 4.26Å; I572-L658 HydrophobicContact CG1-CB 4.25Å; I572-L658 HydrophobicContact CG2-CB 4.03Å; I572-L658 HydrophobicContact CG2-CD1 4.13Å
573	L	88.8	Confident	89.8	Confident	104 Å²	104	34.2 Å²	34.2	55%	0.545	20%	0.199	S	C	.	.	H	α-helix	trans	-65.2	-40.7	179.4	-72.8	173.2	0	0	0	111.8	S569 E570 W571 A576 A577	S569-L573 WeakPolarHBondContact O-CG 3.48Å; S569-L573 PolarHBondContact O-N 2.79Å; E570-L573 PolarHBondContact O-N 3.23Å; W571-L573 VanDerWaalsContact C-N 3.33Å; W571-L573 PolarHBondContact O-N 3.05Å; L573-A576 PolarHBondContact O-N 2.83Å; L573-A577 PolarHBondContact O-N 3.33Å
574	A	87.3	Confident	89.5	Confident	31 Å²	31	38.1 Å²	38.1	26%	0.256	22%	0.215	S	C	.	.	H	α-helix	trans	-64.3	-49.1	175.5	0	0	0	0	0	111.5	V519 E570 W571 A576 A577 D578	V519-A574 HydrophobicContact CB-CB 4.39Å; V519-A574 HydrophobicContact CG1-CB 3.59Å; V519-A574 HydrophobicContact CG2-CB 3.79Å; E570-A574 PolarHBondContact O-N 2.88Å; W571-A574 PolarHBondContact O-N 3.27Å; A574-A576 VanDerWaalsContact C-N 3.3Å; A574-A576 PolarHBondContact O-N 3.42Å; A574-A577 WeakPolarHBondContact O-CB 3.49Å; A574-A577 PolarHBondContact O-N 3.45Å; A574-A577 VanDerWaalsContact O-N 3.17Å; A574-D578 PolarHBondContact O-N 3.41Å; A574-D578 VanDerWaalsContact O-N 3.12Å
575	V	87.5	Confident	89.1	Confident	11 Å²	11	44.5 Å²	44.5	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-40.7	176.7	172.1	0	0	0	0	111.3	W571 I572 A577 D578 V579 I641 L658	W571-V575 HydrophobicContact CD2-CG2 4.21Å; W571-V575 HydrophobicContact CG-CG2 4.41Å; W571-V575 HydrophobicContact CZ2-CG2 4.09Å; W571-V575 WeakPolarHBondContact O-CG2 3.44Å; W571-V575 PolarHBondContact O-N 3.43Å; I572-V575 PolarHBondContact O-N 3.12Å; V575-A577 VanDerWaalsContact C-N 3.31Å; V575-A577 PolarHBondContact O-N 3.09Å; V575-D578 PolarHBondContact O-N 3.11Å; V575-V579 HydrophobicContact CG1-CG2 4.13Å; V575-V579 WeakPolarHBondContact O-CB 3.11Å; V575-V579 VanDerWaalsContact O-CG2 3.26Å; V575-V579 WeakPolarHBondContact O-CG2 3.12Å; V575-V579 PolarHBondContact O-N 3.24Å; V575-I641 HydrophobicContact CG1-CD1 4.13Å; V575-I641 HydrophobicContact CG1-CG2 4Å; V575-I641 HydrophobicContact CG2-CG2 3.88Å; V575-L658 HydrophobicContact CB-CD1 4.39Å; V575-L658 HydrophobicContact CG1-CD1 3.91Å
576	A	87.9	Confident	88.7	Confident	16 Å²	16	42.8 Å²	42.8	13%	0.132	24%	0.238	C	C	.	.	H	α-helix	trans	-65.6	-34.2	178.4	0	0	0	0	0	112.4	I572 L573 A574 G580 T661	I572-A576 WeakPolarHBondContact O-CB 3.48Å; I572-A576 PolarHBondContact O-N 3.37Å; L573-A576 PolarHBondContact O-N 2.83Å; A574-A576 VanDerWaalsContact C-N 3.3Å; A574-A576 PolarHBondContact O-N 3.42Å; A576-G580 WeakPolarHBondContact O-CA 3.4Å; A576-G580 PolarHBondContact O-N 3.29Å; A576-T661 HydrophobicContact CB-CG2 4.44Å; A576-T661 WeakPolarHBondContact CB-OG1 3.43Å
577	A	88.1	Confident	88.1	Confident	63 Å²	63	38.7 Å²	38.7	52%	0.521	22%	0.219	S	C	.	.	H	α-helix	trans	-67.1	-44.5	175	0	0	0	0	0	111.6	L573 A574 V575 G580 S581	L573-A577 PolarHBondContact O-N 3.33Å; A574-A577 WeakPolarHBondContact O-CB 3.49Å; A574-A577 PolarHBondContact O-N 3.45Å; A574-A577 VanDerWaalsContact O-N 3.17Å; V575-A577 VanDerWaalsContact C-N 3.31Å; V575-A577 PolarHBondContact O-N 3.09Å; A577-G580 PolarHBondContact O-N 3.48Å; A577-S581 PolarHBondContact O-N 2.73Å; A577-S581 PolarHBondContact O-OG 2.79Å
578	D	87.6	Confident	87.5	Confident	99 Å²	99	44.2 Å²	44.2	53%	0.529	24%	0.244	S	C	.	.	H	α-helix	trans	-66.2	-44.5	177.9	-69.7	-12.4	0	0	0	112	A574 V575 G580 S581 E582	A574-D578 PolarHBondContact O-N 3.41Å; A574-D578 VanDerWaalsContact O-N 3.12Å; V575-D578 PolarHBondContact O-N 3.11Å; D578-G580 VanDerWaalsContact C-N 3.3Å; D578-G580 PolarHBondContact O-N 2.64Å; D578-S581 PolarHBondContact O-N 3.28Å; D578-S581 PolarHBondContact O-OG 3.33Å; D578-E582 PolarHBondContact O-N 3.02Å
579	V	88.1	Confident	86.6	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-38.9	175.4	169.5	0	0	0	0	110.5	V575 E582 V583 L634 M638 A662	V575-V579 HydrophobicContact CG1-CG2 4.13Å; V575-V579 WeakPolarHBondContact O-CB 3.11Å; V575-V579 VanDerWaalsContact O-CG2 3.26Å; V575-V579 WeakPolarHBondContact O-CG2 3.12Å; V575-V579 PolarHBondContact O-N 3.24Å; V579-E582 PolarHBondContact O-N 2.86Å; V579-V583 HydrophobicContact CG1-CG2 4.36Å; V579-V583 WeakPolarHBondContact O-CB 3.3Å; V579-V583 VanDerWaalsContact O-CG2 3.22Å; V579-V583 WeakPolarHBondContact O-CG2 3.26Å; V579-V583 PolarHBondContact O-N 3.5Å; V579-L634 HydrophobicContact CG1-CD1 3.24Å; V579-M638 HydrophobicContact CG2-CG 4.45Å; V579-A662 HydrophobicContact CG1-CB 4.48Å
580	G	88.5	Confident	85.5	Confident	8 Å²	8	46.1 Å²	46.1	8%	0.082	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-37.3	178.9	0	0	0	0	0	113.7	A576 A577 D578 K584	A576-G580 WeakPolarHBondContact O-CA 3.4Å; A576-G580 PolarHBondContact O-N 3.29Å; A577-G580 PolarHBondContact O-N 3.48Å; D578-G580 VanDerWaalsContact C-N 3.3Å; D578-G580 PolarHBondContact O-N 2.64Å; G580-K584 WeakPolarHBondContact O-CG 3.39Å; G580-K584 PolarHBondContact O-N 2.99Å
581	S	88.1	Confident	84.1	Confident	68 Å²	68	46.5 Å²	46.5	48%	0.476	26%	0.262	S	S	.	.	H	α-helix	trans	-69.4	-43.4	175	59.5	0	0	0	0	111.7	A577 D578 V583 K584 E585	A577-S581 PolarHBondContact O-N 2.73Å; A577-S581 PolarHBondContact O-OG 2.79Å; D578-S581 PolarHBondContact O-N 3.28Å; D578-S581 PolarHBondContact O-OG 3.33Å; S581-V583 VanDerWaalsContact C-N 3.34Å; S581-V583 PolarHBondContact O-N 3.33Å; S581-K584 PolarHBondContact O-N 3.49Å; S581-E585 PolarHBondContact O-N 3.34Å
582	E	87.5	Confident	83	Confident	59 Å²	59	50.5 Å²	50.5	28%	0.276	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-40.8	176.8	179.8	175.2	-178.1	0	0	111.9	D578 V579 E585 N586	D578-E582 PolarHBondContact O-N 3.02Å; V579-E582 PolarHBondContact O-N 2.86Å; E582-E585 PolarHBondContact O-N 2.97Å; E582-N586 VanDerWaalsContact CG-ND2 3.32Å; E582-N586 WeakPolarHBondContact CG-ND2 3.25Å; E582-N586 WeakPolarHBondContact O-CB 3.48Å; E582-N586 PolarHBondContact O-N 3.4Å; E582-N586 PolarHBondContact O-ND2 3.33Å
583	V	88.9	Confident	81.7	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-63.8	-43.5	176.6	167.6	0	0	0	0	111.3	V579 S581 N586 L587 L634 V666 A669	V579-V583 HydrophobicContact CG1-CG2 4.36Å; V579-V583 WeakPolarHBondContact O-CB 3.3Å; V579-V583 VanDerWaalsContact O-CG2 3.22Å; V579-V583 WeakPolarHBondContact O-CG2 3.26Å; V579-V583 PolarHBondContact O-N 3.5Å; S581-V583 VanDerWaalsContact C-N 3.34Å; S581-V583 PolarHBondContact O-N 3.33Å; V583-N586 PolarHBondContact O-N 3.06Å; V583-L587 HydrophobicContact CG1-CD1 3.81Å; V583-L587 WeakPolarHBondContact O-CB 3.46Å; V583-L587 PolarHBondContact O-N 3.48Å; V583-L634 HydrophobicContact CG2-CD1 3.88Å; V583-L634 HydrophobicContact CG2-CD2 4Å; V583-L634 HydrophobicContact CG2-CG 4.49Å; V583-V666 HydrophobicContact CG1-CB 4.37Å; V583-V666 HydrophobicContact CG1-CG2 3.84Å; V583-V666 HydrophobicContact CG2-CG2 4.16Å; V583-A669 HydrophobicContact CG1-CB 3.94Å
584	K	87	Confident	80.6	Confident	93 Å²	93	58.5 Å²	58.5	40%	0.404	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-45.6	176.7	-73.4	174.6	-177.7	-177.4	0	111.4	G580 S581 L587 H588 A669	G580-K584 WeakPolarHBondContact O-CG 3.39Å; G580-K584 PolarHBondContact O-N 2.99Å; S581-K584 PolarHBondContact O-N 3.49Å; K584-L587 PolarHBondContact O-N 2.99Å; K584-H588 WeakPolarHBondContact O-CB 3.3Å; K584-H588 PolarHBondContact O-CD2 3.12Å; K584-H588 PolarHBondContact O-N 3.18Å; K584-A669 HydrophobicContact CG-CB 3.88Å
585	E	85.9	Confident	79.4	Confident	135 Å²	135	58.4 Å²	58.4	63%	0.631	31%	0.314	S	S	*	.	H	α-helix	trans	-61.8	-46.7	178.1	-172.3	-177	170.6	0	0	112.1	S581 E582 L587 H588 T589	S581-E585 PolarHBondContact O-N 3.34Å; E582-E585 PolarHBondContact O-N 2.97Å; E585-L587 PolarHBondContact O-N 3.5Å; E585-H588 PolarHBondContact O-N 3.38Å; E585-T589 WeakPolarHBondContact O-CG2 3.12Å; E585-T589 PolarHBondContact O-N 3.48Å; E585-T589 PolarHBondContact O-OG1 2.64Å
586	N	84	Confident	78.3	Confident	38 Å²	38	59.2 Å²	59.2	20%	0.203	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-37.9	178.8	-77.9	-62	0	0	0	112.5	E582 V583 T589 Q590 W630	E582-N586 VanDerWaalsContact CG-ND2 3.32Å; E582-N586 WeakPolarHBondContact CG-ND2 3.25Å; E582-N586 WeakPolarHBondContact O-CB 3.48Å; E582-N586 PolarHBondContact O-N 3.4Å; E582-N586 PolarHBondContact O-ND2 3.33Å; V583-N586 PolarHBondContact O-N 3.06Å; N586-T589 WeakPolarHBondContact CA-OG1 3.36Å; N586-T589 PolarHBondContact O-OG1 3.35Å; N586-Q590 WeakPolarHBondContact O-CG 3.39Å; N586-Q590 PolarHBondContact O-N 3.17Å; N586-W630 HydrophobicContact CB-CB 3.87Å; N586-W630 HydrophobicContact CB-CG 4.36Å
587	L	80.7	Confident	77.1	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-72.9	-40.4	178.4	-81.2	164.1	0	0	0	112.1	V583 K584 E585 T589 Q590 W630 A669 M670 L673 L688	V583-L587 HydrophobicContact CG1-CD1 3.81Å; V583-L587 WeakPolarHBondContact O-CB 3.46Å; V583-L587 PolarHBondContact O-N 3.48Å; K584-L587 PolarHBondContact O-N 2.99Å; E585-L587 PolarHBondContact O-N 3.5Å; L587-T589 VanDerWaalsContact C-N 3.29Å; L587-T589 PolarHBondContact O-N 3.43Å; L587-Q590 WeakPolarHBondContact O-CB 3.49Å; L587-Q590 PolarHBondContact O-N 3.35Å; L587-Q590 VanDerWaalsContact O-N 3.16Å; L587-W630 HydrophobicContact CD1-CH2 4.46Å; L587-W630 HydrophobicContact CD2-CZ2 3.93Å; L587-W630 HydrophobicContact CG-CZ2 4.43Å; L587-A669 HydrophobicContact CD1-CB 3.4Å; L587-A669 VanDerWaalsContact CD1-CB 3.4Å; L587-M670 HydrophobicContact CD1-CG 4.09Å; L587-L673 HydrophobicContact CB-CD1 4.19Å; L587-L673 HydrophobicContact CD2-CD1 4.15Å; L587-L673 WeakPolarHBondContact O-CD1 2.95Å; L587-L688 HydrophobicContact CD2-CD2 3.67Å
588	H	77.9	Confident	76	Confident	116 Å²	116	66.6 Å²	66.6	54%	0.537	34%	0.339	S	S	.	.	H	α-helix	trans	-61.9	-36.8	174.3	-80.2	-61.1	0	0	0	112.6	K584 E585 Q590	K584-H588 WeakPolarHBondContact O-CB 3.3Å; K584-H588 PolarHBondContact O-CD2 3.12Å; K584-H588 PolarHBondContact O-N 3.18Å; E585-H588 PolarHBondContact O-N 3.38Å; H588-Q590 VanDerWaalsContact C-N 3.27Å; H588-Q590 PolarHBondContact O-N 2.75Å
589	T	74.7	Confident	74.8	Confident	66 Å²	66	63.1 Å²	63.1	41%	0.405	32%	0.321	S	S	.	.	H	α-helix	trans	-73.2	-14.3	177.7	52.3	0	0	0	0	113.7	E585 N586 L587 C591 D592 T595	E585-T589 WeakPolarHBondContact O-CG2 3.12Å; E585-T589 PolarHBondContact O-N 3.48Å; E585-T589 PolarHBondContact O-OG1 2.64Å; N586-T589 WeakPolarHBondContact CA-OG1 3.36Å; N586-T589 PolarHBondContact O-OG1 3.35Å; L587-T589 VanDerWaalsContact C-N 3.29Å; L587-T589 PolarHBondContact O-N 3.43Å; T589-C591 PolarHBondContact O-N 2.85Å; T589-D592 PolarHBondContact O-N 2.92Å; T589-T595 PolarHBondContact O-OG1 3.3Å
590	Q	67	Low	73.5	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.009	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-9.9	177.7	-62.3	-142.8	-58	0	0	114.3	N586 L587 H588 D592 Q596 N599 L684	N586-Q590 WeakPolarHBondContact O-CG 3.39Å; N586-Q590 PolarHBondContact O-N 3.17Å; L587-Q590 WeakPolarHBondContact O-CB 3.49Å; L587-Q590 PolarHBondContact O-N 3.35Å; L587-Q590 VanDerWaalsContact O-N 3.16Å; H588-Q590 VanDerWaalsContact C-N 3.27Å; H588-Q590 PolarHBondContact O-N 2.75Å; Q590-D592 PolarHBondContact O-N 2.88Å; Q590-Q596 WeakPolarHBondContact O-CG 3.44Å; Q590-Q596 PolarHBondContact O-NE2 3.33Å; Q590-N599 PolarHBondContact NE2-ND2 3.22Å; Q590-L684 HydrophobicContact CB-CD1 4.36Å; Q590-L684 HydrophobicContact CB-CD2 4.31Å
591	C	60.5	Low	72.2	Confident	52 Å²	52	68.3 Å²	68.3	35%	0.351	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-18.9	173	-65.3	0	0	0	0	112.5	T589	T589-C591 PolarHBondContact O-N 2.85Å
592	D	66.3	Low	71.3	Confident	91 Å²	91	72.8 Å²	72.8	49%	0.487	35%	0.352	S	S	.	.	S	Bend	trans	-78.1	132.4	177	-171.3	6	0	0	0	112.2	T589 Q590 R594 T595 Q596	T589-D592 PolarHBondContact O-N 2.92Å; Q590-D592 PolarHBondContact O-N 2.88Å; D592-R594 PolarHBondContact O-N 3.37Å; D592-R594 PolarHBondContact OD1-N 2.92Å; D592-T595 HydrophobicContact CB-CG2 4.15Å; D592-T595 PolarHBondContact O-N 2.89Å; D592-T595 PolarHBondContact O-OG1 2.9Å; D592-Q596 WeakPolarHBondContact O-CG 3.36Å; D592-Q596 PolarHBondContact O-N 2.96Å
593	V	62.8	Low	70.6	Confident	99 Å²	99	72.6 Å²	72.6	60%	0.6	35%	0.35	S	S	*	.	H	α-helix	trans	-60.5	-35.2	-177.9	178.9	0	0	0	0	111.3	Q596 M597	V593-Q596 WeakPolarHBondContact O-CB 3.33Å; V593-Q596 PolarHBondContact O-N 3.41Å; V593-M597 WeakPolarHBondContact O-CG 3.41Å; V593-M597 PolarHBondContact O-N 3.15Å
594	R	66.6	Low	69.8	Low	174 Å²	174	75.1 Å²	75.1	66%	0.657	36%	0.361	S	S	*	.	H	α-helix	trans	-65.9	-45.2	178.5	-175.8	178	-178.8	157.6	3.2	111.8	D592 Q596 M597 E598	D592-R594 PolarHBondContact O-N 3.37Å; D592-R594 PolarHBondContact OD1-N 2.92Å; R594-Q596 VanDerWaalsContact C-N 3.3Å; R594-Q596 PolarHBondContact O-N 2.88Å; R594-M597 PolarHBondContact O-N 3.23Å; R594-E598 IonicContact NE-OE1 3.78Å; R594-E598 WeakPolarHBondContact O-CG 3.37Å; R594-E598 PolarHBondContact O-N 2.88Å
595	T	62.1	Low	69	Low	28 Å²	28	74.4 Å²	74.4	17%	0.172	37%	0.368	C	S	.	.	H	α-helix	trans	-70.1	-30.9	179.3	64	0	0	0	0	111.1	T589 D592 E598 N599	T589-T595 PolarHBondContact O-OG1 3.3Å; D592-T595 HydrophobicContact CB-CG2 4.15Å; D592-T595 PolarHBondContact O-N 2.89Å; D592-T595 PolarHBondContact O-OG1 2.9Å; T595-E598 PolarHBondContact O-N 3.48Å; T595-N599 VanDerWaalsContact O-CB 3.24Å; T595-N599 WeakPolarHBondContact O-CB 3.44Å; T595-N599 PolarHBondContact O-N 3.49Å; T595-N599 PolarHBondContact O-ND2 2.98Å
596	Q	63.3	Low	68	Low	28 Å²	28	69.7 Å²	69.7	13%	0.131	35%	0.348	C	S	.	.	H	α-helix	trans	-57.4	-58.3	167.6	-68.9	177.1	16.3	0	0	109.3	Q590 D592 V593 R594 E598 N599 L600 S681	Q590-Q596 WeakPolarHBondContact O-CG 3.44Å; Q590-Q596 PolarHBondContact O-NE2 3.33Å; D592-Q596 WeakPolarHBondContact O-CG 3.36Å; D592-Q596 PolarHBondContact O-N 2.96Å; V593-Q596 WeakPolarHBondContact O-CB 3.33Å; V593-Q596 PolarHBondContact O-N 3.41Å; R594-Q596 VanDerWaalsContact C-N 3.3Å; R594-Q596 PolarHBondContact O-N 2.88Å; Q596-E598 PolarHBondContact O-N 2.65Å; Q596-E598 VanDerWaalsContact O-N 3.13Å; Q596-N599 PolarHBondContact O-N 3.17Å; Q596-L600 HydrophobicContact CB-CD1 4.19Å; Q596-L600 WeakPolarHBondContact O-CB 3.35Å; Q596-L600 VanDerWaalsContact O-CD1 3.29Å; Q596-L600 WeakPolarHBondContact O-CD1 3.29Å; Q596-L600 WeakPolarHBondContact O-CG 3.46Å; Q596-L600 PolarHBondContact O-N 3.05Å; Q596-L600 VanDerWaalsContact O-N 3.07Å; Q596-S681 PolarHBondContact OE1-OG 2.79Å
597	M	63.3	Low	67	Low	146 Å²	146	71.7 Å²	71.7	72%	0.719	36%	0.362	S	S	*	.	H	α-helix	trans	-54.2	-39.3	-179.6	-69.4	-173.8	72.2	0	0	113.7	V593 R594	V593-M597 WeakPolarHBondContact O-CG 3.41Å; V593-M597 PolarHBondContact O-N 3.15Å; R594-M597 PolarHBondContact O-N 3.23Å
598	E	64.5	Low	66	Low	88 Å²	88	74 Å²	74	41%	0.411	37%	0.374	S	S	.	.	H	α-helix	trans	-70.8	-34.6	178.4	-70.7	179.2	-169.4	0	0	113.3	R594 T595 Q596 R629	R594-E598 IonicContact NE-OE1 3.78Å; R594-E598 WeakPolarHBondContact O-CG 3.37Å; R594-E598 PolarHBondContact O-N 2.88Å; T595-E598 PolarHBondContact O-N 3.48Å; Q596-E598 PolarHBondContact O-N 2.65Å; Q596-E598 VanDerWaalsContact O-N 3.13Å; E598-R629 WeakPolarHBondContact O-CD 3.34Å; E598-R629 PolarHBondContact O-NE 2.91Å; E598-R629 PolarHBondContact O-NH1 3.46Å; E598-R629 PolarHBondContact O-NH2 3.45Å
599	N	62.4	Low	64.9	Low	26 Å²	26	76.1 Å²	76.1	14%	0.139	38%	0.384	C	S	.	.	H	α-helix	trans	-82.5	-23.3	-176.3	-75	-37.1	0	0	0	113.9	Q590 T595 Q596 L601 R629	Q590-N599 PolarHBondContact NE2-ND2 3.22Å; T595-N599 VanDerWaalsContact O-CB 3.24Å; T595-N599 WeakPolarHBondContact O-CB 3.44Å; T595-N599 PolarHBondContact O-N 3.49Å; T595-N599 PolarHBondContact O-ND2 2.98Å; Q596-N599 PolarHBondContact O-N 3.17Å; N599-L601 VanDerWaalsContact C-N 3.34Å; N599-L601 PolarHBondContact O-N 3.06Å; N599-R629 WeakPolarHBondContact OD1-CB 3.25Å
600	L	62.4	Low	63.9	Low	39 Å²	39	77.1 Å²	77.1	20%	0.204	39%	0.387	C	S	.	.			trans	-78.1	78.5	-177.1	-63.2	166.7	0	0	0	109.4	Q596 Y603 L683	Q596-L600 HydrophobicContact CB-CD1 4.19Å; Q596-L600 WeakPolarHBondContact O-CB 3.35Å; Q596-L600 VanDerWaalsContact O-CD1 3.29Å; Q596-L600 WeakPolarHBondContact O-CD1 3.29Å; Q596-L600 WeakPolarHBondContact O-CG 3.46Å; Q596-L600 PolarHBondContact O-N 3.05Å; Q596-L600 VanDerWaalsContact O-N 3.07Å; L600-Y603 WeakPolarHBondContact CA-OH 3.28Å; L600-Y603 HydrophobicContact CB-CE2 3.57Å; L600-Y603 VanDerWaalsContact CB-OH 3.29Å; L600-Y603 WeakPolarHBondContact CB-OH 3.32Å; L600-Y603 HydrophobicContact CD2-CE2 4.45Å; L600-Y603 WeakPolarHBondContact CD2-OH 3.32Å; L600-Y603 HydrophobicContact CG-CE2 4.46Å; L600-Y603 WeakPolarHBondContact CG-OH 3.46Å; L600-L683 HydrophobicContact CD1-CD2 3.68Å; L600-L683 HydrophobicContact CD1-CG 4.46Å; L600-L683 HydrophobicContact CD2-CD2 4.06Å; L600-L683 HydrophobicContact CD2-CG 3.99Å; L600-L683 HydrophobicContact CG-CD2 4.48Å
601	L	61.2	Low	63.2	Low	81 Å²	81	84.7 Å²	84.7	42%	0.424	43%	0.428	S	S	.	.			trans	-72.6	-46.6	-167.6	-76.9	147.7	0	0	0	115.9	N599 L627 R629	N599-L601 VanDerWaalsContact C-N 3.34Å; N599-L601 PolarHBondContact O-N 3.06Å; L601-L627 WeakPolarHBondContact CD1-O 3.43Å; L601-R629 HydrophobicContact CD1-CB 4.4Å; L601-R629 HydrophobicContact CD1-CG 3.54Å; L601-R629 HydrophobicContact CD2-CG 3.98Å; L601-R629 HydrophobicContact CG-CG 3.84Å
602	R	68.2	Low	62.8	Low	162 Å²	162	90.3 Å²	90.3	61%	0.611	45%	0.449	S	S	*	.			trans	-151.6	130.8	-176.8	-73.3	-170.4	179.8	-175.2	-0.8	112.6	C625	R602-C625 HydrophobicContact CB-CB 4.44Å; R602-C625 PolarHBondContact O-N 3.36Å; R602-C625 VanDerWaalsContact O-N 3.13Å
603	Y	72.9	Confident	62	Low	56 Å²	56	89.4 Å²	89.4	22%	0.22	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	146.1	174.3	-62.7	-87.3	0	0	0	111	L600 L622 I623 P624 L683 Q687	L600-Y603 WeakPolarHBondContact CA-OH 3.28Å; L600-Y603 HydrophobicContact CB-CE2 3.57Å; L600-Y603 VanDerWaalsContact CB-OH 3.29Å; L600-Y603 WeakPolarHBondContact CB-OH 3.32Å; L600-Y603 HydrophobicContact CD2-CE2 4.45Å; L600-Y603 WeakPolarHBondContact CD2-OH 3.32Å; L600-Y603 HydrophobicContact CG-CE2 4.46Å; L600-Y603 WeakPolarHBondContact CG-OH 3.46Å; Y603-L622 HydrophobicContact CD1-CB 3.76Å; Y603-L622 HydrophobicContact CG-CB 4.05Å; Y603-L622 HydrophobicContact CG-CD2 4.27Å; Y603-I623 CarbonylContact C-O 3.6Å; Y603-I623 VanDerWaalsContact CA-O 3.29Å; Y603-I623 WeakPolarHBondContact CA-O 3.24Å; Y603-P624 HydrophobicContact CD1-CG 4.44Å; Y603-P624 HydrophobicContact CE1-CB 4.4Å; Y603-P624 HydrophobicContact CE1-CG 3.92Å; Y603-L683 HydrophobicContact CD1-CD1 4.11Å; Y603-L683 HydrophobicContact CE1-CD1 3.54Å; Y603-L683 HydrophobicContact CE1-CG 4.43Å; Y603-Q687 PolarHBondContact OH-OE1 2.94Å
604	E	73	Confident	61.3	Low	54 Å²	54	89.2 Å²	89.2	25%	0.252	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.3	159.6	-175.6	-179.7	-177.8	0	0	107.1	V606 I623 C625 R733	E604-V606 HydrophobicContact CG-CG2 4.41Å; E604-I623 HydrophobicContact CB-CB 4.49Å; E604-I623 PolarHBondContact N-O 3.21Å; E604-I623 PolarHBondContact O-N 2.88Å; E604-C625 PolarHBondContact N-SG 3.32Å; E604-R733 IonicContact OE1-CZ 3.62Å; E604-R733 IonicContact OE1-NH1 2.76Å; E604-R733 PolarHBondContact OE1-NH1 2.81Å
605	S	68.5	Low	60.4	Low	78 Å²	78	90.6 Å²	90.6	55%	0.545	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	114.9	173.4	60.1	0	0	0	0	109.4	M621	S605-M621 CarbonylContact C-O 3.58Å; S605-M621 WeakPolarHBondContact CA-O 3.5Å
606	V	64.8	Low	59.8	Low	37 Å²	37	96.4 Å²	96.4	22%	0.224	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	117.7	173.7	-177.7	0	0	0	0	108	E604 K620 M621 I623	E604-V606 HydrophobicContact CG-CG2 4.41Å; V606-K620 WeakPolarHBondContact O-CA 3.35Å; V606-M621 HydrophobicContact CB-CB 4.44Å; V606-M621 HydrophobicContact CB-CE 4.3Å; V606-M621 PolarHBondContact N-O 3.28Å; V606-M621 PolarHBondContact O-N 3.31Å; V606-I623 HydrophobicContact CG2-CD1 3.86Å; V606-I623 HydrophobicContact CG2-CG1 4.37Å
607	T	64	Low	58.7	Low	79 Å²	79	97.9 Å²	97.9	49%	0.485	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115.7	170.1	46.7	0	0	0	0	108.6	S619 K620	T607-S619 WeakPolarHBondContact CA-O 3.37Å; T607-K620 HydrophobicContact CG2-CG 4.07Å
608	I	60.2	Low	57.7	Low	51 Å²	51	94.7 Å²	94.7	26%	0.262	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	122.2	168.9	-50.7	165.3	0	0	0	106.2	S619 L729	I608-S619 PolarHBondContact N-O 3.23Å; I608-L729 HydrophobicContact CD1-CD2 3.23Å; I608-L729 HydrophobicContact CG1-CD2 3.78Å
609	E	54.9	Low	57.3	Low	161 Å²	161	93 Å²	93	75%	0.752	50%	0.504	S	S	*	.			trans	-83.1	113.4	168.9	-68.5	-174.9	169.7	0	0	107.7	D611	E609-D611 PolarHBondContact O-N 3.3Å
610	D	53.8	Low	57.4	Low	88 Å²	88	98.9 Å²	98.9	47%	0.471	53%	0.528	S	S	.	.			trans	-70.1	110.2	166.7	-85.3	-24.2	0	0	0	108.1	Q612	D610-Q612 PolarHBondContact O-N 2.92Å
611	D	52.1	Low	57.9	Low	161 Å²	161	98 Å²	98	86%	0.861	52%	0.523	S	S	*	.	S	Bend	trans	-61.6	-8.8	172.8	-75.5	-23.8	0	0	0	112.7	E609 G613	E609-D611 PolarHBondContact O-N 3.3Å; D611-G613 PolarHBondContact O-N 3.46Å
612	Q	51.8	Low	58.5	Low	170 Å²	170	97.8 Å²	97.8	79%	0.794	52%	0.522	S	S	*	.	S	Bend	trans	-79.8	48.8	179	-61.3	-169	20.6	0	0	113.6	D610 V614	D610-Q612 PolarHBondContact O-N 2.92Å; Q612-V614 PolarHBondContact O-N 2.91Å
613	G	49.3	Very low	59.1	Low	71 Å²	71	90.1 Å²	90.1	73%	0.732	49%	0.493	S	S	*	.	S	Bend	trans	57.5	-5.7	155.4	0	0	0	0	0	119.8	D611 K615	D611-G613 PolarHBondContact O-N 3.46Å; G613-K615 PolarHBondContact O-N 3.42Å
614	V	47.6	Very low	59.6	Low	96 Å²	96	87.4 Å²	87.4	58%	0.582	48%	0.482	S	S	*	.			trans	-89.7	96.3	177.8	-178.8	0	0	0	0	106.6	Q612 N616 S617	Q612-V614 PolarHBondContact O-N 2.91Å; V614-N616 PolarHBondContact O-N 2.89Å; V614-S617 PolarHBondContact O-N 3.46Å
615	K	49.1	Very low	59.9	Low	203 Å²	203	86.5 Å²	86.5	88%	0.883	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-0.2	-173.5	-77	-175.7	171.6	-178.1	0	117.3	G613	G613-K615 PolarHBondContact O-N 3.42Å
616	N	47.9	Very low	60.7	Low	150 Å²	150	83.5 Å²	83.5	80%	0.802	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.1	8.8	-171.3	-71.1	-8.7	0	0	0	115.8	V614	V614-N616 PolarHBondContact O-N 2.89Å
617	S	40.3	Very low	61.7	Low	58 Å²	58	81.9 Å²	81.9	41%	0.406	45%	0.45	S	S	.	.			trans	-103.9	45.9	-179.3	-44.5	0	0	0	0	113.1	V614 S619	V614-S617 PolarHBondContact O-N 3.46Å; S617-S619 PolarHBondContact O-N 3.46Å
618	S	42.9	Very low	62.8	Low	79 Å²	79	78.1 Å²	78.1	55%	0.552	43%	0.428	S	S	*	.			trans	-71.3	99.6	171.4	53.9	0	0	0	0	109.5	K620	S618-K620 PolarHBondContact O-N 3.48Å
619	S	55.2	Low	64	Low	54 Å²	54	80.4 Å²	80.4	38%	0.378	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	123.2	178.2	51.6	0	0	0	0	109.2	T607 I608 S617	T607-S619 WeakPolarHBondContact CA-O 3.37Å; I608-S619 PolarHBondContact N-O 3.23Å; S617-S619 PolarHBondContact O-N 3.46Å
620	K	66	Low	65.5	Low	149 Å²	149	73 Å²	73	65%	0.648	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	103.1	176.7	-71.6	-178.1	-178.7	179.1	0	109	V606 T607 S618	V606-K620 WeakPolarHBondContact O-CA 3.35Å; T607-K620 HydrophobicContact CG2-CG 4.07Å; S618-K620 PolarHBondContact O-N 3.48Å
621	M	71.8	Confident	67.2	Low	21 Å²	21	68.9 Å²	68.9	10%	0.103	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	133.3	172.6	-169.6	177.1	64.9	0	0	109.8	S605 V606 I623 L729 M730	S605-M621 CarbonylContact C-O 3.58Å; S605-M621 WeakPolarHBondContact CA-O 3.5Å; V606-M621 HydrophobicContact CB-CB 4.44Å; V606-M621 HydrophobicContact CB-CE 4.3Å; V606-M621 PolarHBondContact N-O 3.28Å; V606-M621 PolarHBondContact O-N 3.31Å; M621-I623 HydrophobicContact CE-CD1 3.74Å; M621-I623 HydrophobicContact CE-CG1 4Å; M621-L729 HydrophobicContact CE-CB 4.28Å; M621-L729 HydrophobicContact CE-CD2 3.61Å; M621-L729 HydrophobicContact CE-CG 3.65Å; M621-L729 HydrophobicContact SD-CB 4.33Å; M621-L729 HydrophobicContact SD-CD2 3.72Å; M621-L729 HydrophobicContact SD-CG 4.14Å; M621-M730 HydrophobicContact CE-CG 3.62Å; M621-M730 HydrophobicContact CG-CE 4.37Å; M621-M730 HydrophobicContact CG-CG 4.18Å; M621-M730 HydrophobicContact CG-SD 4.39Å; M621-M730 HydrophobicContact SD-CG 3.28Å; M621-M730 WeakPolarHBondContact SD-CG 3.49Å; M621-M730 HydrophobicContact SD-SD 4.04Å
622	L	75	Confident	69	Low	76 Å²	76	65 Å²	65	40%	0.398	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	114.8	-177.7	-67	170	0	0	0	110.1	Y603 L683 M730	Y603-L622 HydrophobicContact CD1-CB 3.76Å; Y603-L622 HydrophobicContact CG-CB 4.05Å; Y603-L622 HydrophobicContact CG-CD2 4.27Å; L622-L683 HydrophobicContact CB-CD1 4.08Å; L622-M730 WeakPolarHBondContact O-CE 3.32Å
623	I	80.1	Confident	70.8	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.7	178.8	-50.1	-176.5	0	0	0	110.1	Y603 E604 V606 M621 C625 M730 R733 L734	Y603-I623 CarbonylContact C-O 3.6Å; Y603-I623 VanDerWaalsContact CA-O 3.29Å; Y603-I623 WeakPolarHBondContact CA-O 3.24Å; E604-I623 HydrophobicContact CB-CB 4.49Å; E604-I623 PolarHBondContact N-O 3.21Å; E604-I623 PolarHBondContact O-N 2.88Å; V606-I623 HydrophobicContact CG2-CD1 3.86Å; V606-I623 HydrophobicContact CG2-CG1 4.37Å; M621-I623 HydrophobicContact CE-CD1 3.74Å; M621-I623 HydrophobicContact CE-CG1 4Å; I623-C625 PolarHBondContact O-N 2.71Å; I623-M730 HydrophobicContact CB-CE 4.41Å; I623-M730 HydrophobicContact CG1-CE 3.97Å; I623-M730 HydrophobicContact CG1-CG 4.34Å; I623-R733 HydrophobicContact CD1-CB 3.48Å; I623-R733 VanDerWaalsContact CD1-CB 3.48Å; I623-R733 HydrophobicContact CD1-CG 3.86Å; I623-R733 HydrophobicContact CG2-CB 4.35Å; I623-L734 HydrophobicContact CG2-CD1 4.2Å
624	P	82.9	Confident	72.8	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	135.2	173.9	-28.6	35.2	0	0	0	113.5	Y603 V686 Q687 F690 N737	Y603-P624 HydrophobicContact CD1-CG 4.44Å; Y603-P624 HydrophobicContact CE1-CB 4.4Å; Y603-P624 HydrophobicContact CE1-CG 3.92Å; P624-V686 HydrophobicContact CG-CG1 3.81Å; P624-Q687 VanDerWaalsContact CB-OE1 3.3Å; P624-Q687 HydrophobicContact CG-CB 4.43Å; P624-F690 HydrophobicContact CB-CB 3.92Å; P624-F690 HydrophobicContact CB-CD1 4.17Å; P624-F690 HydrophobicContact CB-CD2 4.12Å; P624-F690 HydrophobicContact CB-CG 3.8Å; P624-F690 HydrophobicContact CG-CB 4.28Å; P624-N737 PolarHBondContact O-ND2 3.11Å
625	C	80.6	Confident	74.9	Confident	35 Å²	35	56 Å²	56	24%	0.236	28%	0.278	C	S	.	.			trans	-118.1	-11.6	175	-63.5	0	0	0	0	113.5	R602 E604 I623 N737	R602-C625 HydrophobicContact CB-CB 4.44Å; R602-C625 PolarHBondContact O-N 3.36Å; R602-C625 VanDerWaalsContact O-N 3.13Å; E604-C625 PolarHBondContact N-SG 3.32Å; I623-C625 PolarHBondContact O-N 2.71Å; C625-N737 PolarHBondContact SG-ND2 3.33Å; C625-N737 VanDerWaalsContact SG-ND2 3.4Å
626	S	84.3	Confident	76.9	Confident	14 Å²	14	51 Å²	51	10%	0.098	26%	0.258	C	S	.	.	S	Bend	trans	-138.6	151.4	-175.9	59.2	0	0	0	0	110.7	Q687 F690	S626-Q687 PolarHBondContact O-NE2 2.79Å; S626-F690 WeakPolarHBondContact O-CE1 3.35Å
627	L	86.9	Confident	78.9	Confident	3 Å²	3	48 Å²	48	2%	0.016	24%	0.235	C	C	.	.			trans	-56.2	146.8	170.5	-79	-178.7	0	0	0	110.3	L601 A631 F632 L635 D691 V694 Q741 L745	L601-L627 WeakPolarHBondContact CD1-O 3.43Å; L627-A631 HydrophobicContact CB-CB 4.37Å; L627-A631 HydrophobicContact CD2-CB 4.08Å; L627-F632 HydrophobicContact CB-CB 4.35Å; L627-L635 HydrophobicContact CD1-CD1 3.61Å; L627-D691 WeakPolarHBondContact CA-OD1 3.26Å; L627-D691 HydrophobicContact CD2-CB 4.16Å; L627-D691 WeakPolarHBondContact CD2-OD1 3.41Å; L627-V694 HydrophobicContact CD1-CG1 4.11Å; L627-V694 HydrophobicContact CD2-CB 3.74Å; L627-V694 HydrophobicContact CD2-CG1 3.71Å; L627-V694 HydrophobicContact CD2-CG2 4.3Å; L627-V694 HydrophobicContact CG-CB 4.49Å; L627-V694 HydrophobicContact CG-CG1 3.98Å; L627-Q741 HydrophobicContact CG-CG 4.44Å; L627-L745 HydrophobicContact CD1-CD1 3.28Å; L627-L745 HydrophobicContact CG-CD1 3.85Å
628	S	87.1	Confident	81.3	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.007	22%	0.216	C	C	.	.			trans	-60.1	157.6	168.1	63.9	0	0	0	0	110.9	W630 A631 F632 Q687 D691	S628-W630 VanDerWaalsContact C-N 3.27Å; S628-W630 PolarHBondContact O-N 3Å; S628-W630 PolarHBondContact OG-NE1 3.01Å; S628-A631 PolarHBondContact O-N 3.26Å; S628-A631 WeakPolarHBondContact OG-CB 3.22Å; S628-A631 PolarHBondContact OG-N 3.16Å; S628-F632 PolarHBondContact O-N 3.36Å; S628-Q687 VanDerWaalsContact N-NE2 3.18Å; S628-D691 WeakPolarHBondContact CB-OD2 3.41Å; S628-D691 PolarHBondContact N-OD1 2.93Å; S628-D691 PolarHBondContact OG-OD2 2.77Å
629	R	84.8	Confident	83.4	Confident	98 Å²	98	42.6 Å²	42.6	37%	0.37	20%	0.198	S	C	.	.	H	α-helix	trans	-57.8	-41.4	-179.3	-68.3	-178.6	174.9	-177.2	3.9	112	E598 N599 L601 R633	E598-R629 WeakPolarHBondContact O-CD 3.34Å; E598-R629 PolarHBondContact O-NE 2.91Å; E598-R629 PolarHBondContact O-NH1 3.46Å; E598-R629 PolarHBondContact O-NH2 3.45Å; N599-R629 WeakPolarHBondContact OD1-CB 3.25Å; L601-R629 HydrophobicContact CD1-CB 4.4Å; L601-R629 HydrophobicContact CD1-CG 3.54Å; L601-R629 HydrophobicContact CD2-CG 3.98Å; L601-R629 HydrophobicContact CG-CG 3.84Å; R629-R633 VanDerWaalsContact O-CB 3.25Å; R629-R633 WeakPolarHBondContact O-CB 3.41Å; R629-R633 WeakPolarHBondContact O-CG 3.38Å; R629-R633 PolarHBondContact O-N 2.91Å
630	W	86.8	Confident	85	Confident	7 Å²	7	46.6 Å²	46.6	3%	0.027	20%	0.204	C	C	.	.	H	α-helix	trans	-67	-42	179.7	74.1	-98.4	0	0	0	111.4	N586 L587 S628 F632 R633 L634 V666 L688 D691 L695	N586-W630 HydrophobicContact CB-CB 3.87Å; N586-W630 HydrophobicContact CB-CG 4.36Å; L587-W630 HydrophobicContact CD1-CH2 4.46Å; L587-W630 HydrophobicContact CD2-CZ2 3.93Å; L587-W630 HydrophobicContact CG-CZ2 4.43Å; S628-W630 VanDerWaalsContact C-N 3.27Å; S628-W630 PolarHBondContact O-N 3Å; S628-W630 PolarHBondContact OG-NE1 3.01Å; W630-F632 PolarHBondContact O-N 3.27Å; W630-R633 PolarHBondContact O-N 2.83Å; W630-L634 HydrophobicContact CZ3-CD2 4.15Å; W630-L634 WeakPolarHBondContact O-CB 3.37Å; W630-L634 PolarHBondContact O-N 2.97Å; W630-V666 HydrophobicContact CH2-CG1 4.02Å; W630-V666 HydrophobicContact CZ3-CG1 4.5Å; W630-V666 HydrophobicContact CZ3-CG2 4.23Å; W630-L688 HydrophobicContact CZ2-CD2 4.01Å; W630-D691 HydrophobicContact CZ2-CB 4.49Å; W630-L695 HydrophobicContact CH2-CD1 4.37Å
631	A	89.5	Confident	86	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.5	-38.6	179.2	0	0	0	0	0	111.7	L627 S628 L634 L635 D691 L695	L627-A631 HydrophobicContact CB-CB 4.37Å; L627-A631 HydrophobicContact CD2-CB 4.08Å; S628-A631 PolarHBondContact O-N 3.26Å; S628-A631 WeakPolarHBondContact OG-CB 3.22Å; S628-A631 PolarHBondContact OG-N 3.16Å; A631-L634 WeakPolarHBondContact O-CB 3.36Å; A631-L634 PolarHBondContact O-N 3.03Å; A631-L635 PolarHBondContact O-N 3.15Å; A631-D691 HydrophobicContact CB-CB 4.27Å; A631-L695 HydrophobicContact CB-CD1 4.37Å
632	F	89.7	Confident	86.6	Confident	79 Å²	79	39.7 Å²	39.7	35%	0.346	18%	0.175	S	C	.	.	H	α-helix	trans	-66.4	-43.1	172.4	-174	-90.2	0	0	0	111.9	L627 S628 W630 L634 L635 H636 L745 F749	L627-F632 HydrophobicContact CB-CB 4.35Å; S628-F632 PolarHBondContact O-N 3.36Å; W630-F632 PolarHBondContact O-N 3.27Å; F632-L634 VanDerWaalsContact C-N 3.3Å; F632-L634 PolarHBondContact O-N 3.26Å; F632-L635 PolarHBondContact O-N 2.67Å; F632-H636 WeakPolarHBondContact O-CB 3.5Å; F632-H636 PolarHBondContact O-N 3.39Å; F632-L745 HydrophobicContact CD2-CD2 3.97Å; F632-L745 HydrophobicContact CE2-CD2 3.8Å; F632-F749 HydrophobicContact CD2-CE2 4.41Å; F632-F749 HydrophobicContact CE2-CE2 4.04Å; F632-F749 HydrophobicContact CE2-CZ 4.06Å; F632-F749 HydrophobicContact CZ-CZ 4.1Å
633	R	89.2	Confident	86.9	Confident	142 Å²	142	37.7 Å²	37.7	54%	0.536	17%	0.169	S	C	.	.	H	α-helix	trans	-60.9	-39.3	175.4	-79.9	177.1	-176.7	-177.4	1.8	111.7	R629 W630 H636 R637	R629-R633 VanDerWaalsContact O-CB 3.25Å; R629-R633 WeakPolarHBondContact O-CB 3.41Å; R629-R633 WeakPolarHBondContact O-CG 3.38Å; R629-R633 PolarHBondContact O-N 2.91Å; W630-R633 PolarHBondContact O-N 2.83Å; R633-H636 PolarHBondContact O-N 3.42Å; R633-R637 WeakPolarHBondContact O-CB 3.35Å; R633-R637 PolarHBondContact O-N 3.49Å
634	L	91.5	Very high	87	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-57.6	-54	174.3	171.3	63.1	0	0	0	111	V579 V583 W630 A631 F632 H636 R637 M638 V666	V579-L634 HydrophobicContact CG1-CD1 3.24Å; V583-L634 HydrophobicContact CG2-CD1 3.88Å; V583-L634 HydrophobicContact CG2-CD2 4Å; V583-L634 HydrophobicContact CG2-CG 4.49Å; W630-L634 HydrophobicContact CZ3-CD2 4.15Å; W630-L634 WeakPolarHBondContact O-CB 3.37Å; W630-L634 PolarHBondContact O-N 2.97Å; A631-L634 WeakPolarHBondContact O-CB 3.36Å; A631-L634 PolarHBondContact O-N 3.03Å; F632-L634 VanDerWaalsContact C-N 3.3Å; F632-L634 PolarHBondContact O-N 3.26Å; L634-H636 PolarHBondContact O-N 3.39Å; L634-R637 PolarHBondContact O-N 2.93Å; L634-M638 HydrophobicContact CD1-CG 4.17Å; L634-M638 HydrophobicContact CD1-SD 3.98Å; L634-M638 HydrophobicContact CG-SD 4.23Å; L634-M638 WeakPolarHBondContact O-CG 3.48Å; L634-M638 PolarHBondContact O-N 2.86Å; L634-V666 HydrophobicContact CD2-CG2 3.64Å
635	L	91.5	Very high	87.1	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-59.8	-45.6	177.9	-69	177.9	0	0	0	111.9	L627 A631 F632 R637 M638 S639 L695 L698 L699 L745 F749	L627-L635 HydrophobicContact CD1-CD1 3.61Å; A631-L635 PolarHBondContact O-N 3.15Å; F632-L635 PolarHBondContact O-N 2.67Å; L635-R637 VanDerWaalsContact C-N 3.35Å; L635-R637 PolarHBondContact O-N 2.79Å; L635-M638 PolarHBondContact O-N 2.84Å; L635-S639 VanDerWaalsContact O-CB 3.3Å; L635-S639 WeakPolarHBondContact O-CB 3.47Å; L635-S639 PolarHBondContact O-N 3.46Å; L635-L695 HydrophobicContact CD1-CD2 4.04Å; L635-L695 HydrophobicContact CD2-CD2 3.76Å; L635-L695 HydrophobicContact CG-CD2 3.86Å; L635-L698 HydrophobicContact CD1-CD1 3.85Å; L635-L699 HydrophobicContact CD2-CD1 4.05Å; L635-L699 HydrophobicContact CD2-CD2 3.94Å; L635-L699 HydrophobicContact CD2-CG 4.21Å; L635-L745 HydrophobicContact CD1-CD1 4.32Å; L635-F749 HydrophobicContact CB-CD2 3.79Å; L635-F749 HydrophobicContact CB-CE1 4.41Å; L635-F749 HydrophobicContact CB-CE2 3.58Å; L635-F749 HydrophobicContact CB-CG 4.26Å; L635-F749 HydrophobicContact CB-CZ 3.92Å; L635-F749 HydrophobicContact CD1-CD2 3.95Å; L635-F749 HydrophobicContact CD1-CE2 3.99Å; L635-F749 HydrophobicContact CG-CD2 4.43Å; L635-F749 HydrophobicContact CG-CE2 4.45Å
636	H	91.2	Very high	87.2	Confident	98 Å²	98	36.7 Å²	36.7	45%	0.454	16%	0.163	S	C	.	.	H	α-helix	trans	-61.2	-42.8	176.6	177.6	-96.7	0	0	0	112.2	F632 R633 L634 S639 R640 F749	F632-H636 WeakPolarHBondContact O-CB 3.5Å; F632-H636 PolarHBondContact O-N 3.39Å; R633-H636 PolarHBondContact O-N 3.42Å; L634-H636 PolarHBondContact O-N 3.39Å; H636-S639 PolarHBondContact O-N 3.5Å; H636-R640 WeakPolarHBondContact O-CB 3.19Å; H636-R640 PolarHBondContact O-N 3.05Å; H636-F749 HydrophobicContact CB-CE1 4.15Å; H636-F749 HydrophobicContact CB-CZ 4.12Å
637	R	90.4	Very high	87.2	Confident	86 Å²	86	36.5 Å²	36.5	33%	0.325	16%	0.161	S	C	.	.	H	α-helix	trans	-64.5	-48.7	179.5	176.9	59.2	-175	-127.1	5.3	111.1	R633 L634 L635 S639 R640 I641	R633-R637 WeakPolarHBondContact O-CB 3.35Å; R633-R637 PolarHBondContact O-N 3.49Å; L634-R637 PolarHBondContact O-N 2.93Å; L635-R637 VanDerWaalsContact C-N 3.35Å; L635-R637 PolarHBondContact O-N 2.79Å; R637-S639 VanDerWaalsContact C-N 3.28Å; R637-S639 PolarHBondContact O-N 2.75Å; R637-R640 PolarHBondContact O-N 3.42Å; R637-I641 HydrophobicContact CG-CD1 4.04Å; R637-I641 WeakPolarHBondContact O-CG1 3.39Å; R637-I641 PolarHBondContact O-N 3.19Å
638	M	90.1	Very high	87	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-58.8	-44.1	174.6	-67.2	176.4	68.6	0	0	110.4	V579 L634 L635 R640 I641 G642 L658 A662 I752	V579-M638 HydrophobicContact CG2-CG 4.45Å; L634-M638 HydrophobicContact CD1-CG 4.17Å; L634-M638 HydrophobicContact CD1-SD 3.98Å; L634-M638 HydrophobicContact CG-SD 4.23Å; L634-M638 WeakPolarHBondContact O-CG 3.48Å; L634-M638 PolarHBondContact O-N 2.86Å; L635-M638 PolarHBondContact O-N 2.84Å; M638-R640 VanDerWaalsContact C-N 3.34Å; M638-R640 PolarHBondContact O-N 3.47Å; M638-I641 PolarHBondContact O-N 3.11Å; M638-G642 PolarHBondContact O-N 2.94Å; M638-L658 HydrophobicContact CE-CG 4.16Å; M638-A662 HydrophobicContact CE-CB 3.51Å; M638-A662 HydrophobicContact SD-CB 3.63Å; M638-I752 HydrophobicContact CB-CD1 3.55Å; M638-I752 HydrophobicContact CE-CG2 4.14Å
639	S	87.9	Confident	86.9	Confident	23 Å²	23	42.4 Å²	42.4	16%	0.161	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-41.1	-179.6	-168.9	0	0	0	0	112	L635 H636 R637 G642 A643	L635-S639 VanDerWaalsContact O-CB 3.3Å; L635-S639 WeakPolarHBondContact O-CB 3.47Å; L635-S639 PolarHBondContact O-N 3.46Å; H636-S639 PolarHBondContact O-N 3.5Å; R637-S639 VanDerWaalsContact C-N 3.28Å; R637-S639 PolarHBondContact O-N 2.75Å; S639-G642 PolarHBondContact O-N 2.61Å; S639-A643 WeakPolarHBondContact O-CB 3.09Å; S639-A643 PolarHBondContact O-N 3.4Å
640	R	87.3	Confident	87.1	Confident	137 Å²	137	38.1 Å²	38.1	52%	0.517	18%	0.175	S	C	.	.	H	α-helix	trans	-67.2	-44.1	177.2	-170.5	-177.6	65.2	170.1	2.2	111.6	H636 R637 M638 A643 A644	H636-R640 WeakPolarHBondContact O-CB 3.19Å; H636-R640 PolarHBondContact O-N 3.05Å; R637-R640 PolarHBondContact O-N 3.42Å; M638-R640 VanDerWaalsContact C-N 3.34Å; M638-R640 PolarHBondContact O-N 3.47Å; R640-A643 PolarHBondContact O-N 2.92Å; R640-A644 WeakPolarHBondContact O-CB 3.27Å; R640-A644 PolarHBondContact O-N 3.32Å
641	I	86.7	Confident	87.3	Confident	26 Å²	26	39.3 Å²	39.3	13%	0.133	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-42.7	176	-71.8	167.7	0	0	0	110.9	W571 V575 R637 M638 A644 V645	W571-I641 HydrophobicContact CH2-CG2 4.39Å; W571-I641 HydrophobicContact CZ2-CG2 3.54Å; V575-I641 HydrophobicContact CG1-CD1 4.13Å; V575-I641 HydrophobicContact CG1-CG2 4Å; V575-I641 HydrophobicContact CG2-CG2 3.88Å; R637-I641 HydrophobicContact CG-CD1 4.04Å; R637-I641 WeakPolarHBondContact O-CG1 3.39Å; R637-I641 PolarHBondContact O-N 3.19Å; M638-I641 PolarHBondContact O-N 3.11Å; I641-A644 WeakPolarHBondContact O-CB 3.46Å; I641-A644 PolarHBondContact O-N 2.9Å; I641-V645 PolarHBondContact O-N 3.47Å
642	G	84.9	Confident	87.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-43.4	175.5	0	0	0	0	0	112.3	M638 S639 V645 G646 I647	M638-G642 PolarHBondContact O-N 2.94Å; S639-G642 PolarHBondContact O-N 2.61Å; G642-V645 PolarHBondContact O-N 2.89Å; G642-G646 PolarHBondContact O-N 3.2Å; G642-G646 VanDerWaalsContact O-N 3.09Å; G642-I647 VanDerWaalsContact O-CB 3.31Å; G642-I647 WeakPolarHBondContact O-CB 3.37Å; G642-I647 PolarHBondContact O-N 2.84Å
643	A	82.2	Confident	87.2	Confident	34 Å²	34	50.5 Å²	50.5	28%	0.281	23%	0.228	S	C	.	.	H	α-helix	trans	-59.2	-47.9	175.2	0	0	0	0	0	111	L432 S639 R640 V645 G646	L432-A643 VanDerWaalsContact CD1-C 3.5Å; L432-A643 HydrophobicContact CD1-CB 3.69Å; L432-A643 WeakPolarHBondContact CD1-O 3.31Å; L432-A643 WeakPolarHBondContact CG-O 3.28Å; S639-A643 WeakPolarHBondContact O-CB 3.09Å; S639-A643 PolarHBondContact O-N 3.4Å; R640-A643 PolarHBondContact O-N 2.92Å; A643-V645 PolarHBondContact O-N 3.32Å; A643-V645 VanDerWaalsContact O-N 3.11Å; A643-G646 PolarHBondContact O-N 3.46Å
644	A	82.9	Confident	87.3	Confident	14 Å²	14	43.9 Å²	43.9	12%	0.116	20%	0.202	C	C	.	.	H	α-helix	trans	-52.7	-35.8	177.6	0	0	0	0	0	113.9	L429 C431 R640 I641	L429-A644 HydrophobicContact CD2-CB 4.38Å; L429-A644 HydrophobicContact CG-CB 4.28Å; L429-A644 WeakPolarHBondContact O-CB 3.35Å; C431-A644 VanDerWaalsContact CB-O 3.22Å; C431-A644 WeakPolarHBondContact CB-O 3.14Å; C431-A644 PolarHBondContact N-O 3.02Å; C431-A644 PolarHBondContact SG-O 3.31Å; R640-A644 WeakPolarHBondContact O-CB 3.27Å; R640-A644 PolarHBondContact O-N 3.32Å; I641-A644 WeakPolarHBondContact O-CB 3.46Å; I641-A644 PolarHBondContact O-N 2.9Å
645	V	83.8	Confident	87.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-86.7	-13.7	176.7	172.7	0	0	0	0	113	L429 V523 K527 Y568 W571 I641 G642 A643 V650	L429-V645 HydrophobicContact CD1-CG2 4.25Å; L429-V645 HydrophobicContact CD2-CG2 3.7Å; L429-V645 HydrophobicContact CG-CG2 4.22Å; V523-V645 HydrophobicContact CG1-CB 4.37Å; V523-V645 HydrophobicContact CG1-CG1 3.63Å; V523-V645 HydrophobicContact CG1-CG2 4.12Å; V523-V645 HydrophobicContact CG2-CG1 4.24Å; V523-V645 HydrophobicContact CG2-CG2 3.99Å; K527-V645 WeakPolarHBondContact CE-O 3.4Å; K527-V645 PolarHBondContact NZ-O 2.88Å; Y568-V645 HydrophobicContact CE1-CG1 4.06Å; W571-V645 HydrophobicContact CH2-CB 4.36Å; W571-V645 HydrophobicContact CH2-CG2 4.23Å; W571-V645 HydrophobicContact CZ2-CB 4.06Å; W571-V645 HydrophobicContact CZ2-CG1 4.48Å; W571-V645 HydrophobicContact CZ2-CG2 3.46Å; W571-V645 VanDerWaalsContact CZ2-CG2 3.46Å; I641-V645 PolarHBondContact O-N 3.47Å; G642-V645 PolarHBondContact O-N 2.89Å; A643-V645 PolarHBondContact O-N 3.32Å; A643-V645 VanDerWaalsContact O-N 3.11Å; V645-V650 HydrophobicContact CG1-CG2 4.23Å
646	G	82.5	Confident	87.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	59.9	-167.9	0	0	0	0	0	111.8	G642 A643 H648 S649	G642-G646 PolarHBondContact O-N 3.2Å; G642-G646 VanDerWaalsContact O-N 3.09Å; A643-G646 PolarHBondContact O-N 3.46Å; G646-H648 PolarHBondContact O-N 3.43Å; G646-S649 PolarHBondContact O-N 3.48Å; G646-S649 PolarHBondContact O-OG 2.79Å
647	I	83.7	Confident	87.1	Confident	9 Å²	9	46.4 Å²	46.4	5%	0.046	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-52.6	-20.8	-174.6	-163.4	161.2	0	0	0	115.2	G642 S649 V650 V655 L658 A751 I752	G642-I647 VanDerWaalsContact O-CB 3.31Å; G642-I647 WeakPolarHBondContact O-CB 3.37Å; G642-I647 PolarHBondContact O-N 2.84Å; I647-S649 VanDerWaalsContact C-N 3.25Å; I647-S649 PolarHBondContact O-N 2.67Å; I647-V650 WeakPolarHBondContact O-CB 3.48Å; I647-V650 PolarHBondContact O-N 3.09Å; I647-V650 VanDerWaalsContact O-N 3.16Å; I647-V655 HydrophobicContact CD1-CG1 4.01Å; I647-V655 HydrophobicContact CD1-CG2 4.24Å; I647-V655 HydrophobicContact CG1-CG1 4.24Å; I647-V655 HydrophobicContact CG1-CG2 3.67Å; I647-L658 HydrophobicContact CD1-CD2 4.3Å; I647-A751 HydrophobicContact CG2-CB 3.62Å; I647-I752 HydrophobicContact CD1-CG1 4.21Å
648	H	83	Confident	87.1	Confident	112 Å²	112	42.5 Å²	42.5	52%	0.519	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-66	-25.7	175	58.4	-90.6	0	0	0	113.7	L451 S453 G646	L451-H648 PolarHBondContact O-CD2 3.47Å; L451-H648 PolarHBondContact O-NE2 2.91Å; S453-H648 PolarHBondContact OG-CE1 2.86Å; S453-H648 PolarHBondContact OG-NE2 2.72Å; S453-H648 VanDerWaalsContact OG-NE2 3.12Å; G646-H648 PolarHBondContact O-N 3.43Å
649	S	85.6	Confident	87.1	Confident	17 Å²	17	42.4 Å²	42.4	12%	0.119	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-85.5	-10.3	175.3	65.6	0	0	0	0	113.2	L452 K527 Q530 G646 I647	L452-S649 PolarHBondContact O-OG 3.25Å; K527-S649 PolarHBondContact NZ-OG 3.4Å; Q530-S649 PolarHBondContact NE2-O 2.88Å; Q530-S649 VanDerWaalsContact NE2-O 3.11Å; G646-S649 PolarHBondContact O-N 3.48Å; G646-S649 PolarHBondContact O-OG 2.79Å; I647-S649 VanDerWaalsContact C-N 3.25Å; I647-S649 PolarHBondContact O-N 2.67Å
650	V	89.5	Confident	87.3	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.042	20%	0.204	C	C	.	.	S	Bend	trans	-81.7	136	179.4	-179.7	0	0	0	0	108.9	Y568 V645 I647 R652 L654 V655	Y568-V650 HydrophobicContact CD1-CG1 4.39Å; Y568-V650 HydrophobicContact CD1-CG2 4.08Å; Y568-V650 HydrophobicContact CD2-CG1 4.33Å; Y568-V650 HydrophobicContact CE1-CG2 3.76Å; Y568-V650 HydrophobicContact CE2-CG2 4.4Å; Y568-V650 HydrophobicContact CG-CG1 4.2Å; V645-V650 HydrophobicContact CG1-CG2 4.23Å; I647-V650 WeakPolarHBondContact O-CB 3.48Å; I647-V650 PolarHBondContact O-N 3.09Å; I647-V650 VanDerWaalsContact O-N 3.16Å; V650-R652 PolarHBondContact O-N 3.21Å; V650-L654 HydrophobicContact CG1-CB 3.9Å; V650-L654 HydrophobicContact CG1-CD1 4.31Å; V650-V655 HydrophobicContact CB-CG2 4.18Å; V650-V655 HydrophobicContact CG1-CG2 4.16Å
651	P	90.4	Very high	87.5	Confident	33 Å²	33	39.1 Å²	39.1	21%	0.214	19%	0.19	C	C	.	.			trans	-50	129.2	175.1	-29.2	34.3	0	0	0	112.6	E565 H653 L654 V655	E565-P651 HydrophobicContact CG-CG 4.36Å; P651-H653 PolarHBondContact O-N 2.86Å; P651-L654 HydrophobicContact CB-CD1 4.17Å; P651-L654 HydrophobicContact CB-CG 4.25Å; P651-L654 HydrophobicContact CG-CD1 4.08Å; P651-L654 WeakPolarHBondContact O-CB 3.35Å; P651-L654 PolarHBondContact O-N 3.41Å; P651-V655 PolarHBondContact O-N 2.83Å
652	R	87.9	Confident	87.7	Confident	216 Å²	216	38 Å²	38	82%	0.815	19%	0.185	S	C	*	.	H	α-helix	trans	-54.3	-31.7	-174.5	-78.1	-176.2	172.8	159.5	-0.8	114.4	V650 L654 V655 K656	V650-R652 PolarHBondContact O-N 3.21Å; R652-L654 VanDerWaalsContact C-N 3.29Å; R652-L654 PolarHBondContact O-N 3.15Å; R652-V655 PolarHBondContact O-N 3.24Å; R652-K656 WeakPolarHBondContact O-CG 3.35Å; R652-K656 PolarHBondContact O-N 2.93Å
653	H	89.2	Confident	88	Confident	98 Å²	98	38.1 Å²	38.1	45%	0.454	19%	0.186	S	C	.	.	H	α-helix	trans	-68.3	-30.8	178.7	72	-91.5	0	0	0	112.2	E565 P651 K656 Q657	E565-H653 IonicContact OE1-CE1 3.97Å; E565-H653 PolarHBondContact OE1-CE1 3.37Å; P651-H653 PolarHBondContact O-N 2.86Å; H653-K656 WeakPolarHBondContact O-CB 3.17Å; H653-K656 PolarHBondContact O-N 3.07Å; H653-Q657 PolarHBondContact O-N 3.22Å
654	L	91	Very high	88.5	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-74.3	-38.4	174.2	-61.9	-179.8	0	0	0	111.2	E565 Y568 I572 V650 P651 R652 K656 Q657 L658	E565-L654 HydrophobicContact CB-CD1 4.35Å; E565-L654 HydrophobicContact CG-CD1 4.35Å; Y568-L654 HydrophobicContact CD2-CD1 4.24Å; Y568-L654 HydrophobicContact CG-CD1 4.28Å; I572-L654 HydrophobicContact CD1-CB 3.6Å; I572-L654 HydrophobicContact CD1-CD2 4.45Å; I572-L654 VanDerWaalsContact CD1-O 3.23Å; I572-L654 WeakPolarHBondContact CD1-O 3.37Å; V650-L654 HydrophobicContact CG1-CB 3.9Å; V650-L654 HydrophobicContact CG1-CD1 4.31Å; P651-L654 HydrophobicContact CB-CD1 4.17Å; P651-L654 HydrophobicContact CB-CG 4.25Å; P651-L654 HydrophobicContact CG-CD1 4.08Å; P651-L654 WeakPolarHBondContact O-CB 3.35Å; P651-L654 PolarHBondContact O-N 3.41Å; R652-L654 VanDerWaalsContact C-N 3.29Å; R652-L654 PolarHBondContact O-N 3.15Å; L654-K656 VanDerWaalsContact C-N 3.27Å; L654-K656 PolarHBondContact O-N 3.2Å; L654-Q657 WeakPolarHBondContact O-CA 3.45Å; L654-Q657 VanDerWaalsContact O-CB 3.32Å; L654-Q657 WeakPolarHBondContact O-CB 3.38Å; L654-Q657 PolarHBondContact O-N 2.66Å; L654-L658 PolarHBondContact O-N 3.17Å
655	V	89.9	Confident	88.9	Confident	20 Å²	20	37.5 Å²	37.5	12%	0.121	18%	0.178	C	C	.	.	H	α-helix	trans	-59	-41.9	170.6	-178.3	0	0	0	0	110.8	I647 V650 P651 R652 Q657 L658 T659	I647-V655 HydrophobicContact CD1-CG1 4.01Å; I647-V655 HydrophobicContact CD1-CG2 4.24Å; I647-V655 HydrophobicContact CG1-CG1 4.24Å; I647-V655 HydrophobicContact CG1-CG2 3.67Å; V650-V655 HydrophobicContact CB-CG2 4.18Å; V650-V655 HydrophobicContact CG1-CG2 4.16Å; P651-V655 PolarHBondContact O-N 2.83Å; R652-V655 PolarHBondContact O-N 3.24Å; V655-Q657 VanDerWaalsContact C-N 3.34Å; V655-Q657 PolarHBondContact O-N 2.97Å; V655-L658 WeakPolarHBondContact O-CB 2.97Å; V655-L658 PolarHBondContact O-N 3.47Å; V655-T659 PolarHBondContact O-N 3.08Å; V655-T659 VanDerWaalsContact O-N 3.1Å; V655-T659 PolarHBondContact O-OG1 3.36Å
656	K	89.5	Confident	89.2	Confident	72 Å²	72	37.6 Å²	37.6	31%	0.313	18%	0.179	S	C	.	.	H	α-helix	trans	-63.2	-38.5	172.5	-70.4	179.7	-176.3	-165.1	0	112.5	R652 H653 L654 L658 T659 H660 D701	R652-K656 WeakPolarHBondContact O-CG 3.35Å; R652-K656 PolarHBondContact O-N 2.93Å; H653-K656 WeakPolarHBondContact O-CB 3.17Å; H653-K656 PolarHBondContact O-N 3.07Å; L654-K656 VanDerWaalsContact C-N 3.27Å; L654-K656 PolarHBondContact O-N 3.2Å; K656-L658 VanDerWaalsContact C-N 3.35Å; K656-L658 PolarHBondContact O-N 2.96Å; K656-T659 WeakPolarHBondContact CA-OG1 3.45Å; K656-T659 PolarHBondContact O-N 3.32Å; K656-T659 PolarHBondContact O-OG1 3.39Å; K656-H660 WeakPolarHBondContact O-CB 3.25Å; K656-H660 PolarHBondContact O-CD2 3.38Å; K656-H660 VanDerWaalsContact O-CG 3.32Å; K656-H660 PolarHBondContact O-N 3.31Å; K656-D701 WeakPolarHBondContact CE-OD2 3.33Å; K656-D701 IonicContact NZ-OD2 2.75Å; K656-D701 PolarHBondContact NZ-OD2 2.83Å
657	Q	90.7	Very high	89.7	Confident	66 Å²	66	37.6 Å²	37.6	31%	0.308	18%	0.179	S	C	.	.	H	α-helix	trans	-60.4	-44.5	174.7	-176.2	179.9	-14.3	0	0	111.6	I572 H653 L654 V655 T659 H660 T661	I572-Q657 HydrophobicContact CG2-CG 4.26Å; H653-Q657 PolarHBondContact O-N 3.22Å; L654-Q657 WeakPolarHBondContact O-CA 3.45Å; L654-Q657 VanDerWaalsContact O-CB 3.32Å; L654-Q657 WeakPolarHBondContact O-CB 3.38Å; L654-Q657 PolarHBondContact O-N 2.66Å; V655-Q657 VanDerWaalsContact C-N 3.34Å; V655-Q657 PolarHBondContact O-N 2.97Å; Q657-T659 PolarHBondContact O-N 2.6Å; Q657-H660 PolarHBondContact O-N 2.94Å; Q657-T661 WeakPolarHBondContact O-CG2 3.46Å; Q657-T661 PolarHBondContact O-N 3.1Å; Q657-T661 PolarHBondContact O-OG1 3.46Å
658	L	90.7	Very high	90	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-60.3	-44.1	176.4	178.7	64.2	0	0	0	112.6	W571 I572 V575 M638 I647 L654 V655 K656 T661 A662	W571-L658 HydrophobicContact CH2-CD2 4.36Å; I572-L658 HydrophobicContact CG1-CB 4.25Å; I572-L658 HydrophobicContact CG2-CB 4.03Å; I572-L658 HydrophobicContact CG2-CD1 4.13Å; V575-L658 HydrophobicContact CB-CD1 4.39Å; V575-L658 HydrophobicContact CG1-CD1 3.91Å; M638-L658 HydrophobicContact CE-CG 4.16Å; I647-L658 HydrophobicContact CD1-CD2 4.3Å; L654-L658 PolarHBondContact O-N 3.17Å; V655-L658 WeakPolarHBondContact O-CB 2.97Å; V655-L658 PolarHBondContact O-N 3.47Å; K656-L658 VanDerWaalsContact C-N 3.35Å; K656-L658 PolarHBondContact O-N 2.96Å; L658-T661 PolarHBondContact O-OG1 2.86Å; L658-A662 WeakPolarHBondContact O-CB 3.44Å; L658-A662 PolarHBondContact O-N 2.91Å; L658-A662 VanDerWaalsContact O-N 3.1Å
659	T	90.7	Very high	90.2	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-67	-39.7	177.4	54.9	0	0	0	0	112.7	V655 K656 Q657 A662 I663 L699 I752	V655-T659 PolarHBondContact O-N 3.08Å; V655-T659 VanDerWaalsContact O-N 3.1Å; V655-T659 PolarHBondContact O-OG1 3.36Å; K656-T659 WeakPolarHBondContact CA-OG1 3.45Å; K656-T659 PolarHBondContact O-N 3.32Å; K656-T659 PolarHBondContact O-OG1 3.39Å; Q657-T659 PolarHBondContact O-N 2.6Å; T659-A662 PolarHBondContact O-N 2.79Å; T659-I663 WeakPolarHBondContact O-CG1 3.42Å; T659-I663 PolarHBondContact O-N 3.28Å; T659-L699 HydrophobicContact CG2-CD2 3.98Å; T659-L699 PolarHBondContact OG1-O 2.84Å; T659-I752 HydrophobicContact CG2-CG2 3.36Å; T659-I752 WeakPolarHBondContact CG2-O 3.38Å
660	H	91.9	Very high	90.3	Very high	53 Å²	53	34.8 Å²	34.8	25%	0.245	17%	0.165	C	C	.	.	H	α-helix	trans	-64.6	-42.2	176.7	-79.2	-155.6	0	0	0	112.2	K656 Q657 I663 S664 S704	K656-H660 WeakPolarHBondContact O-CB 3.25Å; K656-H660 PolarHBondContact O-CD2 3.38Å; K656-H660 VanDerWaalsContact O-CG 3.32Å; K656-H660 PolarHBondContact O-N 3.31Å; Q657-H660 PolarHBondContact O-N 2.94Å; H660-I663 PolarHBondContact O-N 3.44Å; H660-S664 WeakPolarHBondContact O-CB 3.4Å; H660-S664 PolarHBondContact O-N 2.84Å; H660-S704 VanDerWaalsContact CE1-CB 3.45Å; H660-S704 WeakPolarHBondContact CE1-CB 3.25Å; H660-S704 VanDerWaalsContact NE2-CB 3.3Å; H660-S704 WeakPolarHBondContact NE2-CB 3.48Å
661	T	90	Very high	90.2	Very high	38 Å²	38	36.5 Å²	36.5	23%	0.233	17%	0.174	C	C	.	.	H	α-helix	trans	-67	-40.3	178	52.8	0	0	0	0	111.4	A576 Q657 L658 S664 S665	A576-T661 HydrophobicContact CB-CG2 4.44Å; A576-T661 WeakPolarHBondContact CB-OG1 3.43Å; Q657-T661 WeakPolarHBondContact O-CG2 3.46Å; Q657-T661 PolarHBondContact O-N 3.1Å; Q657-T661 PolarHBondContact O-OG1 3.46Å; L658-T661 PolarHBondContact O-OG1 2.86Å; T661-S664 PolarHBondContact O-N 3.4Å; T661-S665 PolarHBondContact O-N 3.34Å
662	A	90.9	Very high	90	Very high	2 Å²	2	38.1 Å²	38.1	2%	0.017	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-40.7	174.7	0	0	0	0	0	112.8	V579 M638 L658 T659 S665 V666	V579-A662 HydrophobicContact CG1-CB 4.48Å; M638-A662 HydrophobicContact CE-CB 3.51Å; M638-A662 HydrophobicContact SD-CB 3.63Å; L658-A662 WeakPolarHBondContact O-CB 3.44Å; L658-A662 PolarHBondContact O-N 2.91Å; L658-A662 VanDerWaalsContact O-N 3.1Å; T659-A662 PolarHBondContact O-N 2.79Å; A662-S665 PolarHBondContact O-N 3.12Å; A662-S665 PolarHBondContact O-OG 3.21Å; A662-V666 VanDerWaalsContact O-CG2 3.31Å; A662-V666 WeakPolarHBondContact O-CG2 3.36Å; A662-V666 PolarHBondContact O-N 2.96Å; A662-V666 VanDerWaalsContact O-N 3.1Å
663	I	92.1	Very high	89.8	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-70.2	-37.5	175	-67.4	168.5	0	0	0	111.4	T659 H660 S665 V666 V667 L699 L700 M707 C711	T659-I663 WeakPolarHBondContact O-CG1 3.42Å; T659-I663 PolarHBondContact O-N 3.28Å; H660-I663 PolarHBondContact O-N 3.44Å; I663-S665 VanDerWaalsContact C-N 3.28Å; I663-S665 PolarHBondContact O-N 3.12Å; I663-V666 PolarHBondContact O-N 3.36Å; I663-V667 HydrophobicContact CG2-CG2 4.08Å; I663-V667 WeakPolarHBondContact O-CB 3.31Å; I663-V667 WeakPolarHBondContact O-CG2 3.5Å; I663-V667 PolarHBondContact O-N 3.4Å; I663-L699 HydrophobicContact CD1-CB 3.32Å; I663-L699 HydrophobicContact CD1-CD1 4.08Å; I663-L699 HydrophobicContact CD1-CG 4.33Å; I663-L699 HydrophobicContact CG1-CB 4Å; I663-L699 HydrophobicContact CG1-CD1 3.79Å; I663-L700 HydrophobicContact CD1-CD1 3.98Å; I663-L700 HydrophobicContact CD1-CD2 3.41Å; I663-L700 VanDerWaalsContact CD1-CD2 3.41Å; I663-L700 HydrophobicContact CD1-CG 3.33Å; I663-M707 HydrophobicContact CG2-CG 4.11Å; I663-M707 HydrophobicContact CG2-SD 4.25Å; I663-C711 VanDerWaalsContact CG2-SG 3.58Å
664	S	92.5	Very high	89.4	Confident	23 Å²	23	24.3 Å²	24.3	16%	0.161	13%	0.128	C	C	.	.	H	α-helix	trans	-59.3	-43.1	175.9	-159.3	0	0	0	0	110.9	H660 T661 V667 E668 R710	H660-S664 WeakPolarHBondContact O-CB 3.4Å; H660-S664 PolarHBondContact O-N 2.84Å; T661-S664 PolarHBondContact O-N 3.4Å; S664-V667 PolarHBondContact O-N 3.24Å; S664-E668 WeakPolarHBondContact O-CB 3.14Å; S664-E668 WeakPolarHBondContact O-CG 3.32Å; S664-E668 PolarHBondContact O-N 2.82Å; S664-E668 PolarHBondContact OG-OE1 2.98Å; S664-R710 PolarHBondContact OG-NH1 2.99Å; S664-R710 VanDerWaalsContact OG-NH1 3.13Å
665	S	90.8	Very high	89	Confident	11 Å²	11	31.9 Å²	31.9	8%	0.077	16%	0.164	C	C	.	.	H	α-helix	trans	-67.6	-37.2	178.2	66.6	0	0	0	0	112.7	T661 A662 I663 A669	T661-S665 PolarHBondContact O-N 3.34Å; A662-S665 PolarHBondContact O-N 3.12Å; A662-S665 PolarHBondContact O-OG 3.21Å; I663-S665 VanDerWaalsContact C-N 3.28Å; I663-S665 PolarHBondContact O-N 3.12Å; S665-A669 VanDerWaalsContact O-CB 3.28Å; S665-A669 WeakPolarHBondContact O-CB 3.36Å; S665-A669 PolarHBondContact O-N 3.23Å
666	V	91.5	Very high	88.5	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-61.3	-50.5	171.7	171.7	0	0	0	0	111	V583 W630 L634 A662 I663 E668 A669 M670 L695	V583-V666 HydrophobicContact CG1-CB 4.37Å; V583-V666 HydrophobicContact CG1-CG2 3.84Å; V583-V666 HydrophobicContact CG2-CG2 4.16Å; W630-V666 HydrophobicContact CH2-CG1 4.02Å; W630-V666 HydrophobicContact CZ3-CG1 4.5Å; W630-V666 HydrophobicContact CZ3-CG2 4.23Å; L634-V666 HydrophobicContact CD2-CG2 3.64Å; A662-V666 VanDerWaalsContact O-CG2 3.31Å; A662-V666 WeakPolarHBondContact O-CG2 3.36Å; A662-V666 PolarHBondContact O-N 2.96Å; A662-V666 VanDerWaalsContact O-N 3.1Å; I663-V666 PolarHBondContact O-N 3.36Å; V666-E668 VanDerWaalsContact C-N 3.35Å; V666-E668 PolarHBondContact O-N 2.91Å; V666-A669 PolarHBondContact O-N 3.31Å; V666-M670 HydrophobicContact CG1-CG 4.36Å; V666-M670 HydrophobicContact CG1-SD 3.8Å; V666-M670 WeakPolarHBondContact O-CB 3.39Å; V666-M670 WeakPolarHBondContact O-CG 3.4Å; V666-M670 PolarHBondContact O-N 3.49Å; V666-L695 HydrophobicContact CG1-CD1 4.29Å
667	V	91.8	Very high	87.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-44.2	-180	171.3	0	0	0	0	111.1	I663 S664 A669 M670 D671 L692 R710 T714	I663-V667 HydrophobicContact CG2-CG2 4.08Å; I663-V667 WeakPolarHBondContact O-CB 3.31Å; I663-V667 WeakPolarHBondContact O-CG2 3.5Å; I663-V667 PolarHBondContact O-N 3.4Å; S664-V667 PolarHBondContact O-N 3.24Å; V667-A669 PolarHBondContact O-N 2.89Å; V667-M670 PolarHBondContact O-N 3.15Å; V667-D671 WeakPolarHBondContact O-CB 3.45Å; V667-D671 PolarHBondContact O-N 3.12Å; V667-L692 HydrophobicContact CG2-CD1 4.1Å; V667-R710 HydrophobicContact CG1-CG 3.97Å; V667-T714 VanDerWaalsContact CG1-OG1 3.3Å; V667-T714 WeakPolarHBondContact CG1-OG1 3.37Å
668	E	89.9	Confident	86.1	Confident	73 Å²	73	40.7 Å²	40.7	34%	0.341	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-42.8	176.8	-75.7	164.7	-158.4	0	0	112.5	S664 V666 M670 D671 V672 R710	S664-E668 WeakPolarHBondContact O-CB 3.14Å; S664-E668 WeakPolarHBondContact O-CG 3.32Å; S664-E668 PolarHBondContact O-N 2.82Å; S664-E668 PolarHBondContact OG-OE1 2.98Å; V666-E668 VanDerWaalsContact C-N 3.35Å; V666-E668 PolarHBondContact O-N 2.91Å; E668-M670 VanDerWaalsContact C-N 3.34Å; E668-D671 PolarHBondContact O-N 3.3Å; E668-V672 VanDerWaalsContact O-CG2 3.3Å; E668-V672 WeakPolarHBondContact O-CG2 3.18Å; E668-V672 PolarHBondContact O-N 3.44Å; E668-R710 IonicContact OE1-CZ 3.15Å; E668-R710 IonicContact OE1-NH1 3.64Å; E668-R710 PolarHBondContact OE1-NH1 3.41Å; E668-R710 IonicContact OE1-NH2 2.69Å
669	A	88	Confident	85	Confident	5 Å²	5	49.1 Å²	49.1	4%	0.041	25%	0.25	C	C	.	.	H	α-helix	trans	-67.8	-35.4	177.2	0	0	0	0	0	112.2	V583 K584 L587 S665 V666 V667 L673	V583-A669 HydrophobicContact CG1-CB 3.94Å; K584-A669 HydrophobicContact CG-CB 3.88Å; L587-A669 HydrophobicContact CD1-CB 3.4Å; L587-A669 VanDerWaalsContact CD1-CB 3.4Å; S665-A669 VanDerWaalsContact O-CB 3.28Å; S665-A669 WeakPolarHBondContact O-CB 3.36Å; S665-A669 PolarHBondContact O-N 3.23Å; V666-A669 PolarHBondContact O-N 3.31Å; V667-A669 PolarHBondContact O-N 2.89Å; A669-L673 PolarHBondContact O-N 2.57Å; A669-L673 VanDerWaalsContact O-N 3.07Å
670	M	87.6	Confident	84.1	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-40.8	174.1	-68.3	175.4	94.2	0	0	112	L587 V666 V667 E668 V672 L673 L674 L688 L692 T714 L718	L587-M670 HydrophobicContact CD1-CG 4.09Å; V666-M670 HydrophobicContact CG1-CG 4.36Å; V666-M670 HydrophobicContact CG1-SD 3.8Å; V666-M670 WeakPolarHBondContact O-CB 3.39Å; V666-M670 WeakPolarHBondContact O-CG 3.4Å; V666-M670 PolarHBondContact O-N 3.49Å; V667-M670 PolarHBondContact O-N 3.15Å; E668-M670 VanDerWaalsContact C-N 3.34Å; M670-V672 VanDerWaalsContact C-N 3.33Å; M670-V672 PolarHBondContact O-N 3Å; M670-L673 PolarHBondContact O-N 3.41Å; M670-L674 WeakPolarHBondContact O-CB 3.47Å; M670-L674 VanDerWaalsContact O-CG 3.26Å; M670-L674 WeakPolarHBondContact O-CG 3.5Å; M670-L674 PolarHBondContact O-N 2.98Å; M670-L688 HydrophobicContact CE-CB 3.64Å; M670-L688 HydrophobicContact CE-CD2 4.15Å; M670-L688 HydrophobicContact CE-CG 4.32Å; M670-L688 WeakPolarHBondContact CE-O 3.42Å; M670-L692 HydrophobicContact CE-CB 4.04Å; M670-L692 HydrophobicContact CE-CD2 4.2Å; M670-L692 HydrophobicContact SD-CB 4.2Å; M670-L692 HydrophobicContact SD-CD1 4.27Å; M670-L692 HydrophobicContact SD-CD2 4Å; M670-L692 HydrophobicContact SD-CG 4.38Å; M670-T714 HydrophobicContact CB-CG2 4.18Å; M670-L718 HydrophobicContact CE-CD1 3.62Å
671	D	87.1	Confident	83.5	Confident	43 Å²	43	50 Å²	50	23%	0.23	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-44	176.5	-67.8	-24.3	0	0	0	110	V667 E668 L673 L674 E675 R710 T714	V667-D671 WeakPolarHBondContact O-CB 3.45Å; V667-D671 PolarHBondContact O-N 3.12Å; E668-D671 PolarHBondContact O-N 3.3Å; D671-L673 PolarHBondContact O-N 3.44Å; D671-L674 PolarHBondContact O-N 3.15Å; D671-E675 WeakPolarHBondContact O-CG 3.42Å; D671-E675 PolarHBondContact O-N 3.5Å; D671-R710 IonicContact OD2-NH2 3.51Å; D671-T714 WeakPolarHBondContact OD1-CG2 2.87Å; D671-T714 PolarHBondContact OD1-OG1 2.74Å
672	V	86.3	Confident	83	Confident	67 Å²	67	52 Å²	52	41%	0.406	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-41.2	174.2	170.8	0	0	0	0	112.1	E668 M670 L674 E675 S676	E668-V672 VanDerWaalsContact O-CG2 3.3Å; E668-V672 WeakPolarHBondContact O-CG2 3.18Å; E668-V672 PolarHBondContact O-N 3.44Å; M670-V672 VanDerWaalsContact C-N 3.33Å; M670-V672 PolarHBondContact O-N 3Å; V672-L674 VanDerWaalsContact C-N 3.33Å; V672-E675 PolarHBondContact O-N 3.35Å; V672-S676 PolarHBondContact O-N 2.77Å
673	L	83.5	Confident	82.4	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-39.2	176.6	-167	156.6	0	0	0	111.1	L587 A669 M670 D671 E675 S676 P680	L587-L673 HydrophobicContact CB-CD1 4.19Å; L587-L673 HydrophobicContact CD2-CD1 4.15Å; L587-L673 WeakPolarHBondContact O-CD1 2.95Å; A669-L673 PolarHBondContact O-N 2.57Å; A669-L673 VanDerWaalsContact O-N 3.07Å; M670-L673 PolarHBondContact O-N 3.41Å; D671-L673 PolarHBondContact O-N 3.44Å; L673-E675 VanDerWaalsContact C-N 3.29Å; L673-E675 PolarHBondContact O-N 3.33Å; L673-S676 WeakPolarHBondContact O-CB 3.23Å; L673-S676 PolarHBondContact O-N 3.3Å; L673-S676 PolarHBondContact O-OG 2.95Å; L673-P680 HydrophobicContact CD2-CB 4.28Å; L673-P680 HydrophobicContact CD2-CG 4.18Å
674	L	81.5	Confident	82	Confident	18 Å²	18	54.2 Å²	54.2	9%	0.094	28%	0.279	C	S	.	.	H	α-helix	trans	-70.1	-23.8	178.6	-72.4	171.3	0	0	0	114.1	M670 D671 V672 T714 T717 L718 R721	M670-L674 WeakPolarHBondContact O-CB 3.47Å; M670-L674 VanDerWaalsContact O-CG 3.26Å; M670-L674 WeakPolarHBondContact O-CG 3.5Å; M670-L674 PolarHBondContact O-N 2.98Å; D671-L674 PolarHBondContact O-N 3.15Å; V672-L674 VanDerWaalsContact C-N 3.33Å; L674-T714 HydrophobicContact CD1-CG2 4.23Å; L674-T717 WeakPolarHBondContact CD1-OG1 3.4Å; L674-L718 HydrophobicContact CD1-CD2 4.16Å; L674-L718 HydrophobicContact CD1-CG 4.19Å; L674-L718 HydrophobicContact CD2-CD2 3.88Å; L674-L718 HydrophobicContact CG-CD2 4.4Å; L674-R721 HydrophobicContact CD2-CG 4.37Å; L674-R721 PolarHBondContact O-NH2 2.89Å
675	E	81.8	Confident	81.6	Confident	161 Å²	161	53.2 Å²	53.2	75%	0.752	27%	0.272	S	S	*	.	H	α-helix	trans	-83.7	-16	173.9	-72.3	176.8	-180	0	0	113	D671 V672 L673	D671-E675 WeakPolarHBondContact O-CG 3.42Å; D671-E675 PolarHBondContact O-N 3.5Å; V672-E675 PolarHBondContact O-N 3.35Å; L673-E675 VanDerWaalsContact C-N 3.29Å; L673-E675 PolarHBondContact O-N 3.33Å
676	S	78.6	Confident	81.4	Confident	47 Å²	47	53 Å²	53	33%	0.329	27%	0.27	S	S	.	.	S	Bend	trans	-68.2	149.4	178.6	74.8	0	0	0	0	113	V672 L673 D678	V672-S676 PolarHBondContact O-N 2.77Å; L673-S676 WeakPolarHBondContact O-CB 3.23Å; L673-S676 PolarHBondContact O-N 3.3Å; L673-S676 PolarHBondContact O-OG 2.95Å; S676-D678 VanDerWaalsContact C-N 3.27Å; S676-D678 PolarHBondContact O-N 3.15Å
677	E	62.7	Low	81.1	Confident	184 Å²	184	53 Å²	53	86%	0.86	27%	0.27	S	S	*	.	S	Bend	trans	-65	-28.9	-178.7	-71.1	-72.1	163.7	0	0	112.8	K679	E677-K679 PolarHBondContact O-N 2.74Å; E677-K679 VanDerWaalsContact O-N 3.16Å
678	D	68.1	Low	80.9	Confident	112 Å²	112	53.2 Å²	53.2	60%	0.599	27%	0.271	S	S	*	.	S	Bend	trans	-72.1	108.2	179.3	-70	-35.5	0	0	0	110	S676 P680	S676-D678 VanDerWaalsContact C-N 3.27Å; S676-D678 PolarHBondContact O-N 3.15Å; D678-P680 WeakPolarHBondContact O-CD 3.3Å; D678-P680 VanDerWaalsContact O-N 3.12Å
679	K	68	Low	80.9	Confident	181 Å²	181	49.8 Å²	49.8	79%	0.787	26%	0.255	S	S	*	.			trans	-66.5	111.8	176.5	-69	178.1	-175.9	174	0	109.2	E677	E677-K679 PolarHBondContact O-N 2.74Å; E677-K679 VanDerWaalsContact O-N 3.16Å
680	P	72.3	Confident	81	Confident	26 Å²	26	49.6 Å²	49.6	17%	0.169	25%	0.253	C	S	.	.			trans	-61.5	146.7	176.4	26.1	-34.2	0	0	0	109.9	L673 D678 L684 V685	L673-P680 HydrophobicContact CD2-CB 4.28Å; L673-P680 HydrophobicContact CD2-CG 4.18Å; D678-P680 WeakPolarHBondContact O-CD 3.3Å; D678-P680 VanDerWaalsContact O-N 3.12Å; P680-L684 HydrophobicContact CB-CD2 3.86Å; P680-L684 HydrophobicContact CB-CG 4.39Å; P680-V685 HydrophobicContact CB-CG2 4.01Å; P680-V685 HydrophobicContact CG-CG2 3.62Å
681	S	77.4	Confident	81.2	Confident	45 Å²	45	49.5 Å²	49.5	32%	0.315	25%	0.253	S	S	.	.			trans	-59.3	146	176.4	64.9	0	0	0	0	110.5	Q596 L683 L684 V685	Q596-S681 PolarHBondContact OE1-OG 2.79Å; S681-L683 PolarHBondContact O-N 3.5Å; S681-L683 VanDerWaalsContact O-N 3.17Å; S681-L684 WeakPolarHBondContact O-CB 3.35Å; S681-L684 PolarHBondContact O-N 3.42Å; S681-L684 WeakPolarHBondContact OG-CB 3.48Å; S681-L684 PolarHBondContact OG-N 2.85Å; S681-V685 PolarHBondContact O-N 3.19Å
682	Q	79.8	Confident	81.5	Confident	80 Å²	80	47.5 Å²	47.5	37%	0.374	24%	0.242	S	C	.	.	H	α-helix	trans	-55.2	-37.1	179.6	-175.9	177.2	-19.3	0	0	111.7	L684 V685 V686 V722 D726	Q682-L684 PolarHBondContact O-N 3.35Å; Q682-V685 PolarHBondContact O-N 3.05Å; Q682-V686 VanDerWaalsContact O-CG2 3.31Å; Q682-V686 WeakPolarHBondContact O-CG2 3.3Å; Q682-V686 PolarHBondContact O-N 2.71Å; Q682-V722 HydrophobicContact CG-CG1 4.12Å; Q682-D726 PolarHBondContact NE2-OD2 3.18Å
683	L	79.6	Confident	81.7	Confident	49 Å²	49	46 Å²	46	26%	0.257	23%	0.231	S	C	.	.	H	α-helix	trans	-61	-43.6	175	-176.6	62.2	0	0	0	112.5	L600 Y603 L622 S681 V686 Q687	L600-L683 HydrophobicContact CD1-CD2 3.68Å; L600-L683 HydrophobicContact CD1-CG 4.46Å; L600-L683 HydrophobicContact CD2-CD2 4.06Å; L600-L683 HydrophobicContact CD2-CG 3.99Å; L600-L683 HydrophobicContact CG-CD2 4.48Å; Y603-L683 HydrophobicContact CD1-CD1 4.11Å; Y603-L683 HydrophobicContact CE1-CD1 3.54Å; Y603-L683 HydrophobicContact CE1-CG 4.43Å; L622-L683 HydrophobicContact CB-CD1 4.08Å; S681-L683 PolarHBondContact O-N 3.5Å; S681-L683 VanDerWaalsContact O-N 3.17Å; L683-V686 PolarHBondContact O-N 3.19Å; L683-Q687 PolarHBondContact O-N 2.9Å
684	L	82.2	Confident	82.1	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-64.1	-43.9	176.4	177.8	61	0	0	0	111.2	Q590 P680 S681 Q682 V686 Q687 L688	Q590-L684 HydrophobicContact CB-CD1 4.36Å; Q590-L684 HydrophobicContact CB-CD2 4.31Å; P680-L684 HydrophobicContact CB-CD2 3.86Å; P680-L684 HydrophobicContact CB-CG 4.39Å; S681-L684 WeakPolarHBondContact O-CB 3.35Å; S681-L684 PolarHBondContact O-N 3.42Å; S681-L684 WeakPolarHBondContact OG-CB 3.48Å; S681-L684 PolarHBondContact OG-N 2.85Å; Q682-L684 PolarHBondContact O-N 3.35Å; L684-V686 VanDerWaalsContact C-N 3.32Å; L684-V686 PolarHBondContact O-N 3.15Å; L684-Q687 PolarHBondContact O-N 3.43Å; L684-L688 HydrophobicContact CD1-CD1 4.38Å; L684-L688 HydrophobicContact CD1-CG 4.17Å; L684-L688 HydrophobicContact CG-CD1 4.15Å; L684-L688 HydrophobicContact CG-CG 4.38Å; L684-L688 WeakPolarHBondContact O-CB 3.36Å; L684-L688 VanDerWaalsContact O-CG 3.32Å; L684-L688 WeakPolarHBondContact O-CG 3.46Å; L684-L688 PolarHBondContact O-N 3.33Å
685	V	84.9	Confident	82.6	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-42.6	177.8	177.7	0	0	0	0	111.3	P680 S681 Q682 L688 L689 L718 R721 V722	P680-V685 HydrophobicContact CB-CG2 4.01Å; P680-V685 HydrophobicContact CG-CG2 3.62Å; S681-V685 PolarHBondContact O-N 3.19Å; Q682-V685 PolarHBondContact O-N 3.05Å; V685-L688 PolarHBondContact O-N 3.29Å; V685-L689 VanDerWaalsContact O-CB 3.3Å; V685-L689 WeakPolarHBondContact O-CB 3.23Å; V685-L689 PolarHBondContact O-N 2.83Å; V685-L718 HydrophobicContact CG1-CB 4.33Å; V685-L718 HydrophobicContact CG1-CD2 3.96Å; V685-L718 WeakPolarHBondContact CG1-O 3.43Å; V685-R721 HydrophobicContact CG1-CB 4.16Å; V685-V722 HydrophobicContact CB-CG2 4.21Å; V685-V722 HydrophobicContact CG1-CG2 3.56Å
686	V	86	Confident	83	Confident	6 Å²	6	38.1 Å²	38.1	4%	0.036	20%	0.195	C	C	.	.	H	α-helix	trans	-65.5	-41.7	176.2	177.1	0	0	0	0	111	P624 Q682 L683 L684 L689 F690 V722 M730 L734	P624-V686 HydrophobicContact CG-CG1 3.81Å; Q682-V686 VanDerWaalsContact O-CG2 3.31Å; Q682-V686 WeakPolarHBondContact O-CG2 3.3Å; Q682-V686 PolarHBondContact O-N 2.71Å; L683-V686 PolarHBondContact O-N 3.19Å; L684-V686 VanDerWaalsContact C-N 3.32Å; L684-V686 PolarHBondContact O-N 3.15Å; V686-L689 PolarHBondContact O-N 3.24Å; V686-F690 PolarHBondContact O-N 2.91Å; V686-V722 HydrophobicContact CG2-CG1 4.22Å; V686-V722 HydrophobicContact CG2-CG2 4.06Å; V686-M730 HydrophobicContact CB-CE 4.33Å; V686-M730 HydrophobicContact CG1-CE 3.49Å; V686-M730 VanDerWaalsContact CG1-CE 3.49Å; V686-M730 HydrophobicContact CG1-SD 4.29Å; V686-M730 HydrophobicContact CG2-CE 4.1Å; V686-M730 HydrophobicContact CG2-SD 4.07Å; V686-L734 HydrophobicContact CG1-CD1 4.42Å
687	Q	86.5	Confident	83.4	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.019	19%	0.194	C	C	.	.	H	α-helix	trans	-61.8	-44.5	175.2	-177.7	65	44.2	0	0	111.6	Y603 P624 S626 S628 L683 L684 L689 F690 D691	Y603-Q687 PolarHBondContact OH-OE1 2.94Å; P624-Q687 VanDerWaalsContact CB-OE1 3.3Å; P624-Q687 HydrophobicContact CG-CB 4.43Å; S626-Q687 PolarHBondContact O-NE2 2.79Å; S628-Q687 VanDerWaalsContact N-NE2 3.18Å; L683-Q687 PolarHBondContact O-N 2.9Å; L684-Q687 PolarHBondContact O-N 3.43Å; Q687-L689 VanDerWaalsContact C-N 3.3Å; Q687-L689 PolarHBondContact O-N 3.26Å; Q687-F690 WeakPolarHBondContact O-CB 3.45Å; Q687-F690 PolarHBondContact O-N 3.11Å; Q687-D691 PolarHBondContact NE2-OD1 3.27Å; Q687-D691 WeakPolarHBondContact O-CB 3.3Å; Q687-D691 PolarHBondContact O-N 3.01Å
688	L	87.5	Confident	84.7	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.016	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-37.8	176.6	-74.1	179.7	0	0	0	112	L587 W630 M670 L684 V685 D691 L692 L718	L587-L688 HydrophobicContact CD2-CD2 3.67Å; W630-L688 HydrophobicContact CZ2-CD2 4.01Å; M670-L688 HydrophobicContact CE-CB 3.64Å; M670-L688 HydrophobicContact CE-CD2 4.15Å; M670-L688 HydrophobicContact CE-CG 4.32Å; M670-L688 WeakPolarHBondContact CE-O 3.42Å; L684-L688 HydrophobicContact CD1-CD1 4.38Å; L684-L688 HydrophobicContact CD1-CG 4.17Å; L684-L688 HydrophobicContact CG-CD1 4.15Å; L684-L688 HydrophobicContact CG-CG 4.38Å; L684-L688 WeakPolarHBondContact O-CB 3.36Å; L684-L688 VanDerWaalsContact O-CG 3.32Å; L684-L688 WeakPolarHBondContact O-CG 3.46Å; L684-L688 PolarHBondContact O-N 3.33Å; V685-L688 PolarHBondContact O-N 3.29Å; L688-D691 PolarHBondContact O-N 2.95Å; L688-L692 WeakPolarHBondContact O-CB 3.49Å; L688-L692 PolarHBondContact O-N 2.92Å; L688-L718 HydrophobicContact CB-CD2 4.35Å
689	L	88.9	Confident	85.7	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-67.4	-39.4	174.7	-175.9	156.3	0	0	0	111.4	V685 V686 Q687 Q693 L718 K719 L734	V685-L689 VanDerWaalsContact O-CB 3.3Å; V685-L689 WeakPolarHBondContact O-CB 3.23Å; V685-L689 PolarHBondContact O-N 2.83Å; V686-L689 PolarHBondContact O-N 3.24Å; Q687-L689 VanDerWaalsContact C-N 3.3Å; Q687-L689 PolarHBondContact O-N 3.26Å; L689-Q693 WeakPolarHBondContact O-CB 3.37Å; L689-Q693 VanDerWaalsContact O-CG 3.23Å; L689-Q693 WeakPolarHBondContact O-CG 3.49Å; L689-Q693 PolarHBondContact O-N 3.35Å; L689-Q693 VanDerWaalsContact O-N 3.12Å; L689-L718 HydrophobicContact CB-CB 4.46Å; L689-L718 HydrophobicContact CB-CD1 4.45Å; L689-L718 HydrophobicContact CD1-CB 4.24Å; L689-K719 HydrophobicContact CD1-CG 3.5Å; L689-K719 VanDerWaalsContact CD1-CG 3.5Å; L689-L734 HydrophobicContact CD2-CD2 3.2Å
690	F	90.3	Very high	86.6	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.8	-50.7	171.6	-179.1	-95.5	0	0	0	111.4	P624 S626 V686 Q687 L692 Q693 V694 L734 N737 V738 Q741	P624-F690 HydrophobicContact CB-CB 3.92Å; P624-F690 HydrophobicContact CB-CD1 4.17Å; P624-F690 HydrophobicContact CB-CD2 4.12Å; P624-F690 HydrophobicContact CB-CG 3.8Å; P624-F690 HydrophobicContact CG-CB 4.28Å; S626-F690 WeakPolarHBondContact O-CE1 3.35Å; V686-F690 PolarHBondContact O-N 2.91Å; Q687-F690 WeakPolarHBondContact O-CB 3.45Å; Q687-F690 PolarHBondContact O-N 3.11Å; F690-L692 PolarHBondContact O-N 3.36Å; F690-Q693 PolarHBondContact O-N 3.38Å; F690-V694 HydrophobicContact CD1-CG2 4.23Å; F690-V694 HydrophobicContact CE1-CG2 3.81Å; F690-V694 HydrophobicContact CE2-CG2 4.28Å; F690-V694 HydrophobicContact CZ-CG2 3.86Å; F690-V694 WeakPolarHBondContact O-CG2 3.48Å; F690-V694 PolarHBondContact O-N 2.91Å; F690-L734 HydrophobicContact CB-CD1 4.1Å; F690-L734 HydrophobicContact CD2-CD1 3.7Å; F690-L734 HydrophobicContact CD2-CG 4.38Å; F690-L734 HydrophobicContact CG-CD1 4.37Å; F690-N737 HydrophobicContact CE2-CB 3.74Å; F690-N737 HydrophobicContact CZ-CB 4.47Å; F690-V738 HydrophobicContact CD2-CG2 3.56Å; F690-V738 HydrophobicContact CE2-CB 4.39Å; F690-V738 HydrophobicContact CE2-CG2 3.67Å; F690-V738 HydrophobicContact CG-CG2 4.46Å; F690-Q741 HydrophobicContact CE1-CB 4.42Å; F690-Q741 HydrophobicContact CE1-CG 4.11Å; F690-Q741 HydrophobicContact CZ-CB 3.76Å; F690-Q741 HydrophobicContact CZ-CG 3.94Å
691	D	91.4	Very high	87.2	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.1	-49.6	-178.8	-68.8	-19.9	0	0	0	111.2	L627 S628 W630 A631 Q687 L688 Q693 V694 L695	L627-D691 WeakPolarHBondContact CA-OD1 3.26Å; L627-D691 HydrophobicContact CD2-CB 4.16Å; L627-D691 WeakPolarHBondContact CD2-OD1 3.41Å; S628-D691 WeakPolarHBondContact CB-OD2 3.41Å; S628-D691 PolarHBondContact N-OD1 2.93Å; S628-D691 PolarHBondContact OG-OD2 2.77Å; W630-D691 HydrophobicContact CZ2-CB 4.49Å; A631-D691 HydrophobicContact CB-CB 4.27Å; Q687-D691 PolarHBondContact NE2-OD1 3.27Å; Q687-D691 WeakPolarHBondContact O-CB 3.3Å; Q687-D691 PolarHBondContact O-N 3.01Å; L688-D691 PolarHBondContact O-N 2.95Å; D691-Q693 VanDerWaalsContact C-N 3.32Å; D691-Q693 PolarHBondContact O-N 2.99Å; D691-V694 PolarHBondContact O-N 3.48Å; D691-L695 WeakPolarHBondContact O-CB 3.43Å; D691-L695 VanDerWaalsContact O-CG 3.25Å; D691-L695 WeakPolarHBondContact O-CG 3.44Å; D691-L695 PolarHBondContact O-N 3.35Å
692	L	93.2	Very high	87.3	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-63.5	-37	179.1	-177.7	58.5	0	0	0	111.8	V667 M670 L688 F690 T696 T714 I715 L718	V667-L692 HydrophobicContact CG2-CD1 4.1Å; M670-L692 HydrophobicContact CE-CB 4.04Å; M670-L692 HydrophobicContact CE-CD2 4.2Å; M670-L692 HydrophobicContact SD-CB 4.2Å; M670-L692 HydrophobicContact SD-CD1 4.27Å; M670-L692 HydrophobicContact SD-CD2 4Å; M670-L692 HydrophobicContact SD-CG 4.38Å; L688-L692 WeakPolarHBondContact O-CB 3.49Å; L688-L692 PolarHBondContact O-N 2.92Å; F690-L692 PolarHBondContact O-N 3.36Å; L692-T696 WeakPolarHBondContact O-CB 3.24Å; L692-T696 PolarHBondContact O-N 3.05Å; L692-T696 PolarHBondContact O-OG1 3.46Å; L692-T714 HydrophobicContact CD2-CG2 4.08Å; L692-I715 HydrophobicContact CD2-CD1 4.42Å; L692-I715 HydrophobicContact CD2-CG1 3.66Å; L692-I715 HydrophobicContact CG-CD1 4.4Å; L692-I715 HydrophobicContact CG-CG1 4.09Å; L692-L718 HydrophobicContact CD2-CD1 4.17Å
693	Q	91.7	Very high	87.5	Confident	34 Å²	34	22 Å²	22	16%	0.159	11%	0.114	C	C	.	.	H	α-helix	trans	-66.4	-43.4	175.8	-76.4	-179.7	17.2	0	0	112.2	L689 F690 D691 T697 I715 V738	L689-Q693 WeakPolarHBondContact O-CB 3.37Å; L689-Q693 VanDerWaalsContact O-CG 3.23Å; L689-Q693 WeakPolarHBondContact O-CG 3.49Å; L689-Q693 PolarHBondContact O-N 3.35Å; L689-Q693 VanDerWaalsContact O-N 3.12Å; F690-Q693 PolarHBondContact O-N 3.38Å; D691-Q693 VanDerWaalsContact C-N 3.32Å; D691-Q693 PolarHBondContact O-N 2.99Å; Q693-T697 WeakPolarHBondContact O-CB 3.19Å; Q693-T697 PolarHBondContact O-N 3.35Å; Q693-T697 PolarHBondContact O-OG1 3.36Å; Q693-I715 HydrophobicContact CG-CD1 4.17Å; Q693-V738 HydrophobicContact CB-CG1 4.1Å; Q693-V738 HydrophobicContact CB-CG2 3.94Å
694	V	91.2	Very high	87.8	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.7	-48.6	175.8	172.8	0	0	0	0	110.6	L627 F690 D691 T696 T697 L698 V738 Q741 L745	L627-V694 HydrophobicContact CD1-CG1 4.11Å; L627-V694 HydrophobicContact CD2-CB 3.74Å; L627-V694 HydrophobicContact CD2-CG1 3.71Å; L627-V694 HydrophobicContact CD2-CG2 4.3Å; L627-V694 HydrophobicContact CG-CB 4.49Å; L627-V694 HydrophobicContact CG-CG1 3.98Å; F690-V694 HydrophobicContact CD1-CG2 4.23Å; F690-V694 HydrophobicContact CE1-CG2 3.81Å; F690-V694 HydrophobicContact CE2-CG2 4.28Å; F690-V694 HydrophobicContact CZ-CG2 3.86Å; F690-V694 WeakPolarHBondContact O-CG2 3.48Å; F690-V694 PolarHBondContact O-N 2.91Å; D691-V694 PolarHBondContact O-N 3.48Å; V694-T696 PolarHBondContact O-N 3.09Å; V694-T697 PolarHBondContact O-N 2.93Å; V694-T697 VanDerWaalsContact O-N 3.15Å; V694-L698 HydrophobicContact CG1-CD1 3.66Å; V694-L698 HydrophobicContact CG1-CG 4.32Å; V694-L698 WeakPolarHBondContact O-CB 3.45Å; V694-L698 WeakPolarHBondContact O-CG 3.38Å; V694-L698 PolarHBondContact O-N 3.23Å; V694-V738 HydrophobicContact CG2-CB 4.29Å; V694-V738 HydrophobicContact CG2-CG1 4.03Å; V694-V738 HydrophobicContact CG2-CG2 4.14Å; V694-Q741 HydrophobicContact CG1-CG 4.42Å; V694-Q741 HydrophobicContact CG2-CB 4.37Å; V694-Q741 HydrophobicContact CG2-CG 4.34Å; V694-L745 HydrophobicContact CG1-CD1 3.78Å
695	L	92.4	Very high	88	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-61.2	-44.7	178.9	-69.9	175	0	0	0	112	W630 A631 L635 V666 D691 T697 L698 L699	W630-L695 HydrophobicContact CH2-CD1 4.37Å; A631-L695 HydrophobicContact CB-CD1 4.37Å; L635-L695 HydrophobicContact CD1-CD2 4.04Å; L635-L695 HydrophobicContact CD2-CD2 3.76Å; L635-L695 HydrophobicContact CG-CD2 3.86Å; V666-L695 HydrophobicContact CG1-CD1 4.29Å; D691-L695 WeakPolarHBondContact O-CB 3.43Å; D691-L695 VanDerWaalsContact O-CG 3.25Å; D691-L695 WeakPolarHBondContact O-CG 3.44Å; D691-L695 PolarHBondContact O-N 3.35Å; L695-T697 VanDerWaalsContact C-N 3.28Å; L695-T697 PolarHBondContact O-N 3.48Å; L695-L698 PolarHBondContact O-N 2.87Å; L695-L699 HydrophobicContact CD2-CD1 4.16Å; L695-L699 VanDerWaalsContact O-CB 3.28Å; L695-L699 WeakPolarHBondContact O-CB 3.28Å; L695-L699 PolarHBondContact O-N 3.45Å
696	T	90.3	Very high	88.2	Confident	19 Å²	19	33 Å²	33	12%	0.117	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-39.6	175.4	-58.6	0	0	0	0	110.8	L692 V694 L700 C711	L692-T696 WeakPolarHBondContact O-CB 3.24Å; L692-T696 PolarHBondContact O-N 3.05Å; L692-T696 PolarHBondContact O-OG1 3.46Å; V694-T696 PolarHBondContact O-N 3.09Å; T696-L700 HydrophobicContact CG2-CD1 3.87Å; T696-L700 VanDerWaalsContact O-CB 3.3Å; T696-L700 WeakPolarHBondContact O-CB 3.49Å; T696-L700 PolarHBondContact O-N 3.36Å; T696-C711 HydrophobicContact CG2-CB 4.16Å
697	T	87.7	Confident	88.3	Confident	51 Å²	51	34 Å²	34	31%	0.313	17%	0.173	S	C	.	.	H	α-helix	trans	-73.3	-35	-178.8	-50.4	0	0	0	0	112.2	Q693 V694 L695 T742 Y758	Q693-T697 WeakPolarHBondContact O-CB 3.19Å; Q693-T697 PolarHBondContact O-N 3.35Å; Q693-T697 PolarHBondContact O-OG1 3.36Å; V694-T697 PolarHBondContact O-N 2.93Å; V694-T697 VanDerWaalsContact O-N 3.15Å; L695-T697 VanDerWaalsContact C-N 3.28Å; L695-T697 PolarHBondContact O-N 3.48Å; T697-T742 HydrophobicContact CG2-CG2 3.82Å; T697-Y758 HydrophobicContact CG2-CD2 4.46Å; T697-Y758 HydrophobicContact CG2-CE2 3.55Å
698	L	88.2	Confident	88.4	Confident	5 Å²	5	36.1 Å²	36.1	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-77.4	-44.7	179.7	-73	171.2	0	0	0	113.3	L635 V694 L695 T742 L745 V746 V753 A754	L635-L698 HydrophobicContact CD1-CD1 3.85Å; V694-L698 HydrophobicContact CG1-CD1 3.66Å; V694-L698 HydrophobicContact CG1-CG 4.32Å; V694-L698 WeakPolarHBondContact O-CB 3.45Å; V694-L698 WeakPolarHBondContact O-CG 3.38Å; V694-L698 PolarHBondContact O-N 3.23Å; L695-L698 PolarHBondContact O-N 2.87Å; L698-T742 HydrophobicContact CD2-CG2 3.6Å; L698-T742 HydrophobicContact CG-CG2 3.97Å; L698-L745 HydrophobicContact CD1-CB 3.82Å; L698-L745 HydrophobicContact CD1-CD1 3.83Å; L698-L745 HydrophobicContact CD2-CB 4.2Å; L698-V746 HydrophobicContact CD2-CB 4.42Å; L698-V746 HydrophobicContact CD2-CG2 3.39Å; L698-V753 HydrophobicContact CD2-CG2 4.39Å; L698-A754 PolarHBondContact O-N 2.82Å
699	L	89.1	Confident	88.6	Confident	4 Å²	4	42 Å²	42	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-101.5	-8.4	-164.4	-60.9	178.7	0	0	0	113.6	L635 T659 I663 L695 I752 A754	L635-L699 HydrophobicContact CD2-CD1 4.05Å; L635-L699 HydrophobicContact CD2-CD2 3.94Å; L635-L699 HydrophobicContact CD2-CG 4.21Å; T659-L699 HydrophobicContact CG2-CD2 3.98Å; T659-L699 PolarHBondContact OG1-O 2.84Å; I663-L699 HydrophobicContact CD1-CB 3.32Å; I663-L699 HydrophobicContact CD1-CD1 4.08Å; I663-L699 HydrophobicContact CD1-CG 4.33Å; I663-L699 HydrophobicContact CG1-CB 4Å; I663-L699 HydrophobicContact CG1-CD1 3.79Å; L695-L699 HydrophobicContact CD2-CD1 4.16Å; L695-L699 VanDerWaalsContact O-CB 3.28Å; L695-L699 WeakPolarHBondContact O-CB 3.28Å; L695-L699 PolarHBondContact O-N 3.45Å; L699-I752 HydrophobicContact CD2-CG2 3.56Å; L699-A754 WeakPolarHBondContact O-CB 3.44Å
700	L	88.3	Confident	88.7	Confident	7 Å²	7	45.5 Å²	45.5	4%	0.037	22%	0.22	C	C	.	.			trans	-117.9	125.4	179.2	-64.4	-176.9	0	0	0	112.8	I663 T696 S704 M707 K708	I663-L700 HydrophobicContact CD1-CD1 3.98Å; I663-L700 HydrophobicContact CD1-CD2 3.41Å; I663-L700 VanDerWaalsContact CD1-CD2 3.41Å; I663-L700 HydrophobicContact CD1-CG 3.33Å; T696-L700 HydrophobicContact CG2-CD1 3.87Å; T696-L700 VanDerWaalsContact O-CB 3.3Å; T696-L700 WeakPolarHBondContact O-CB 3.49Å; T696-L700 PolarHBondContact O-N 3.36Å; L700-S704 WeakPolarHBondContact CB-OG 3.42Å; L700-M707 HydrophobicContact CD1-CB 4.13Å; L700-M707 HydrophobicContact CD1-CG 3.81Å; L700-M707 HydrophobicContact CD2-CB 4.16Å; L700-M707 HydrophobicContact CD2-CG 3.91Å; L700-K708 HydrophobicContact CB-CG 4.25Å; L700-K708 HydrophobicContact CD1-CG 3.8Å
701	D	84.8	Confident	88.7	Confident	15 Å²	15	45.5 Å²	45.5	8%	0.08	22%	0.22	C	C	.	.			trans	-80.5	175.1	172.4	73.5	-0.9	0	0	0	112.5	K656 Q703 S704 K708 A754	K656-D701 WeakPolarHBondContact CE-OD2 3.33Å; K656-D701 IonicContact NZ-OD2 2.75Å; K656-D701 PolarHBondContact NZ-OD2 2.83Å; D701-Q703 PolarHBondContact O-N 3.18Å; D701-Q703 PolarHBondContact OD1-N 2.9Å; D701-S704 PolarHBondContact O-N 2.68Å; D701-S704 PolarHBondContact O-OG 2.89Å; D701-S704 WeakPolarHBondContact OD1-CB 3.43Å; D701-S704 PolarHBondContact OD1-N 3.33Å; D701-K708 WeakPolarHBondContact O-CE 3.47Å; D701-K708 PolarHBondContact O-NZ 3.09Å; D701-A754 HydrophobicContact CB-CB 4.07Å
702	D	79.9	Confident	88.7	Confident	96 Å²	96	53.2 Å²	53.2	51%	0.513	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.2	178.2	-64	-34.6	0	0	0	114.1	K708 R761	D702-K708 IonicContact OD1-NZ 3.95Å; D702-K708 PolarHBondContact OD1-NZ 3.49Å; D702-K708 VanDerWaalsContact OD1-NZ 3.15Å; D702-R761 IonicContact OD2-NH1 3.1Å; D702-R761 PolarHBondContact OD2-NH1 2.91Å; D702-R761 VanDerWaalsContact OD2-NH1 3.1Å
703	Q	83.9	Confident	88.7	Confident	158 Å²	158	58.1 Å²	58.1	74%	0.738	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-22.6	-178.4	-58.3	-59.2	-28.7	0	0	113.1	D701 T705	D701-Q703 PolarHBondContact O-N 3.18Å; D701-Q703 PolarHBondContact OD1-N 2.9Å; Q703-T705 PolarHBondContact O-N 2.73Å
704	S	85.7	Confident	88.5	Confident	7 Å²	7	56.7 Å²	56.7	5%	0.049	27%	0.266	C	S	.	.			trans	-71.4	42.6	179.5	67.8	0	0	0	0	115.1	H660 L700 D701 K706 M707 K708	H660-S704 VanDerWaalsContact CE1-CB 3.45Å; H660-S704 WeakPolarHBondContact CE1-CB 3.25Å; H660-S704 VanDerWaalsContact NE2-CB 3.3Å; H660-S704 WeakPolarHBondContact NE2-CB 3.48Å; L700-S704 WeakPolarHBondContact CB-OG 3.42Å; D701-S704 PolarHBondContact O-N 2.68Å; D701-S704 PolarHBondContact O-OG 2.89Å; D701-S704 WeakPolarHBondContact OD1-CB 3.43Å; D701-S704 PolarHBondContact OD1-N 3.33Å; S704-K706 VanDerWaalsContact C-N 3.32Å; S704-K706 PolarHBondContact O-N 2.94Å; S704-M707 PolarHBondContact O-N 2.95Å; S704-M707 VanDerWaalsContact O-N 3.12Å; S704-K708 PolarHBondContact O-N 3.1Å
705	T	86.8	Confident	88.5	Confident	92 Å²	92	57.8 Å²	57.8	56%	0.564	27%	0.271	S	S	*	.	H	α-helix	trans	-54.5	-40.5	-172.9	56.8	0	0	0	0	114.3	Q703 K709	Q703-T705 PolarHBondContact O-N 2.73Å; T705-K709 WeakPolarHBondContact O-CB 3.47Å; T705-K709 PolarHBondContact O-N 2.96Å
706	K	88.9	Confident	88.3	Confident	185 Å²	185	61 Å²	61	80%	0.804	30%	0.295	S	S	*	.	H	α-helix	trans	-62.8	-49	177.5	-68.7	-176.6	-179.6	179.1	0	111.5	S704 K709 R710	S704-K706 VanDerWaalsContact C-N 3.32Å; S704-K706 PolarHBondContact O-N 2.94Å; K706-K709 WeakPolarHBondContact O-CB 3.22Å; K706-K709 PolarHBondContact O-N 3.22Å; K706-R710 PolarHBondContact O-N 3.48Å; K706-R710 VanDerWaalsContact O-N 3.12Å
707	M	87.4	Confident	88.2	Confident	29 Å²	29	63.4 Å²	63.4	14%	0.143	31%	0.309	C	S	.	.	H	α-helix	trans	-69.1	-42.4	-179.9	-168.2	56.9	73.3	0	0	111.2	I663 L700 S704 K709 R710 C711	I663-M707 HydrophobicContact CG2-CG 4.11Å; I663-M707 HydrophobicContact CG2-SD 4.25Å; L700-M707 HydrophobicContact CD1-CB 4.13Å; L700-M707 HydrophobicContact CD1-CG 3.81Å; L700-M707 HydrophobicContact CD2-CB 4.16Å; L700-M707 HydrophobicContact CD2-CG 3.91Å; S704-M707 PolarHBondContact O-N 2.95Å; S704-M707 VanDerWaalsContact O-N 3.12Å; M707-K709 PolarHBondContact O-N 2.92Å; M707-R710 WeakPolarHBondContact O-CA 3.35Å; M707-R710 WeakPolarHBondContact O-CB 3.32Å; M707-R710 PolarHBondContact O-N 3.3Å; M707-R710 HydrophobicContact SD-CB 4.27Å; M707-C711 PolarHBondContact O-N 2.95Å; M707-C711 PolarHBondContact O-SG 3.37Å
708	K	89	Confident	88.2	Confident	48 Å²	48	61 Å²	61	21%	0.209	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-32.2	171.9	-76.6	-178.5	166.6	174.6	0	112.9	L700 D701 D702 S704 R712	L700-K708 HydrophobicContact CB-CG 4.25Å; L700-K708 HydrophobicContact CD1-CG 3.8Å; D701-K708 WeakPolarHBondContact O-CE 3.47Å; D701-K708 PolarHBondContact O-NZ 3.09Å; D702-K708 IonicContact OD1-NZ 3.95Å; D702-K708 PolarHBondContact OD1-NZ 3.49Å; D702-K708 VanDerWaalsContact OD1-NZ 3.15Å; S704-K708 PolarHBondContact O-N 3.1Å; K708-R712 WeakPolarHBondContact O-CB 3.49Å; K708-R712 WeakPolarHBondContact O-CG 3.44Å; K708-R712 PolarHBondContact O-N 2.9Å; K708-R712 VanDerWaalsContact O-N 3.09Å; K708-R712 PolarHBondContact O-NE 3.38Å; K708-R712 VanDerWaalsContact O-NE 3.15Å
709	K	91	Very high	88.2	Confident	126 Å²	126	64.7 Å²	64.7	55%	0.548	31%	0.31	S	S	.	.	H	α-helix	trans	-67.7	-44.9	172.2	-174.7	-179.9	177.1	-177.5	0	111	T705 K706 M707 R712 Q713	T705-K709 WeakPolarHBondContact O-CB 3.47Å; T705-K709 PolarHBondContact O-N 2.96Å; K706-K709 WeakPolarHBondContact O-CB 3.22Å; K706-K709 PolarHBondContact O-N 3.22Å; M707-K709 PolarHBondContact O-N 2.92Å; K709-R712 PolarHBondContact O-N 3.05Å; K709-Q713 WeakPolarHBondContact O-CG 3.24Å; K709-Q713 PolarHBondContact O-N 2.87Å; K709-Q713 VanDerWaalsContact O-N 3.08Å
710	R	91.2	Very high	88	Confident	75 Å²	75	67.7 Å²	67.7	28%	0.283	34%	0.342	S	S	.	.	H	α-helix	trans	-59.8	-50.9	176	-162.7	-174.4	-179.7	163	5	111.6	S664 V667 E668 D671 K706 M707 R712 Q713 T714	S664-R710 PolarHBondContact OG-NH1 2.99Å; S664-R710 VanDerWaalsContact OG-NH1 3.13Å; V667-R710 HydrophobicContact CG1-CG 3.97Å; E668-R710 IonicContact OE1-CZ 3.15Å; E668-R710 IonicContact OE1-NH1 3.64Å; E668-R710 PolarHBondContact OE1-NH1 3.41Å; E668-R710 IonicContact OE1-NH2 2.69Å; D671-R710 IonicContact OD2-NH2 3.51Å; K706-R710 PolarHBondContact O-N 3.48Å; K706-R710 VanDerWaalsContact O-N 3.12Å; M707-R710 WeakPolarHBondContact O-CA 3.35Å; M707-R710 WeakPolarHBondContact O-CB 3.32Å; M707-R710 PolarHBondContact O-N 3.3Å; M707-R710 HydrophobicContact SD-CB 4.27Å; R710-R712 VanDerWaalsContact C-N 3.28Å; R710-R712 PolarHBondContact O-N 3.01Å; R710-Q713 WeakPolarHBondContact O-CB 3.4Å; R710-Q713 PolarHBondContact O-N 3Å; R710-T714 PolarHBondContact O-N 3.37Å; R710-T714 VanDerWaalsContact O-N 3.15Å
711	C	91	Very high	87.8	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.5	-39.2	176.1	-58.4	0	0	0	0	112	I663 T696 M707 Q713 T714 I715	I663-C711 VanDerWaalsContact CG2-SG 3.58Å; T696-C711 HydrophobicContact CG2-CB 4.16Å; M707-C711 PolarHBondContact O-N 2.95Å; M707-C711 PolarHBondContact O-SG 3.37Å; C711-Q713 VanDerWaalsContact C-N 3.31Å; C711-Q713 PolarHBondContact O-N 3.05Å; C711-T714 PolarHBondContact O-N 3.19Å; C711-I715 WeakPolarHBondContact O-CB 3.43Å; C711-I715 WeakPolarHBondContact O-CD1 3.36Å; C711-I715 WeakPolarHBondContact O-CG1 3.49Å; C711-I715 PolarHBondContact O-N 2.9Å
712	R	91.4	Very high	87.7	Confident	163 Å²	163	73.3 Å²	73.3	62%	0.615	36%	0.363	S	S	*	.	H	α-helix	trans	-63.9	-34	175.6	-79.5	-178.1	-66	169.8	-0.5	113.2	K708 K709 R710 S716	K708-R712 WeakPolarHBondContact O-CB 3.49Å; K708-R712 WeakPolarHBondContact O-CG 3.44Å; K708-R712 PolarHBondContact O-N 2.9Å; K708-R712 VanDerWaalsContact O-N 3.09Å; K708-R712 PolarHBondContact O-NE 3.38Å; K708-R712 VanDerWaalsContact O-NE 3.15Å; K709-R712 PolarHBondContact O-N 3.05Å; R710-R712 VanDerWaalsContact C-N 3.28Å; R710-R712 PolarHBondContact O-N 3.01Å; R712-S716 WeakPolarHBondContact O-CB 3.45Å; R712-S716 PolarHBondContact O-N 2.73Å
713	Q	92	Very high	87.9	Confident	105 Å²	105	72.4 Å²	72.4	49%	0.491	36%	0.358	S	S	.	.	H	α-helix	trans	-66.2	-50.4	175.4	-70.1	167.1	-37.5	0	0	110.3	K709 R710 C711 I715 S716 T717	K709-Q713 WeakPolarHBondContact O-CG 3.24Å; K709-Q713 PolarHBondContact O-N 2.87Å; K709-Q713 VanDerWaalsContact O-N 3.08Å; R710-Q713 WeakPolarHBondContact O-CB 3.4Å; R710-Q713 PolarHBondContact O-N 3Å; C711-Q713 VanDerWaalsContact C-N 3.31Å; C711-Q713 PolarHBondContact O-N 3.05Å; Q713-I715 VanDerWaalsContact C-N 3.32Å; Q713-I715 PolarHBondContact O-N 3.11Å; Q713-S716 WeakPolarHBondContact O-CA 3.35Å; Q713-S716 WeakPolarHBondContact O-CB 3.37Å; Q713-S716 PolarHBondContact O-N 3.34Å; Q713-S716 PolarHBondContact O-OG 3.43Å; Q713-T717 PolarHBondContact O-N 2.91Å
714	T	88.9	Confident	87.7	Confident	4 Å²	4	68.4 Å²	68.4	3%	0.025	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-34.1	176.8	-49.7	0	0	0	0	112.3	V667 M670 D671 L674 L692 R710 C711 S716 T717 L718	V667-T714 VanDerWaalsContact CG1-OG1 3.3Å; V667-T714 WeakPolarHBondContact CG1-OG1 3.37Å; M670-T714 HydrophobicContact CB-CG2 4.18Å; D671-T714 WeakPolarHBondContact OD1-CG2 2.87Å; D671-T714 PolarHBondContact OD1-OG1 2.74Å; L674-T714 HydrophobicContact CD1-CG2 4.23Å; L692-T714 HydrophobicContact CD2-CG2 4.08Å; R710-T714 PolarHBondContact O-N 3.37Å; R710-T714 VanDerWaalsContact O-N 3.15Å; C711-T714 PolarHBondContact O-N 3.19Å; T714-S716 VanDerWaalsContact C-N 3.29Å; T714-S716 PolarHBondContact O-N 2.93Å; T714-T717 WeakPolarHBondContact CA-OG1 3.18Å; T714-T717 PolarHBondContact O-N 2.92Å; T714-T717 PolarHBondContact O-OG1 3.42Å; T714-L718 HydrophobicContact CG2-CD1 4.33Å; T714-L718 WeakPolarHBondContact O-CB 3.38Å; T714-L718 WeakPolarHBondContact O-CD1 3.49Å; T714-L718 VanDerWaalsContact O-CG 3.28Å; T714-L718 WeakPolarHBondContact O-CG 3.41Å; T714-L718 PolarHBondContact O-N 3.19Å
715	I	90.7	Very high	87.5	Confident	22 Å²	22	76 Å²	76	11%	0.113	39%	0.385	C	S	.	.	H	α-helix	trans	-63.3	-37.1	170.7	-69.9	164.6	0	0	0	110.8	L692 Q693 C711 Q713 K719	L692-I715 HydrophobicContact CD2-CD1 4.42Å; L692-I715 HydrophobicContact CD2-CG1 3.66Å; L692-I715 HydrophobicContact CG-CD1 4.4Å; L692-I715 HydrophobicContact CG-CG1 4.09Å; Q693-I715 HydrophobicContact CG-CD1 4.17Å; C711-I715 WeakPolarHBondContact O-CB 3.43Å; C711-I715 WeakPolarHBondContact O-CD1 3.36Å; C711-I715 WeakPolarHBondContact O-CG1 3.49Å; C711-I715 PolarHBondContact O-N 2.9Å; Q713-I715 VanDerWaalsContact C-N 3.32Å; Q713-I715 PolarHBondContact O-N 3.11Å; I715-K719 HydrophobicContact CG2-CD 4.23Å; I715-K719 HydrophobicContact CG2-CG 4.5Å; I715-K719 WeakPolarHBondContact O-CB 3.46Å; I715-K719 VanDerWaalsContact O-CG 3.25Å; I715-K719 WeakPolarHBondContact O-CG 3.23Å; I715-K719 PolarHBondContact O-N 2.91Å
716	S	88.7	Confident	87.2	Confident	71 Å²	71	74.4 Å²	74.4	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-69.9	-37.2	177.8	76.2	0	0	0	0	112.7	R712 Q713 T714 K719 G720	R712-S716 WeakPolarHBondContact O-CB 3.45Å; R712-S716 PolarHBondContact O-N 2.73Å; Q713-S716 WeakPolarHBondContact O-CA 3.35Å; Q713-S716 WeakPolarHBondContact O-CB 3.37Å; Q713-S716 PolarHBondContact O-N 3.34Å; Q713-S716 PolarHBondContact O-OG 3.43Å; T714-S716 VanDerWaalsContact C-N 3.29Å; T714-S716 PolarHBondContact O-N 2.93Å; S716-K719 PolarHBondContact O-N 3.49Å; S716-G720 PolarHBondContact O-N 3.43Å
717	T	88.3	Confident	86.8	Confident	69 Å²	69	67 Å²	67	42%	0.423	34%	0.341	S	S	.	.	H	α-helix	trans	-68.8	-41	175.9	55.5	0	0	0	0	111.3	L674 Q713 T714 G720 R721	L674-T717 WeakPolarHBondContact CD1-OG1 3.4Å; Q713-T717 PolarHBondContact O-N 2.91Å; T714-T717 WeakPolarHBondContact CA-OG1 3.18Å; T714-T717 PolarHBondContact O-N 2.92Å; T714-T717 PolarHBondContact O-OG1 3.42Å; T717-G720 PolarHBondContact O-N 2.94Å; T717-R721 PolarHBondContact O-N 3.45Å
718	L	86.8	Confident	86.6	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-45.1	172.9	-72.8	164.8	0	0	0	111.9	M670 L674 V685 L688 L689 L692 T714 G720 R721	M670-L718 HydrophobicContact CE-CD1 3.62Å; L674-L718 HydrophobicContact CD1-CD2 4.16Å; L674-L718 HydrophobicContact CD1-CG 4.19Å; L674-L718 HydrophobicContact CD2-CD2 3.88Å; L674-L718 HydrophobicContact CG-CD2 4.4Å; V685-L718 HydrophobicContact CG1-CB 4.33Å; V685-L718 HydrophobicContact CG1-CD2 3.96Å; V685-L718 WeakPolarHBondContact CG1-O 3.43Å; L688-L718 HydrophobicContact CB-CD2 4.35Å; L689-L718 HydrophobicContact CB-CB 4.46Å; L689-L718 HydrophobicContact CB-CD1 4.45Å; L689-L718 HydrophobicContact CD1-CB 4.24Å; L692-L718 HydrophobicContact CD2-CD1 4.17Å; T714-L718 HydrophobicContact CG2-CD1 4.33Å; T714-L718 WeakPolarHBondContact O-CB 3.38Å; T714-L718 WeakPolarHBondContact O-CD1 3.49Å; T714-L718 VanDerWaalsContact O-CG 3.28Å; T714-L718 WeakPolarHBondContact O-CG 3.41Å; T714-L718 PolarHBondContact O-N 3.19Å; L718-G720 VanDerWaalsContact C-N 3.28Å; L718-G720 PolarHBondContact O-N 3.4Å; L718-R721 PolarHBondContact O-N 2.86Å; L718-R721 VanDerWaalsContact O-N 3.12Å
719	K	88.1	Confident	86.2	Confident	81 Å²	81	74.3 Å²	74.3	35%	0.352	38%	0.378	S	S	.	.	H	α-helix	trans	-60	-38.3	176.2	-77.2	179.8	178.7	-173	0	112.6	L689 I715 S716 R721 V722 L727	L689-K719 HydrophobicContact CD1-CG 3.5Å; L689-K719 VanDerWaalsContact CD1-CG 3.5Å; I715-K719 HydrophobicContact CG2-CD 4.23Å; I715-K719 HydrophobicContact CG2-CG 4.5Å; I715-K719 WeakPolarHBondContact O-CB 3.46Å; I715-K719 VanDerWaalsContact O-CG 3.25Å; I715-K719 WeakPolarHBondContact O-CG 3.23Å; I715-K719 PolarHBondContact O-N 2.91Å; S716-K719 PolarHBondContact O-N 3.49Å; K719-R721 PolarHBondContact O-N 3.49Å; K719-V722 PolarHBondContact O-N 3.44Å; K719-L727 HydrophobicContact CB-CD2 3.81Å; K719-L727 HydrophobicContact CD-CD2 4.25Å; K719-L727 HydrophobicContact CG-CD1 4.43Å; K719-L727 HydrophobicContact CG-CD2 3.82Å
720	G	86.1	Confident	85.8	Confident	68 Å²	68	68.7 Å²	68.7	70%	0.701	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.4	177.7	0	0	0	0	0	114.7	S716 T717 L718	S716-G720 PolarHBondContact O-N 3.43Å; T717-G720 PolarHBondContact O-N 2.94Å; L718-G720 VanDerWaalsContact C-N 3.28Å; L718-G720 PolarHBondContact O-N 3.4Å
721	R	82.8	Confident	85.4	Confident	130 Å²	130	66.8 Å²	66.8	49%	0.491	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-12.1	176.4	-65.4	-72.7	-164.9	161	6.9	113.3	L674 V685 T717 L718 K719	L674-R721 HydrophobicContact CD2-CG 4.37Å; L674-R721 PolarHBondContact O-NH2 2.89Å; V685-R721 HydrophobicContact CG1-CB 4.16Å; T717-R721 PolarHBondContact O-N 3.45Å; L718-R721 PolarHBondContact O-N 2.86Å; L718-R721 VanDerWaalsContact O-N 3.12Å; K719-R721 PolarHBondContact O-N 3.49Å
722	V	83.8	Confident	85.1	Confident	10 Å²	10	70.8 Å²	70.8	6%	0.061	38%	0.376	C	S	.	.	S	Bend	trans	-95.1	143.9	177.3	-175.8	0	0	0	0	108.7	Q682 V685 V686 K719 A724 L727	Q682-V722 HydrophobicContact CG-CG1 4.12Å; V685-V722 HydrophobicContact CB-CG2 4.21Å; V685-V722 HydrophobicContact CG1-CG2 3.56Å; V686-V722 HydrophobicContact CG2-CG1 4.22Å; V686-V722 HydrophobicContact CG2-CG2 4.06Å; K719-V722 PolarHBondContact O-N 3.44Å; V722-A724 PolarHBondContact O-N 2.98Å; V722-L727 HydrophobicContact CB-CB 4.5Å; V722-L727 HydrophobicContact CG1-CB 4.07Å
723	D	82.6	Confident	84.7	Confident	77 Å²	77	69.2 Å²	69.2	41%	0.412	37%	0.371	S	S	.	.			trans	-55.6	137.5	172.6	-175	-86.3	0	0	0	110.8	F725 D726 L727	D723-F725 VanDerWaalsContact C-N 3.35Å; D723-F725 PolarHBondContact O-N 3.26Å; D723-F725 WeakPolarHBondContact OD1-CB 3.41Å; D723-F725 PolarHBondContact OD1-N 2.9Å; D723-D726 HydrophobicContact CB-CB 4.25Å; D723-D726 PolarHBondContact O-N 2.91Å; D723-D726 PolarHBondContact OD1-N 3.43Å; D723-L727 WeakPolarHBondContact O-CB 3.38Å; D723-L727 PolarHBondContact O-N 3.29Å
724	A	80.8	Confident	84.4	Confident	73 Å²	73	64.5 Å²	64.5	60%	0.603	35%	0.349	S	S	*	.	H	α-helix	trans	-65.5	-36.8	-172.5	0	0	0	0	0	112.7	V722 E728	V722-A724 PolarHBondContact O-N 2.98Å; A724-E728 PolarHBondContact O-N 3.23Å; A724-E728 VanDerWaalsContact O-N 3.14Å
725	F	81.2	Confident	84.3	Confident	168 Å²	168	70.3 Å²	70.3	74%	0.737	37%	0.374	S	S	*	.	H	α-helix	trans	-71.1	-45.4	179.2	-69.2	-77	0	0	0	111	D723 L727 E728 L729	D723-F725 VanDerWaalsContact C-N 3.35Å; D723-F725 PolarHBondContact O-N 3.26Å; D723-F725 WeakPolarHBondContact OD1-CB 3.41Å; D723-F725 PolarHBondContact OD1-N 2.9Å; F725-L727 VanDerWaalsContact C-N 3.32Å; F725-L727 PolarHBondContact O-N 3.5Å; F725-E728 PolarHBondContact O-N 3.5Å; F725-L729 PolarHBondContact O-N 3.32Å
726	D	80.9	Confident	84	Confident	58 Å²	58	71.7 Å²	71.7	31%	0.31	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-44.5	176.2	-71.3	-20.1	0	0	0	110.8	Q682 D723 E728 L729 M730	Q682-D726 PolarHBondContact NE2-OD2 3.18Å; D723-D726 HydrophobicContact CB-CB 4.25Å; D723-D726 PolarHBondContact O-N 2.91Å; D723-D726 PolarHBondContact OD1-N 3.43Å; D726-E728 PolarHBondContact O-N 3.34Å; D726-L729 PolarHBondContact O-N 2.82Å; D726-M730 WeakPolarHBondContact O-CB 3.36Å; D726-M730 WeakPolarHBondContact O-CG 3.49Å; D726-M730 PolarHBondContact O-N 3.26Å
727	L	80.9	Confident	83.9	Confident	28 Å²	28	68.8 Å²	68.8	15%	0.147	37%	0.367	C	S	.	.	H	α-helix	trans	-62.9	-39.3	179.9	-176.8	64.9	0	0	0	112.5	K719 V722 D723 F725 M730 T731	K719-L727 HydrophobicContact CB-CD2 3.81Å; K719-L727 HydrophobicContact CD-CD2 4.25Å; K719-L727 HydrophobicContact CG-CD1 4.43Å; K719-L727 HydrophobicContact CG-CD2 3.82Å; V722-L727 HydrophobicContact CB-CB 4.5Å; V722-L727 HydrophobicContact CG1-CB 4.07Å; D723-L727 WeakPolarHBondContact O-CB 3.38Å; D723-L727 PolarHBondContact O-N 3.29Å; F725-L727 VanDerWaalsContact C-N 3.32Å; F725-L727 PolarHBondContact O-N 3.5Å; L727-M730 PolarHBondContact O-N 3.39Å; L727-T731 WeakPolarHBondContact O-CB 3.35Å; L727-T731 PolarHBondContact O-N 3.3Å; L727-T731 PolarHBondContact O-OG1 3.43Å
728	E	81.9	Confident	83.9	Confident	151 Å²	151	66.1 Å²	66.1	71%	0.706	35%	0.351	S	S	*	.	H	α-helix	trans	-63.4	-44.3	177.9	-171.6	170.7	-172.4	0	0	111.1	A724 F725 D726 M730 P732	A724-E728 PolarHBondContact O-N 3.23Å; A724-E728 VanDerWaalsContact O-N 3.14Å; F725-E728 PolarHBondContact O-N 3.5Å; D726-E728 PolarHBondContact O-N 3.34Å; E728-M730 PolarHBondContact O-N 2.95Å; E728-P732 WeakPolarHBondContact O-CD 3.22Å
729	L	81.4	Confident	83.8	Confident	80 Å²	80	71.4 Å²	71.4	42%	0.419	37%	0.374	S	S	.	.	H	α-helix	trans	-65.9	-38.1	177.5	-172.7	65.4	0	0	0	112.4	I608 M621 F725 D726	I608-L729 HydrophobicContact CD1-CD2 3.23Å; I608-L729 HydrophobicContact CG1-CD2 3.78Å; M621-L729 HydrophobicContact CE-CB 4.28Å; M621-L729 HydrophobicContact CE-CD2 3.61Å; M621-L729 HydrophobicContact CE-CG 3.65Å; M621-L729 HydrophobicContact SD-CB 4.33Å; M621-L729 HydrophobicContact SD-CD2 3.72Å; M621-L729 HydrophobicContact SD-CG 4.14Å; F725-L729 PolarHBondContact O-N 3.32Å; D726-L729 PolarHBondContact O-N 2.82Å
730	M	82.4	Confident	83.6	Confident	8 Å²	8	71 Å²	71	4%	0.039	37%	0.373	C	S	.	.	H	α-helix	trans	-76.6	-32.6	-179.1	-66.7	176.7	96	0	0	113.5	M621 L622 I623 V686 D726 L727 E728 R733 L734	M621-M730 HydrophobicContact CE-CG 3.62Å; M621-M730 HydrophobicContact CG-CE 4.37Å; M621-M730 HydrophobicContact CG-CG 4.18Å; M621-M730 HydrophobicContact CG-SD 4.39Å; M621-M730 HydrophobicContact SD-CG 3.28Å; M621-M730 WeakPolarHBondContact SD-CG 3.49Å; M621-M730 HydrophobicContact SD-SD 4.04Å; L622-M730 WeakPolarHBondContact O-CE 3.32Å; I623-M730 HydrophobicContact CB-CE 4.41Å; I623-M730 HydrophobicContact CG1-CE 3.97Å; I623-M730 HydrophobicContact CG1-CG 4.34Å; V686-M730 HydrophobicContact CB-CE 4.33Å; V686-M730 HydrophobicContact CG1-CE 3.49Å; V686-M730 VanDerWaalsContact CG1-CE 3.49Å; V686-M730 HydrophobicContact CG1-SD 4.29Å; V686-M730 HydrophobicContact CG2-CE 4.1Å; V686-M730 HydrophobicContact CG2-SD 4.07Å; D726-M730 WeakPolarHBondContact O-CB 3.36Å; D726-M730 WeakPolarHBondContact O-CG 3.49Å; D726-M730 PolarHBondContact O-N 3.26Å; L727-M730 PolarHBondContact O-N 3.39Å; E728-M730 PolarHBondContact O-N 2.95Å; M730-R733 PolarHBondContact O-N 3.06Å; M730-L734 VanDerWaalsContact O-CB 3.27Å; M730-L734 WeakPolarHBondContact O-CB 3.48Å; M730-L734 PolarHBondContact O-N 3.36Å
731	T	83.7	Confident	83.6	Confident	35 Å²	35	68.4 Å²	68.4	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-50.5	-47.5	-170.4	-70.3	0	0	0	0	115.6	L727 K735	L727-T731 WeakPolarHBondContact O-CB 3.35Å; L727-T731 PolarHBondContact O-N 3.3Å; L727-T731 PolarHBondContact O-OG1 3.43Å; T731-K735 HydrophobicContact CG2-CD 4.15Å; T731-K735 WeakPolarHBondContact O-CB 3.31Å; T731-K735 WeakPolarHBondContact O-CG 3.32Å; T731-K735 PolarHBondContact O-N 2.83Å
732	P	84.8	Confident	83.7	Confident	84 Å²	84	62.2 Å²	62.2	55%	0.545	32%	0.319	S	S	.	.	H	α-helix	trans	-65.3	-43.5	-178.6	23.8	-32.9	0	0	0	112.5	E728 K735 A736	E728-P732 WeakPolarHBondContact O-CD 3.22Å; P732-K735 PolarHBondContact O-N 2.91Å; P732-A736 PolarHBondContact O-N 2.95Å; P732-A736 VanDerWaalsContact O-N 3.12Å
733	R	82.3	Confident	83.7	Confident	131 Å²	131	64.5 Å²	64.5	49%	0.494	33%	0.331	S	S	.	.	H	α-helix	trans	-68	-42.9	177.5	-70	-74.3	177.4	161.4	-6.3	111.4	E604 I623 M730 K735 A736 N737	E604-R733 IonicContact OE1-CZ 3.62Å; E604-R733 IonicContact OE1-NH1 2.76Å; E604-R733 PolarHBondContact OE1-NH1 2.81Å; I623-R733 HydrophobicContact CD1-CB 3.48Å; I623-R733 VanDerWaalsContact CD1-CB 3.48Å; I623-R733 HydrophobicContact CD1-CG 3.86Å; I623-R733 HydrophobicContact CG2-CB 4.35Å; M730-R733 PolarHBondContact O-N 3.06Å; R733-K735 VanDerWaalsContact C-N 3.32Å; R733-K735 PolarHBondContact O-N 3.3Å; R733-A736 WeakPolarHBondContact O-CB 3.32Å; R733-A736 PolarHBondContact O-N 2.92Å; R733-A736 VanDerWaalsContact O-N 3.08Å; R733-N737 WeakPolarHBondContact O-CB 3.15Å; R733-N737 VanDerWaalsContact O-CG 3.25Å; R733-N737 PolarHBondContact O-N 3.46Å; R733-N737 PolarHBondContact O-OD1 2.97Å
734	L	85.1	Confident	83.7	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.031	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-44.9	176.5	-166.6	76.9	0	0	0	111.4	I623 V686 L689 F690 M730 A736 N737 V738	I623-L734 HydrophobicContact CG2-CD1 4.2Å; V686-L734 HydrophobicContact CG1-CD1 4.42Å; L689-L734 HydrophobicContact CD2-CD2 3.2Å; F690-L734 HydrophobicContact CB-CD1 4.1Å; F690-L734 HydrophobicContact CD2-CD1 3.7Å; F690-L734 HydrophobicContact CD2-CG 4.38Å; F690-L734 HydrophobicContact CG-CD1 4.37Å; M730-L734 VanDerWaalsContact O-CB 3.27Å; M730-L734 WeakPolarHBondContact O-CB 3.48Å; M730-L734 PolarHBondContact O-N 3.36Å; L734-A736 VanDerWaalsContact C-N 3.34Å; L734-A736 PolarHBondContact O-N 2.84Å; L734-N737 PolarHBondContact O-N 3.49Å; L734-V738 WeakPolarHBondContact O-CB 3.34Å; L734-V738 WeakPolarHBondContact O-CG2 3.35Å; L734-V738 PolarHBondContact O-N 3.46Å
735	K	86.7	Confident	84	Confident	125 Å²	125	63.1 Å²	63.1	54%	0.543	31%	0.305	S	S	.	.	H	α-helix	trans	-62	-39.3	174.9	-75.3	174.3	179.9	174.1	0	112.5	T731 P732 R733 K739	T731-K735 HydrophobicContact CG2-CD 4.15Å; T731-K735 WeakPolarHBondContact O-CB 3.31Å; T731-K735 WeakPolarHBondContact O-CG 3.32Å; T731-K735 PolarHBondContact O-N 2.83Å; P732-K735 PolarHBondContact O-N 2.91Å; R733-K735 VanDerWaalsContact C-N 3.32Å; R733-K735 PolarHBondContact O-N 3.3Å; K735-K739 WeakPolarHBondContact O-CG 3.2Å; K735-K739 PolarHBondContact O-N 3.39Å; K735-K739 VanDerWaalsContact O-N 3.13Å
736	A	85.1	Confident	84.2	Confident	51 Å²	51	55.3 Å²	55.3	42%	0.421	27%	0.271	S	S	.	.	H	α-helix	trans	-64.4	-47.2	175.8	0	0	0	0	0	111.1	P732 R733 L734 V738 K739 Q740	P732-A736 PolarHBondContact O-N 2.95Å; P732-A736 VanDerWaalsContact O-N 3.12Å; R733-A736 WeakPolarHBondContact O-CB 3.32Å; R733-A736 PolarHBondContact O-N 2.92Å; R733-A736 VanDerWaalsContact O-N 3.08Å; L734-A736 VanDerWaalsContact C-N 3.34Å; L734-A736 PolarHBondContact O-N 2.84Å; A736-V738 PolarHBondContact O-N 3Å; A736-K739 WeakPolarHBondContact O-CB 3.45Å; A736-K739 PolarHBondContact O-N 3.26Å; A736-Q740 PolarHBondContact O-N 2.84Å
737	N	87.1	Confident	83.9	Confident	11 Å²	11	55.9 Å²	55.9	6%	0.059	28%	0.277	C	S	.	.	H	α-helix	trans	-64.2	-40.1	179	-66.3	-3.1	0	0	0	111.5	P624 C625 F690 R733 L734 K739 Q740 Q741	P624-N737 PolarHBondContact O-ND2 3.11Å; C625-N737 PolarHBondContact SG-ND2 3.33Å; C625-N737 VanDerWaalsContact SG-ND2 3.4Å; F690-N737 HydrophobicContact CE2-CB 3.74Å; F690-N737 HydrophobicContact CZ-CB 4.47Å; R733-N737 WeakPolarHBondContact O-CB 3.15Å; R733-N737 VanDerWaalsContact O-CG 3.25Å; R733-N737 PolarHBondContact O-N 3.46Å; R733-N737 PolarHBondContact O-OD1 2.97Å; L734-N737 PolarHBondContact O-N 3.49Å; N737-K739 VanDerWaalsContact C-N 3.34Å; N737-K739 PolarHBondContact O-N 3.36Å; N737-Q740 PolarHBondContact O-N 2.99Å; N737-Q741 WeakPolarHBondContact O-CB 3.46Å; N737-Q741 PolarHBondContact O-N 2.8Å
738	V	87.4	Confident	84	Confident	12 Å²	12	59.5 Å²	59.5	7%	0.073	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-45.6	174.9	167.4	0	0	0	0	110	F690 Q693 V694 L734 A736 T742	F690-V738 HydrophobicContact CD2-CG2 3.56Å; F690-V738 HydrophobicContact CE2-CB 4.39Å; F690-V738 HydrophobicContact CE2-CG2 3.67Å; F690-V738 HydrophobicContact CG-CG2 4.46Å; Q693-V738 HydrophobicContact CB-CG1 4.1Å; Q693-V738 HydrophobicContact CB-CG2 3.94Å; V694-V738 HydrophobicContact CG2-CB 4.29Å; V694-V738 HydrophobicContact CG2-CG1 4.03Å; V694-V738 HydrophobicContact CG2-CG2 4.14Å; L734-V738 WeakPolarHBondContact O-CB 3.34Å; L734-V738 WeakPolarHBondContact O-CG2 3.35Å; L734-V738 PolarHBondContact O-N 3.46Å; A736-V738 PolarHBondContact O-N 3Å; V738-T742 VanDerWaalsContact O-CB 3.22Å; V738-T742 WeakPolarHBondContact O-CB 3.44Å; V738-T742 PolarHBondContact O-N 3.35Å; V738-T742 PolarHBondContact O-OG1 3.38Å
739	K	84.9	Confident	84.3	Confident	113 Å²	113	52.9 Å²	52.9	49%	0.491	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-49.9	177	-74.7	178.7	178.9	-172.8	0	111.9	K735 A736 N737 Q741 T742 L743	K735-K739 WeakPolarHBondContact O-CG 3.2Å; K735-K739 PolarHBondContact O-N 3.39Å; K735-K739 VanDerWaalsContact O-N 3.13Å; A736-K739 WeakPolarHBondContact O-CB 3.45Å; A736-K739 PolarHBondContact O-N 3.26Å; N737-K739 VanDerWaalsContact C-N 3.34Å; N737-K739 PolarHBondContact O-N 3.36Å; K739-Q741 PolarHBondContact O-N 2.86Å; K739-T742 PolarHBondContact O-N 3.28Å; K739-L743 WeakPolarHBondContact O-CG 3.23Å; K739-L743 PolarHBondContact O-N 3.32Å
740	Q	83.7	Confident	84.2	Confident	72 Å²	72	53.7 Å²	53.7	34%	0.336	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-45.8	-179	-174.2	-173.9	-5.4	0	0	111.4	A736 N737 L743 R744	A736-Q740 PolarHBondContact O-N 2.84Å; N737-Q740 PolarHBondContact O-N 2.99Å; Q740-L743 PolarHBondContact O-N 3.39Å; Q740-R744 WeakPolarHBondContact O-CG 3.2Å; Q740-R744 PolarHBondContact O-N 3.26Å; Q740-R744 VanDerWaalsContact O-N 3.14Å
741	Q	85.7	Confident	84	Confident	13 Å²	13	55.8 Å²	55.8	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-40.4	178.3	-174	65	-0.3	0	0	111.5	L627 F690 V694 N737 K739 L743 R744 L745	L627-Q741 HydrophobicContact CG-CG 4.44Å; F690-Q741 HydrophobicContact CE1-CB 4.42Å; F690-Q741 HydrophobicContact CE1-CG 4.11Å; F690-Q741 HydrophobicContact CZ-CB 3.76Å; F690-Q741 HydrophobicContact CZ-CG 3.94Å; V694-Q741 HydrophobicContact CG1-CG 4.42Å; V694-Q741 HydrophobicContact CG2-CB 4.37Å; V694-Q741 HydrophobicContact CG2-CG 4.34Å; N737-Q741 WeakPolarHBondContact O-CB 3.46Å; N737-Q741 PolarHBondContact O-N 2.8Å; K739-Q741 PolarHBondContact O-N 2.86Å; Q741-L743 PolarHBondContact O-N 3.19Å; Q741-R744 PolarHBondContact O-N 3.31Å; Q741-L745 HydrophobicContact CG-CD1 3.84Å; Q741-L745 HydrophobicContact CG-CG 4.43Å; Q741-L745 WeakPolarHBondContact O-CB 3.43Å; Q741-L745 WeakPolarHBondContact O-CG 3.5Å; Q741-L745 PolarHBondContact O-N 3.48Å; Q741-L745 VanDerWaalsContact O-N 3.08Å
742	T	85.4	Confident	84.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.9	-49.1	174.4	-58.5	0	0	0	0	110.7	T697 L698 V738 K739 R744 L745 V746 Y758	T697-T742 HydrophobicContact CG2-CG2 3.82Å; L698-T742 HydrophobicContact CD2-CG2 3.6Å; L698-T742 HydrophobicContact CG-CG2 3.97Å; V738-T742 VanDerWaalsContact O-CB 3.22Å; V738-T742 WeakPolarHBondContact O-CB 3.44Å; V738-T742 PolarHBondContact O-N 3.35Å; V738-T742 PolarHBondContact O-OG1 3.38Å; K739-T742 PolarHBondContact O-N 3.28Å; T742-R744 VanDerWaalsContact C-N 3.31Å; T742-R744 PolarHBondContact O-N 3.42Å; T742-L745 PolarHBondContact O-N 3.27Å; T742-L745 VanDerWaalsContact O-N 3.07Å; T742-V746 HydrophobicContact CG2-CG2 4.26Å; T742-V746 WeakPolarHBondContact O-CG2 3.4Å; T742-V746 PolarHBondContact O-N 2.83Å; T742-Y758 HydrophobicContact CG2-CD1 4.21Å; T742-Y758 HydrophobicContact CG2-CE1 3.43Å; T742-Y758 VanDerWaalsContact CG2-CE1 3.43Å; T742-Y758 HydrophobicContact CG2-CE2 4.46Å
743	L	83.6	Confident	84	Confident	59 Å²	59	51.1 Å²	51.1	31%	0.309	26%	0.257	S	S	.	.	H	α-helix	trans	-56.8	-42.4	178.7	-75.5	169.6	0	0	0	112.8	K739 Q740 Q741 L745 Y758 Q762	K739-L743 WeakPolarHBondContact O-CG 3.23Å; K739-L743 PolarHBondContact O-N 3.32Å; Q740-L743 PolarHBondContact O-N 3.39Å; Q741-L743 PolarHBondContact O-N 3.19Å; L743-L745 VanDerWaalsContact C-N 3.32Å; L743-L745 PolarHBondContact O-N 2.84Å; L743-Y758 HydrophobicContact CD2-CE1 4.19Å; L743-Q762 HydrophobicContact CD2-CB 3.8Å; L743-Q762 HydrophobicContact CD2-CG 4.07Å
744	R	83.4	Confident	83.6	Confident	117 Å²	117	45.8 Å²	45.8	44%	0.442	24%	0.241	S	C	.	.	H	α-helix	trans	-66	-33	177.2	-69.3	173	68.6	-166.1	2.1	113.1	Q740 Q741 T742 T747	Q740-R744 WeakPolarHBondContact O-CG 3.2Å; Q740-R744 PolarHBondContact O-N 3.26Å; Q740-R744 VanDerWaalsContact O-N 3.14Å; Q741-R744 PolarHBondContact O-N 3.31Å; T742-R744 VanDerWaalsContact C-N 3.31Å; T742-R744 PolarHBondContact O-N 3.42Å; R744-T747 PolarHBondContact O-OG1 3.3Å; R744-T747 VanDerWaalsContact O-OG1 3.11Å
745	L	87.3	Confident	82.9	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-87.1	-27.9	-175.6	-66.4	172.9	0	0	0	112.9	L627 F632 L635 V694 L698 Q741 T742 L743 T747 L748 F749	L627-L745 HydrophobicContact CD1-CD1 3.28Å; L627-L745 HydrophobicContact CG-CD1 3.85Å; F632-L745 HydrophobicContact CD2-CD2 3.97Å; F632-L745 HydrophobicContact CE2-CD2 3.8Å; L635-L745 HydrophobicContact CD1-CD1 4.32Å; V694-L745 HydrophobicContact CG1-CD1 3.78Å; L698-L745 HydrophobicContact CD1-CB 3.82Å; L698-L745 HydrophobicContact CD1-CD1 3.83Å; L698-L745 HydrophobicContact CD2-CB 4.2Å; Q741-L745 HydrophobicContact CG-CD1 3.84Å; Q741-L745 HydrophobicContact CG-CG 4.43Å; Q741-L745 WeakPolarHBondContact O-CB 3.43Å; Q741-L745 WeakPolarHBondContact O-CG 3.5Å; Q741-L745 PolarHBondContact O-N 3.48Å; Q741-L745 VanDerWaalsContact O-N 3.08Å; T742-L745 PolarHBondContact O-N 3.27Å; T742-L745 VanDerWaalsContact O-N 3.07Å; L743-L745 VanDerWaalsContact C-N 3.32Å; L743-L745 PolarHBondContact O-N 2.84Å; L745-T747 VanDerWaalsContact C-N 3.26Å; L745-T747 PolarHBondContact O-N 3.48Å; L745-L748 HydrophobicContact CD2-CD1 4.36Å; L745-L748 PolarHBondContact O-N 3.48Å; L745-L748 VanDerWaalsContact O-N 3.09Å; L745-F749 HydrophobicContact CB-CD2 4.36Å; L745-F749 HydrophobicContact CD2-CD2 4.35Å; L745-F749 HydrophobicContact CD2-CE2 3.93Å; L745-F749 PolarHBondContact O-N 2.87Å
746	V	84	Confident	81.9	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-41.4	177	173.3	0	0	0	0	111	L698 T742 L748 F749 D750 V753 Y758 V759	L698-V746 HydrophobicContact CD2-CB 4.42Å; L698-V746 HydrophobicContact CD2-CG2 3.39Å; T742-V746 HydrophobicContact CG2-CG2 4.26Å; T742-V746 WeakPolarHBondContact O-CG2 3.4Å; T742-V746 PolarHBondContact O-N 2.83Å; V746-L748 VanDerWaalsContact C-N 3.27Å; V746-L748 PolarHBondContact O-N 3.3Å; V746-F749 PolarHBondContact O-N 2.81Å; V746-D750 WeakPolarHBondContact O-CA 3.47Å; V746-D750 PolarHBondContact O-N 2.94Å; V746-V753 HydrophobicContact CB-CG2 4.41Å; V746-V753 HydrophobicContact CG1-CG1 4.2Å; V746-V753 HydrophobicContact CG1-CG2 4.17Å; V746-V753 HydrophobicContact CG2-CG1 4.37Å; V746-V753 HydrophobicContact CG2-CG2 4.28Å; V746-Y758 HydrophobicContact CG2-CD1 3.91Å; V746-Y758 HydrophobicContact CG2-CE1 4.47Å; V746-V759 HydrophobicContact CB-CG2 3.73Å; V746-V759 HydrophobicContact CG1-CG2 3.36Å; V746-V759 HydrophobicContact CG2-CG2 4.33Å
747	T	76.1	Confident	81.1	Confident	71 Å²	71	47.8 Å²	47.8	44%	0.436	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-25.8	179	55	0	0	0	0	113.6	R744 L745 L777	R744-T747 PolarHBondContact O-OG1 3.3Å; R744-T747 VanDerWaalsContact O-OG1 3.11Å; L745-T747 VanDerWaalsContact C-N 3.26Å; L745-T747 PolarHBondContact O-N 3.48Å; T747-L777 HydrophobicContact CG2-CD1 3.85Å
748	L	82.8	Confident	80.2	Confident	103 Å²	103	48.7 Å²	48.7	54%	0.539	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-30.4	179.8	-66.8	175.5	0	0	0	112.3	L745 V746	L745-L748 HydrophobicContact CD2-CD1 4.36Å; L745-L748 PolarHBondContact O-N 3.48Å; L745-L748 VanDerWaalsContact O-N 3.09Å; V746-L748 VanDerWaalsContact C-N 3.27Å; V746-L748 PolarHBondContact O-N 3.3Å
749	F	86.3	Confident	78.9	Confident	12 Å²	12	49.8 Å²	49.8	5%	0.053	27%	0.265	C	S	.	.	S	Bend	trans	-124.7	26.4	-171.1	-57.1	-54.1	0	0	0	113.4	F632 L635 H636 L745 V746 A751 I752 V753	F632-F749 HydrophobicContact CD2-CE2 4.41Å; F632-F749 HydrophobicContact CE2-CE2 4.04Å; F632-F749 HydrophobicContact CE2-CZ 4.06Å; F632-F749 HydrophobicContact CZ-CZ 4.1Å; L635-F749 HydrophobicContact CB-CD2 3.79Å; L635-F749 HydrophobicContact CB-CE1 4.41Å; L635-F749 HydrophobicContact CB-CE2 3.58Å; L635-F749 HydrophobicContact CB-CG 4.26Å; L635-F749 HydrophobicContact CB-CZ 3.92Å; L635-F749 HydrophobicContact CD1-CD2 3.95Å; L635-F749 HydrophobicContact CD1-CE2 3.99Å; L635-F749 HydrophobicContact CG-CD2 4.43Å; L635-F749 HydrophobicContact CG-CE2 4.45Å; H636-F749 HydrophobicContact CB-CE1 4.15Å; H636-F749 HydrophobicContact CB-CZ 4.12Å; L745-F749 HydrophobicContact CB-CD2 4.36Å; L745-F749 HydrophobicContact CD2-CD2 4.35Å; L745-F749 HydrophobicContact CD2-CE2 3.93Å; L745-F749 PolarHBondContact O-N 2.87Å; V746-F749 PolarHBondContact O-N 2.81Å; F749-A751 PolarHBondContact O-N 2.91Å; F749-I752 PolarHBondContact O-N 3.18Å; F749-V753 WeakPolarHBondContact O-CG2 3.35Å; F749-V753 PolarHBondContact O-N 3.41Å
750	D	80.5	Confident	77.8	Confident	98 Å²	98	48.1 Å²	48.1	52%	0.524	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-37	-175.3	-174.2	57.6	0	0	0	113.2	V746 I752 V753	V746-D750 WeakPolarHBondContact O-CA 3.47Å; V746-D750 PolarHBondContact O-N 2.94Å; D750-I752 PolarHBondContact O-N 2.99Å; D750-I752 VanDerWaalsContact O-N 3.12Å; D750-V753 PolarHBondContact O-N 3.42Å
751	A	78.7	Confident	77	Confident	52 Å²	52	51.3 Å²	51.3	43%	0.43	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.4	-179.7	0	0	0	0	0	114.7	I647 F749	I647-A751 HydrophobicContact CG2-CB 3.62Å; F749-A751 PolarHBondContact O-N 2.91Å
752	I	84.3	Confident	75.9	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-18.8	-179.1	-63.5	170.6	0	0	0	111.4	M638 I647 T659 L699 F749 D750 A754	M638-I752 HydrophobicContact CB-CD1 3.55Å; M638-I752 HydrophobicContact CE-CG2 4.14Å; I647-I752 HydrophobicContact CD1-CG1 4.21Å; T659-I752 HydrophobicContact CG2-CG2 3.36Å; T659-I752 WeakPolarHBondContact CG2-O 3.38Å; L699-I752 HydrophobicContact CD2-CG2 3.56Å; F749-I752 PolarHBondContact O-N 3.18Å; D750-I752 PolarHBondContact O-N 2.99Å; D750-I752 VanDerWaalsContact O-N 3.12Å; I752-A754 PolarHBondContact O-N 3.49Å
753	V	83.8	Confident	74.6	Confident	19 Å²	19	58.2 Å²	58.2	12%	0.115	31%	0.309	C	S	.	.			trans	-59.7	128.4	-177.3	171.2	0	0	0	0	110	L698 V746 F749 D750 D755	L698-V753 HydrophobicContact CD2-CG2 4.39Å; V746-V753 HydrophobicContact CB-CG2 4.41Å; V746-V753 HydrophobicContact CG1-CG1 4.2Å; V746-V753 HydrophobicContact CG1-CG2 4.17Å; V746-V753 HydrophobicContact CG2-CG1 4.37Å; V746-V753 HydrophobicContact CG2-CG2 4.28Å; F749-V753 WeakPolarHBondContact O-CG2 3.35Å; F749-V753 PolarHBondContact O-N 3.41Å; D750-V753 PolarHBondContact O-N 3.42Å; V753-D755 VanDerWaalsContact C-N 3.34Å; V753-D755 PolarHBondContact O-N 3.32Å
754	A	73.4	Confident	73.3	Confident	19 Å²	19	61.9 Å²	61.9	16%	0.157	33%	0.328	C	S	.	.	S	Bend	trans	-71.1	-29.8	-172	0	0	0	0	0	113.3	L698 L699 D701 I752	L698-A754 PolarHBondContact O-N 2.82Å; L699-A754 WeakPolarHBondContact O-CB 3.44Å; D701-A754 HydrophobicContact CB-CB 4.07Å; I752-A754 PolarHBondContact O-N 3.49Å
755	D	70.1	Confident	71.7	Confident	35 Å²	35	59.6 Å²	59.6	19%	0.187	34%	0.341	C	S	.	.			trans	-123.6	93.6	175.2	-175.4	13	0	0	0	110.9	V753 K757 Y758 R761	V753-D755 VanDerWaalsContact C-N 3.34Å; V753-D755 PolarHBondContact O-N 3.32Å; D755-K757 PolarHBondContact O-N 3.41Å; D755-K757 WeakPolarHBondContact OD1-CB 3.42Å; D755-K757 PolarHBondContact OD1-N 3.3Å; D755-Y758 VanDerWaalsContact O-CB 3.25Å; D755-Y758 WeakPolarHBondContact O-CB 3.49Å; D755-Y758 PolarHBondContact O-N 3.42Å; D755-R761 IonicContact OD2-CZ 3.39Å; D755-R761 IonicContact OD2-NE 3.82Å; D755-R761 IonicContact OD2-NH1 2.78Å; D755-R761 PolarHBondContact OD2-NH1 2.82Å
756	G	66.3	Low	69.8	Low	48 Å²	48	62.7 Å²	62.7	50%	0.495	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-13.2	174.4	0	0	0	0	0	114.1
757	K	69.3	Low	67.9	Low	140 Å²	140	71.9 Å²	71.9	61%	0.609	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.7	175.1	-58.5	-177.6	179.2	-178.9	0	113.2	D755 V759 T760 R761	D755-K757 PolarHBondContact O-N 3.41Å; D755-K757 WeakPolarHBondContact OD1-CB 3.42Å; D755-K757 PolarHBondContact OD1-N 3.3Å; K757-V759 VanDerWaalsContact C-N 3.33Å; K757-V759 PolarHBondContact O-N 3.39Å; K757-T760 PolarHBondContact O-N 3.43Å; K757-R761 WeakPolarHBondContact O-CG 3.5Å; K757-R761 PolarHBondContact O-N 3.45Å
758	Y	67.8	Low	66.2	Low	30 Å²	30	76.2 Å²	76.2	12%	0.118	41%	0.409	C	S	.	.	H	α-helix	trans	-55.1	-48.4	-179.6	179.8	-91.2	0	0	0	111.5	T697 T742 L743 V746 D755 T760 R761 Q762	T697-Y758 HydrophobicContact CG2-CD2 4.46Å; T697-Y758 HydrophobicContact CG2-CE2 3.55Å; T742-Y758 HydrophobicContact CG2-CD1 4.21Å; T742-Y758 HydrophobicContact CG2-CE1 3.43Å; T742-Y758 VanDerWaalsContact CG2-CE1 3.43Å; T742-Y758 HydrophobicContact CG2-CE2 4.46Å; L743-Y758 HydrophobicContact CD2-CE1 4.19Å; V746-Y758 HydrophobicContact CG2-CD1 3.91Å; V746-Y758 HydrophobicContact CG2-CE1 4.47Å; D755-Y758 VanDerWaalsContact O-CB 3.25Å; D755-Y758 WeakPolarHBondContact O-CB 3.49Å; D755-Y758 PolarHBondContact O-N 3.42Å; Y758-T760 PolarHBondContact O-N 3.35Å; Y758-R761 PolarHBondContact O-N 2.75Å; Y758-Q762 HydrophobicContact CD1-CG 4.04Å; Y758-Q762 HydrophobicContact CE1-CG 3.62Å; Y758-Q762 HydrophobicContact CE2-CG 4.23Å; Y758-Q762 WeakPolarHBondContact O-CG 3.4Å; Y758-Q762 PolarHBondContact O-N 3.2Å
759	V	60.3	Low	64.2	Low	36 Å²	36	77.8 Å²	77.8	22%	0.218	41%	0.414	C	S	.	.	H	α-helix	trans	-60.8	-45.5	179.4	173.4	0	0	0	0	110.9	V746 K757 R761 Q762 L763	V746-V759 HydrophobicContact CB-CG2 3.73Å; V746-V759 HydrophobicContact CG1-CG2 3.36Å; V746-V759 HydrophobicContact CG2-CG2 4.33Å; K757-V759 VanDerWaalsContact C-N 3.33Å; K757-V759 PolarHBondContact O-N 3.39Å; V759-R761 PolarHBondContact O-N 3.29Å; V759-Q762 PolarHBondContact O-N 3.38Å; V759-L763 HydrophobicContact CG1-CD1 3.58Å; V759-L763 HydrophobicContact CG1-CG 4.2Å; V759-L763 WeakPolarHBondContact O-CB 3.44Å; V759-L763 WeakPolarHBondContact O-CG 3.46Å; V759-L763 PolarHBondContact O-N 2.83Å
760	T	60.5	Low	62.2	Low	78 Å²	78	82 Å²	82	48%	0.479	44%	0.443	S	S	.	.	H	α-helix	trans	-61.3	-42.5	177.6	-42.6	0	0	0	0	111.9	K757 Y758 Q762 N764	K757-T760 PolarHBondContact O-N 3.43Å; Y758-T760 PolarHBondContact O-N 3.35Å; T760-Q762 VanDerWaalsContact C-N 3.35Å; T760-Q762 PolarHBondContact O-N 3.22Å; T760-N764 WeakPolarHBondContact O-CB 3.43Å; T760-N764 PolarHBondContact O-N 3.48Å; T760-N764 VanDerWaalsContact O-N 3.1Å; T760-N764 PolarHBondContact O-ND2 2.89Å; T760-N764 PolarHBondContact O-OD1 3.2Å
761	R	66.5	Low	60.4	Low	139 Å²	139	84.8 Å²	84.8	53%	0.525	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-39.2	177.2	-73.6	171.1	175.1	-174.9	-10.6	112	D702 D755 K757 Y758 V759	D702-R761 IonicContact OD2-NH1 3.1Å; D702-R761 PolarHBondContact OD2-NH1 2.91Å; D702-R761 VanDerWaalsContact OD2-NH1 3.1Å; D755-R761 IonicContact OD2-CZ 3.39Å; D755-R761 IonicContact OD2-NE 3.82Å; D755-R761 IonicContact OD2-NH1 2.78Å; D755-R761 PolarHBondContact OD2-NH1 2.82Å; K757-R761 WeakPolarHBondContact O-CG 3.5Å; K757-R761 PolarHBondContact O-N 3.45Å; Y758-R761 PolarHBondContact O-N 2.75Å; V759-R761 PolarHBondContact O-N 3.29Å
762	Q	63.6	Low	58.6	Low	56 Å²	56	85.9 Å²	85.9	26%	0.262	46%	0.456	S	S	.	.	H	α-helix	trans	-73.3	-45	179.1	-66.1	-62.7	-30.1	0	0	112.1	L743 Y758 V759 T760 N764 G765 T766	L743-Q762 HydrophobicContact CD2-CB 3.8Å; L743-Q762 HydrophobicContact CD2-CG 4.07Å; Y758-Q762 HydrophobicContact CD1-CG 4.04Å; Y758-Q762 HydrophobicContact CE1-CG 3.62Å; Y758-Q762 HydrophobicContact CE2-CG 4.23Å; Y758-Q762 WeakPolarHBondContact O-CG 3.4Å; Y758-Q762 PolarHBondContact O-N 3.2Å; V759-Q762 PolarHBondContact O-N 3.38Å; T760-Q762 VanDerWaalsContact C-N 3.35Å; T760-Q762 PolarHBondContact O-N 3.22Å; Q762-N764 VanDerWaalsContact C-N 3.32Å; Q762-N764 PolarHBondContact O-N 2.88Å; Q762-G765 PolarHBondContact O-N 2.9Å; Q762-G765 VanDerWaalsContact O-N 3.1Å; Q762-T766 PolarHBondContact O-OG1 3.26Å
763	L	58	Low	56.5	Low	102 Å²	102	94.7 Å²	94.7	53%	0.534	50%	0.497	S	S	.	.	H	α-helix	trans	-63	-37.2	179.5	-75.1	170	0	0	0	112.4	V759 G765 T766	V759-L763 HydrophobicContact CG1-CD1 3.58Å; V759-L763 HydrophobicContact CG1-CG 4.2Å; V759-L763 WeakPolarHBondContact O-CB 3.44Å; V759-L763 WeakPolarHBondContact O-CG 3.46Å; V759-L763 PolarHBondContact O-N 2.83Å; L763-G765 PolarHBondContact O-N 2.75Å; L763-T766 PolarHBondContact O-N 3.27Å; L763-T766 PolarHBondContact O-OG1 3.5Å; L763-T766 VanDerWaalsContact O-OG1 3.06Å
764	N	56.3	Low	54.6	Low	136 Å²	136	95.8 Å²	95.8	73%	0.727	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.9	177.3	-73.2	-5.1	0	0	0	113.1	T760 Q762	T760-N764 WeakPolarHBondContact O-CB 3.43Å; T760-N764 PolarHBondContact O-N 3.48Å; T760-N764 VanDerWaalsContact O-N 3.1Å; T760-N764 PolarHBondContact O-ND2 2.89Å; T760-N764 PolarHBondContact O-OD1 3.2Å; Q762-N764 VanDerWaalsContact C-N 3.32Å; Q762-N764 PolarHBondContact O-N 2.88Å
765	G	50.9	Low	53	Low	68 Å²	68	99 Å²	99	70%	0.701	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-15.4	178.1	0	0	0	0	0	114.7	Q762 L763	Q762-G765 PolarHBondContact O-N 2.9Å; Q762-G765 VanDerWaalsContact O-N 3.1Å; L763-G765 PolarHBondContact O-N 2.75Å
766	T	47.3	Very low	51.3	Low	69 Å²	69	102.7 Å²	102.7	42%	0.423	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-100.8	116.8	-172.9	46	0	0	0	0	111.7	Q762 L763 Y768	Q762-T766 PolarHBondContact O-OG1 3.26Å; L763-T766 PolarHBondContact O-N 3.27Å; L763-T766 PolarHBondContact O-OG1 3.5Å; L763-T766 VanDerWaalsContact O-OG1 3.06Å; T766-Y768 PolarHBondContact O-N 3.33Å
767	K	42.7	Very low	50	Low	197 Å²	197	106.3 Å²	106.3	86%	0.857	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-67.5	121.8	159.8	-72.9	-176.8	178.7	-179.2	0	107.6	Q769	K767-Q769 PolarHBondContact O-N 3.36Å
768	Y	40.4	Very low	48.3	Very low	161 Å²	161	104.7 Å²	104.7	63%	0.631	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-53.9	120.5	175.8	-178.3	-99.7	0	0	0	110.5	T766 P770	T766-Y768 PolarHBondContact O-N 3.33Å; Y768-P770 HydrophobicContact CE1-CB 4.22Å
769	Q	41.8	Very low	46.8	Very low	136 Å²	136	110.8 Å²	110.8	64%	0.636	57%	0.572	S	S	*	*			trans	-113.7	124.9	167.8	-77.9	-164.2	-21.8	0	0	108.7	K767 D771	K767-Q769 PolarHBondContact O-N 3.36Å; Q769-D771 PolarHBondContact O-N 2.81Å
770	P	43.8	Very low	45.3	Very low	102 Å²	102	114.3 Å²	114.3	66%	0.662	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-21.8	-172.1	24.9	-32.2	0	0	0	114.9	Y768 D772	Y768-P770 HydrophobicContact CE1-CB 4.22Å; P770-D772 VanDerWaalsContact C-N 3.27Å; P770-D772 PolarHBondContact O-N 2.84Å
771	D	43.3	Very low	44.1	Very low	156 Å²	156	115.5 Å²	115.5	83%	0.834	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-10.3	-178.6	-90.6	-22.6	0	0	0	114.1	Q769 Q773	Q769-D771 PolarHBondContact O-N 2.81Å; D771-Q773 VanDerWaalsContact C-N 3.25Å; D771-Q773 PolarHBondContact O-N 3.32Å
772	D	41.1	Very low	42.6	Very low	75 Å²	75	117.8 Å²	117.8	40%	0.401	62%	0.618	S	S	.	*			trans	-83.5	76.1	179.1	-135.7	1.8	0	0	0	108.6	P770 S774 Q775	P770-D772 VanDerWaalsContact C-N 3.27Å; P770-D772 PolarHBondContact O-N 2.84Å; D772-S774 PolarHBondContact O-N 3.43Å; D772-S774 PolarHBondContact OD1-OG 2.82Å; D772-Q775 HydrophobicContact CB-CG 4.2Å; D772-Q775 PolarHBondContact O-N 3.27Å; D772-Q775 PolarHBondContact OD2-NE2 3.44Å
773	Q	39.5	Very low	41.3	Very low	187 Å²	187	117 Å²	117	87%	0.874	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50	-10.3	178.2	-71.8	-172.7	-8.2	0	0	113.9	D771	D771-Q773 VanDerWaalsContact C-N 3.25Å; D771-Q773 PolarHBondContact O-N 3.32Å
774	S	44.3	Very low	40.3	Very low	41 Å²	41	117.3 Å²	117.3	29%	0.287	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.1	-14.2	-179	67.5	0	0	0	0	115.9	D772	D772-S774 PolarHBondContact O-N 3.43Å; D772-S774 PolarHBondContact OD1-OG 2.82Å
775	Q	39.4	Very low	39.4	Very low	88 Å²	88	122.4 Å²	122.4	41%	0.411	64%	0.643	S	S	.	*	S	Bend	trans	-92.3	-20.4	-171.4	-64.1	-171.8	15.6	0	0	114.3	D772	D772-Q775 HydrophobicContact CB-CG 4.2Å; D772-Q775 PolarHBondContact O-N 3.27Å; D772-Q775 PolarHBondContact OD2-NE2 3.44Å
776	M	35.1	Very low	38.7	Very low	112 Å²	112	127 Å²	127	55%	0.552	64%	0.644	S	S	*	*	S	Bend	trans	-88.2	118.1	169.3	-85	175.8	59.9	0	0	109.2	M778	M776-M778 PolarHBondContact O-N 2.86Å
777	L	38.9	Very low	38.2	Very low	124 Å²	124	128.3 Å²	128.3	65%	0.649	66%	0.662	S	S	*	*			trans	-54.4	91.9	146	-98.6	138.5	0	0	0	105.7	T747 L779	T747-L777 HydrophobicContact CG2-CD1 3.85Å; L777-L779 PolarHBondContact O-N 2.84Å
778	M	31.8	Very low	37.7	Very low	105 Å²	105	128.4 Å²	128.4	52%	0.517	66%	0.662	S	S	.	*			trans	-56	96	157.4	-84.4	-64.9	-36.2	0	0	104.8	M776 N780	M776-M778 PolarHBondContact O-N 2.86Å; M778-N780 PolarHBondContact O-N 3.37Å
779	L	36.5	Very low	37.5	Very low	158 Å²	158	127.9 Å²	127.9	83%	0.827	67%	0.67	S	S	*	*			trans	-53.5	92.4	144.2	-78.5	164.3	0	0	0	102.9	L777 S781	L777-L779 PolarHBondContact O-N 2.84Å; L779-S781 PolarHBondContact O-N 2.95Å
780	N	30.2	Very low	37.2	Very low	110 Å²	110	127 Å²	127	59%	0.588	68%	0.676	S	S	*	*			trans	-68.6	86.1	-164.7	-145.8	11.2	0	0	0	106.4	M778 Q782	M778-N780 PolarHBondContact O-N 3.37Å; N780-Q782 PolarHBondContact O-N 3.44Å; N780-Q782 VanDerWaalsContact O-N 3.11Å
781	S	34.4	Very low	36.8	Very low	104 Å²	104	128.5 Å²	128.5	73%	0.727	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-10.4	-170	53.7	0	0	0	0	111.6	L779	L779-S781 PolarHBondContact O-N 2.95Å
782	Q	34.5	Very low	36.4	Very low	186 Å²	186	125.8 Å²	125.8	87%	0.869	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.7	15.3	-177.2	-63.6	-163.4	-11.6	0	0	115.7	N780	N780-Q782 PolarHBondContact O-N 3.44Å; N780-Q782 VanDerWaalsContact O-N 3.11Å
783	G	38	Very low	36.3	Very low	39 Å²	39	129.4 Å²	129.4	40%	0.402	69%	0.688	S	S	.	*			trans	-99.2	95.5	178.7	0	0	0	0	0	112.6	R785	G783-R785 PolarHBondContact O-N 3.2Å
784	C	36	Very low	36.2	Very low	109 Å²	109	127.7 Å²	127.7	74%	0.736	69%	0.685	S	S	*	*			trans	-44.3	136.9	165.1	-175.2	0	0	0	0	110.2	F786	C784-F786 CarbonylContact O-C 3.59Å; C784-F786 PolarHBondContact O-N 3.38Å
785	R	37.8	Very low	35.5	Very low	243 Å²	243	134 Å²	134	92%	0.917	70%	0.703	S	S	*	*	S	Bend	trans	-56.8	-5.8	-171.7	-121.1	177.9	-178.2	-179.5	0.3	115.5	G783	G783-R785 PolarHBondContact O-N 3.2Å
786	F	36.2	Very low	35.1	Very low	166 Å²	166	139.6 Å²	139.6	73%	0.728	73%	0.725	S	S	*	*	S	Bend	trans	-123.2	122.1	174.2	-68.3	-86.3	0	0	0	108.7	C784 K788	C784-F786 CarbonylContact O-C 3.59Å; C784-F786 PolarHBondContact O-N 3.38Å; F786-K788 PolarHBondContact O-N 3.38Å; F786-K788 VanDerWaalsContact O-N 3.1Å
787	A	35.6	Very low	34.9	Very low	95 Å²	95	140.6 Å²	140.6	79%	0.785	73%	0.731	S	S	*	*			trans	-54.5	120.1	163.2	0	0	0	0	0	106.7	L789	A787-L789 PolarHBondContact O-N 3.13Å
788	K	34	Very low	34.4	Very low	199 Å²	199	141.1 Å²	141.1	87%	0.865	74%	0.739	S	S	*	*			trans	-52.6	112.9	169	-76.8	-177.4	176.4	-179	0	105.8	F786	F786-K788 PolarHBondContact O-N 3.38Å; F786-K788 VanDerWaalsContact O-N 3.1Å
789	L	34.4	Very low	34.3	Very low	151 Å²	151	142.5 Å²	142.5	79%	0.791	75%	0.747	S	S	*	*			trans	-49.6	137.7	169.7	-83.5	151.1	0	0	0	107	A787 I791	A787-L789 PolarHBondContact O-N 3.13Å; L789-I791 VanDerWaalsContact C-N 3.34Å; L789-I791 PolarHBondContact O-N 2.99Å
790	P	36.6	Very low	34.2	Very low	118 Å²	118	141.3 Å²	141.3	77%	0.766	75%	0.746	S	S	*	*			trans	-61.3	100.4	-177.4	25.3	-31.8	0	0	0	107.6	C792	P790-C792 VanDerWaalsContact C-N 3.33Å; P790-C792 PolarHBondContact O-N 3.09Å
791	I	35.6	Very low	34.3	Very low	132 Å²	132	140.2 Å²	140.2	68%	0.677	75%	0.752	S	S	*	*			trans	-68.1	107.5	162.1	-56.8	175.5	0	0	0	102.6	L789 D793	L789-I791 VanDerWaalsContact C-N 3.34Å; L789-I791 PolarHBondContact O-N 2.99Å; I791-D793 PolarHBondContact O-N 2.86Å
792	C	35.3	Very low	34.1	Very low	99 Å²	99	138.4 Å²	138.4	67%	0.669	75%	0.75	S	S	*	*			trans	-59.1	108.6	-178.2	-154.1	0	0	0	0	107.9	P790 D794	P790-C792 VanDerWaalsContact C-N 3.33Å; P790-C792 PolarHBondContact O-N 3.09Å; C792-D794 PolarHBondContact O-N 3.19Å
793	D	38.9	Very low	33.8	Very low	151 Å²	151	136.5 Å²	136.5	81%	0.807	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	4.1	-170.4	-79	-35.5	0	0	0	114.4	I791	I791-D793 PolarHBondContact O-N 2.86Å
794	D	36.1	Very low	33.6	Very low	152 Å²	152	144.4 Å²	144.4	81%	0.813	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	12.4	-169.9	-79.9	-27.1	0	0	0	116	C792 K796	C792-D794 PolarHBondContact O-N 3.19Å; D794-K796 PolarHBondContact O-N 3.42Å
795	W	31.1	Very low	33.4	Very low	173 Å²	173	148.3 Å²	148.3	66%	0.655	78%	0.777	S	S	*	*			trans	-91.4	78.1	166.5	79.4	-66.9	0	0	0	110.1	M797	W795-M797 HydrophobicContact CE3-CB 3.59Å; W795-M797 HydrophobicContact CE3-CG 3.6Å; W795-M797 HydrophobicContact CE3-SD 4.13Å; W795-M797 HydrophobicContact CZ3-CB 3.55Å; W795-M797 HydrophobicContact CZ3-CG 3.64Å; W795-M797 HydrophobicContact CZ3-SD 3.62Å; W795-M797 PolarHBondContact O-N 3.22Å
796	K	30.7	Very low	33.1	Very low	205 Å²	205	140.1 Å²	140.1	89%	0.891	77%	0.768	S	S	*	*			trans	-64.4	78.6	155.8	-77.3	-178.9	178.6	173.5	0	108.3	D794 T798	D794-K796 PolarHBondContact O-N 3.42Å; K796-T798 PolarHBondContact O-N 2.95Å; K796-T798 VanDerWaalsContact O-N 3.16Å
797	M	29.3	Very low	33	Very low	134 Å²	134	141.6 Å²	141.6	66%	0.66	78%	0.777	S	S	*	*			trans	-67.9	109.3	156.4	-107.7	-158.2	177	0	0	106.7	W795 I799	W795-M797 HydrophobicContact CE3-CB 3.59Å; W795-M797 HydrophobicContact CE3-CG 3.6Å; W795-M797 HydrophobicContact CE3-SD 4.13Å; W795-M797 HydrophobicContact CZ3-CB 3.55Å; W795-M797 HydrophobicContact CZ3-CG 3.64Å; W795-M797 HydrophobicContact CZ3-SD 3.62Å; W795-M797 PolarHBondContact O-N 3.22Å; M797-I799 HydrophobicContact CB-CG1 4.17Å; M797-I799 PolarHBondContact O-N 3.43Å
798	T	30	Very low	33	Very low	134 Å²	134	143.5 Å²	143.5	82%	0.822	78%	0.78	S	S	*	*			trans	-55.2	87	150.5	24.9	0	0	0	0	107.6	K796 V800	K796-T798 PolarHBondContact O-N 2.95Å; K796-T798 VanDerWaalsContact O-N 3.16Å; T798-V800 VanDerWaalsContact C-N 3.29Å; T798-V800 PolarHBondContact O-N 3.03Å
799	I	30	Very low	32.8	Very low	135 Å²	135	142.1 Å²	142.1	69%	0.692	78%	0.781	S	S	*	*			trans	-68.7	97.1	167.5	-61.9	175.2	0	0	0	105.2	M797 A801	M797-I799 HydrophobicContact CB-CG1 4.17Å; M797-I799 PolarHBondContact O-N 3.43Å; I799-A801 PolarHBondContact O-N 3.2Å; I799-A801 VanDerWaalsContact O-N 3.08Å
800	V	33.9	Very low	32.7	Very low	132 Å²	132	139.9 Å²	139.9	80%	0.8	78%	0.778	S	S	*	*			trans	-58.6	110.7	161.4	176	0	0	0	0	105.4	T798 G802	T798-V800 VanDerWaalsContact C-N 3.29Å; T798-V800 PolarHBondContact O-N 3.03Å; V800-G802 VanDerWaalsContact C-N 3.26Å; V800-G802 PolarHBondContact O-N 3.2Å
801	A	31.7	Very low	32.5	Very low	87 Å²	87	140 Å²	140	72%	0.719	78%	0.78	S	S	*	*			trans	-61.5	86.4	179.3	0	0	0	0	0	110.2	I799 N803	I799-A801 PolarHBondContact O-N 3.2Å; I799-A801 VanDerWaalsContact O-N 3.08Å; A801-N803 PolarHBondContact O-N 3.49Å
802	G	31.4	Very low	32.3	Very low	67 Å²	67	140.6 Å²	140.6	69%	0.691	78%	0.784	S	S	*	*			trans	-86.4	94	161.6	0	0	0	0	0	108	V800 K804	V800-G802 VanDerWaalsContact C-N 3.26Å; V800-G802 PolarHBondContact O-N 3.2Å; G802-K804 PolarHBondContact O-N 2.96Å; G802-K804 VanDerWaalsContact O-N 3.09Å
803	N	28.3	Very low	32.2	Very low	146 Å²	146	146.2 Å²	146.2	78%	0.781	80%	0.798	S	S	*	*			trans	-45.4	114.4	168.1	-81.8	-6.8	0	0	0	110.5	A801	A801-N803 PolarHBondContact O-N 3.49Å
804	K	33.7	Very low	31.8	Very low	205 Å²	205	151.6 Å²	151.6	89%	0.891	82%	0.817	S	S	*	*			trans	-135	100.8	150.7	-76.9	-164.1	176	-177.5	0	108.1	G802	G802-K804 PolarHBondContact O-N 2.96Å; G802-K804 VanDerWaalsContact O-N 3.09Å
805	E	30.4	Very low	31.6	Very low	190 Å²	190	151.6 Å²	151.6	89%	0.888	82%	0.817	S	S	*	*			trans	-58.4	141.5	170.7	-62.3	171.4	150.6	0	0	110.4
806	G	32	Very low	31.6	Very low	72 Å²	72	150.4 Å²	150.4	74%	0.742	83%	0.826	S	S	*	*			trans	98	88.4	156	0	0	0	0	0	115.5
807	E	33.6	Very low	31.7	Very low	196 Å²	196	147.4 Å²	147.4	92%	0.916	82%	0.822	S	S	*	*			trans	-152.9	128.2	137.3	-111.6	166.3	-153.1	0	0	109.5
808	T	35.3	Very low	31.8	Very low	136 Å²	136	148.2 Å²	148.2	83%	0.834	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-82.5	135	-162.7	43.8	0	0	0	0	112.2	S810	T808-S810 PolarHBondContact O-N 2.72Å
809	N	31.2	Very low	31.9	Very low	169 Å²	169	149.1 Å²	149.1	90%	0.904	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-54.4	116.2	174.4	-64.7	-36.9	0	0	0	112.4
810	S	30.9	Very low	32.1	Very low	104 Å²	104	150 Å²	150	73%	0.727	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-95.2	127.5	164.5	51.7	0	0	0	0	110.4	T808 D812	T808-S810 PolarHBondContact O-N 2.72Å; S810-D812 PolarHBondContact O-N 2.72Å
811	P	33	Very low	31.9	Very low	122 Å²	122	151.3 Å²	151.3	79%	0.792	85%	0.845	S	S	*	*			trans	-101	71.8	-177.4	38.3	-29.8	0	0	0	110.6
812	D	32.7	Very low	32	Very low	144 Å²	144	156.2 Å²	156.2	77%	0.77	85%	0.854	S	S	*	*			trans	-124.8	82.7	172.1	-78.8	-36.4	0	0	0	109.4	S810	S810-D812 PolarHBondContact O-N 2.72Å
813	F	31.7	Very low	32	Very low	217 Å²	217	163.7 Å²	163.7	95%	0.952	87%	0.868	S	S	*	*			trans	-141	94.6	160.8	-102.3	-83.8	0	0	0	107.8
814	H	31.3	Very low	32.3	Very low	263 Å²	263	165.3 Å²	165.3	100%	1.218	88%	0.876	S	S	*	*			trans	-85	0	166.4	-114.5	-57.4	0	0	0	110.7

Retrieved 814 of 814 residues in 848.8 ms (Link to these results)

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