A0A3Q0KTP0_SCHMA Loading...

Putative armc4 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KTP0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 747 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.2	Very low	35.1	Very low	251 Å²	251	166.9 Å²	166.9	100%	1.236	87%	0.865	S	S	*	*				0	106.5	0	-68.7	178.4	-160	0	0	106.1
2	G	34.3	Very low	34.7	Very low	72 Å²	72	161.8 Å²	161.8	74%	0.742	85%	0.854	S	S	*	*			trans	-90.3	164.8	-167.3	0	0	0	0	0	113.4
3	V	44.2	Very low	34.4	Very low	141 Å²	141	158.1 Å²	158.1	86%	0.855	85%	0.845	S	S	*	*			trans	-150.8	114.7	137.8	-174.7	0	0	0	0	106.9
4	E	31.9	Very low	33.9	Very low	196 Å²	196	163.5 Å²	163.5	92%	0.916	85%	0.848	S	S	*	*			trans	-91.4	133.5	160.3	-87.4	-177.6	141.4	0	0	108.8
5	S	36.2	Very low	33.8	Very low	99 Å²	99	164.1 Å²	164.1	69%	0.692	84%	0.844	S	S	*	*			trans	164.7	138.5	152.5	23.4	0	0	0	0	106.6
6	E	36.6	Very low	33.6	Very low	174 Å²	174	161.3 Å²	161.3	81%	0.813	84%	0.837	S	S	*	*			cis	-162.3	144.5	19.8	-113.3	167.8	175.2	0	0	108.1
7	K	30.7	Very low	33.2	Very low	212 Å²	212	159.5 Å²	159.5	92%	0.922	83%	0.829	S	S	*	*			trans	-79.8	115	173.9	-78.6	173.6	175.4	170.7	0	109.8
8	I	37.1	Very low	32.8	Very low	144 Å²	144	156.8 Å²	156.8	74%	0.738	83%	0.826	S	S	*	*			trans	-118.6	116.6	162.4	-62.1	179.4	0	0	0	109.2	H10	I8-H10 PolarHBondContact O-N 2.96Å
9	K	28.9	Very low	32.6	Very low	199 Å²	199	157.8 Å²	157.8	87%	0.865	82%	0.823	S	S	*	*			trans	-71.3	115.8	174.2	-73.2	173.4	174.2	176.3	0	109.4
10	H	35.6	Very low	32.4	Very low	178 Å²	178	155.3 Å²	155.3	82%	0.824	82%	0.82	S	S	*	*			trans	-125.1	109.2	158.1	-102.2	-0.3	0	0	0	110.8	I8 S12	I8-H10 PolarHBondContact O-N 2.96Å; H10-S12 PolarHBondContact O-N 3.29Å
11	N	29.2	Very low	32.2	Very low	170 Å²	170	157.1 Å²	157.1	91%	0.909	82%	0.823	S	S	*	*			trans	-63.1	111.1	163.1	-92.8	-13.2	0	0	0	108.4
12	S	30.9	Very low	31.5	Very low	105 Å²	105	150 Å²	150	73%	0.734	80%	0.799	S	S	*	*			trans	-116.4	132.7	157.4	-78.9	0	0	0	0	108.5	H10 R14	H10-S12 PolarHBondContact O-N 3.29Å; S12-R14 PolarHBondContact O-N 3.43Å
13	P	30.8	Very low	31.5	Very low	114 Å²	114	151.8 Å²	151.8	74%	0.74	80%	0.799	S	S	*	*			trans	-68.9	130.7	-172.9	28.5	-31.6	0	0	0	109.5	H15	P13-H15 PolarHBondContact O-N 2.98Å
14	R	27.3	Very low	31	Very low	234 Å²	234	149.6 Å²	149.6	88%	0.883	79%	0.79	S	S	*	*			trans	-59.2	101.5	167.4	-72	177.5	173.9	-179.4	-2.7	107.9	S12 V16	S12-R14 PolarHBondContact O-N 3.43Å; R14-V16 VanDerWaalsContact C-N 3.3Å; R14-V16 HydrophobicContact CB-CG2 4.38Å; R14-V16 PolarHBondContact O-N 3.1Å
15	H	31.3	Very low	31.2	Very low	172 Å²	172	144.7 Å²	144.7	80%	0.796	77%	0.768	S	S	*	*			trans	-66.6	98.7	157.2	-100.3	-78.6	0	0	0	106.8	P13 D17	P13-H15 PolarHBondContact O-N 2.98Å; H15-D17 PolarHBondContact O-N 2.88Å
16	V	30.9	Very low	31.2	Very low	119 Å²	119	143 Å²	143	72%	0.721	76%	0.756	S	S	*	*			trans	-77.4	97.9	168.2	-175.2	0	0	0	0	105.3	R14 S18	R14-V16 VanDerWaalsContact C-N 3.3Å; R14-V16 HydrophobicContact CB-CG2 4.38Å; R14-V16 PolarHBondContact O-N 3.1Å; V16-S18 PolarHBondContact O-N 3.38Å
17	D	27.3	Very low	31.3	Very low	132 Å²	132	142.5 Å²	142.5	71%	0.706	75%	0.753	S	S	*	*			trans	-65	85.5	164.5	-81.9	-28.4	0	0	0	108.1	H15 F19	H15-D17 PolarHBondContact O-N 2.88Å; D17-F19 HydrophobicContact CB-CD2 4.35Å; D17-F19 PolarHBondContact O-N 2.86Å; D17-F19 VanDerWaalsContact O-N 3.11Å
18	S	25.5	Very low	31.9	Very low	110 Å²	110	134 Å²	134	77%	0.769	72%	0.719	S	S	*	*			trans	-78	76	165.1	179.2	0	0	0	0	107.7	V16	V16-S18 PolarHBondContact O-N 3.38Å
19	F	30.2	Very low	32.2	Very low	176 Å²	176	132.9 Å²	132.9	77%	0.772	71%	0.711	S	S	*	*			trans	-79.1	114.1	157.7	-87.5	-85.4	0	0	0	107.1	D17 E21	D17-F19 HydrophobicContact CB-CD2 4.35Å; D17-F19 PolarHBondContact O-N 2.86Å; D17-F19 VanDerWaalsContact O-N 3.11Å; F19-E21 PolarHBondContact O-N 3.49Å
20	S	27.6	Very low	33.1	Very low	108 Å²	108	129.8 Å²	129.8	76%	0.755	70%	0.703	S	S	*	*			trans	-59.1	96.2	176.1	56.7	0	0	0	0	110.7	S22	S20-S22 PolarHBondContact O-N 2.7Å
21	E	28.5	Very low	33.9	Very low	193 Å²	193	125.3 Å²	125.3	90%	0.902	68%	0.683	S	S	*	*			trans	-72.8	79.8	162.2	-73.7	-172.8	153.1	0	0	108.5	F19	F19-E21 PolarHBondContact O-N 3.49Å
22	S	26.8	Very low	35	Very low	102 Å²	102	119.6 Å²	119.6	71%	0.713	65%	0.652	S	S	*	*			trans	-157.4	102.1	170.3	-176.6	0	0	0	0	108.2	S20	S20-S22 PolarHBondContact O-N 2.7Å
23	S	33.5	Very low	36.2	Very low	109 Å²	109	121.1 Å²	121.1	76%	0.762	65%	0.652	S	S	*	*	S	Bend	trans	-179.2	-14.7	156.3	-175.6	0	0	0	0	114.5
24	S	35	Very low	37.5	Very low	95 Å²	95	119.2 Å²	119.2	66%	0.664	64%	0.635	S	S	*	*	S	Bend	trans	-127.8	-7.3	-177.6	93.7	0	0	0	0	116.6
25	E	36	Very low	38.8	Very low	94 Å²	94	113.3 Å²	113.3	44%	0.439	63%	0.627	S	S	.	*	S	Bend	trans	-91.8	-23.9	176.8	-64.1	-160.6	154.5	0	0	112	E27 T28 E29	E25-E27 PolarHBondContact O-N 2.99Å; E25-T28 PolarHBondContact O-N 3.25Å; E25-T28 PolarHBondContact O-OG1 3.47Å; E25-E29 PolarHBondContact O-N 3.38Å
26	S	35.2	Very low	40	Very low	63 Å²	63	112.4 Å²	112.4	44%	0.441	62%	0.623	S	S	.	*	H	α-helix	trans	-61.7	-35.9	-174.7	49.6	0	0	0	0	114.4	T28 E29	S26-T28 VanDerWaalsContact C-N 3.27Å; S26-T28 PolarHBondContact O-N 3.01Å; S26-E29 PolarHBondContact O-N 3.09Å
27	E	39.1	Very low	41.1	Very low	163 Å²	163	115.3 Å²	115.3	76%	0.762	62%	0.621	S	S	*	*	H	α-helix	trans	-71.4	-25.4	177.3	-68.1	-169.8	165.3	0	0	112.6	E25	E25-E27 PolarHBondContact O-N 2.99Å
28	T	43.5	Very low	42.2	Very low	33 Å²	33	117.8 Å²	117.8	20%	0.202	63%	0.625	C	S	.	*	H	α-helix	trans	-82.5	-15.7	177.8	64.1	0	0	0	0	113.6	E25 S26	E25-T28 PolarHBondContact O-N 3.25Å; E25-T28 PolarHBondContact O-OG1 3.47Å; S26-T28 VanDerWaalsContact C-N 3.27Å; S26-T28 PolarHBondContact O-N 3.01Å
29	E	43.9	Very low	43.6	Very low	121 Å²	121	116.2 Å²	116.2	57%	0.565	61%	0.606	S	S	*	*	H	α-helix	trans	-74.9	-29.7	177.8	-69.1	-177.8	165.1	0	0	111.9	E25 S26 E31 D32	E25-E29 PolarHBondContact O-N 3.38Å; S26-E29 PolarHBondContact O-N 3.09Å; E29-E31 PolarHBondContact O-N 2.86Å; E29-D32 PolarHBondContact O-N 3.08Å; E29-D32 VanDerWaalsContact O-N 3.14Å
30	L	47.2	Very low	44.4	Very low	135 Å²	135	114.3 Å²	114.3	71%	0.707	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-63.6	-26	-179.2	-67.1	170.6	0	0	0	113.6	D32	L30-D32 VanDerWaalsContact C-N 3.28Å; L30-D32 PolarHBondContact O-N 2.94Å
31	E	51.8	Low	45.7	Very low	84 Å²	84	114.1 Å²	114.1	39%	0.393	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-71.2	-21.4	177.8	-75.6	-169.3	164.5	0	0	113.2	E29 N162	E29-E31 PolarHBondContact O-N 2.86Å; E31-N162 VanDerWaalsContact OE2-O 3.08Å
32	D	53.1	Low	46.8	Very low	49 Å²	49	112.5 Å²	112.5	26%	0.262	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-86.2	-13.2	-177.5	-75.1	-22.7	0	0	0	112.9	E29 L30 K127 C163	E29-D32 PolarHBondContact O-N 3.08Å; E29-D32 VanDerWaalsContact O-N 3.14Å; L30-D32 VanDerWaalsContact C-N 3.28Å; L30-D32 PolarHBondContact O-N 2.94Å; D32-K127 PolarHBondContact O-NZ 3.03Å; D32-C163 PolarHBondContact OD1-SG 3.18Å
33	D	55.8	Low	48.6	Very low	137 Å²	137	110.6 Å²	110.6	73%	0.733	60%	0.596	S	S	*	*			trans	-98.5	36.5	-177.2	-97.3	-10.8	0	0	0	113.8	P35	D33-P35 VanDerWaalsContact O-CD 3.28Å; D33-P35 WeakPolarHBondContact O-CD 3.5Å
34	I	58.4	Low	50.6	Low	74 Å²	74	113.5 Å²	113.5	38%	0.379	60%	0.604	S	S	.	*			trans	-72	119.6	171.5	-59.2	171.4	0	0	0	108.4	E36 P123	I34-E36 PolarHBondContact O-N 2.95Å; I34-P123 HydrophobicContact CD1-CB 3.24Å; I34-P123 HydrophobicContact CD1-CG 4.03Å
35	P	55.3	Low	52.8	Low	110 Å²	110	111.4 Å²	111.4	71%	0.714	58%	0.584	S	S	*	*			trans	-57.1	131.8	176.2	-20.7	31.2	0	0	0	110.1	D33 R37	D33-P35 VanDerWaalsContact O-CD 3.28Å; D33-P35 WeakPolarHBondContact O-CD 3.5Å; P35-R37 PolarHBondContact O-N 3.28Å
36	E	55.6	Low	55.2	Low	154 Å²	154	109 Å²	109	72%	0.72	58%	0.577	S	S	*	*			trans	-61	107	169.7	-74.8	-175.5	168.5	0	0	108.5	I34 K38	I34-E36 PolarHBondContact O-N 2.95Å; E36-K38 VanDerWaalsContact C-N 3.26Å; E36-K38 PolarHBondContact O-N 3.03Å
37	R	53.5	Low	57.9	Low	179 Å²	179	109.9 Å²	109.9	68%	0.675	58%	0.583	S	S	*	*			trans	-62.2	95.7	161.7	-100.1	-175.9	178.1	170.2	-1.8	107.2	P35 Q39 E82	P35-R37 PolarHBondContact O-N 3.28Å; R37-Q39 PolarHBondContact O-N 3.22Å; R37-Q39 VanDerWaalsContact O-N 3.08Å; R37-E82 IonicContact NH1-OE2 3.35Å
38	K	49.9	Very low	60.4	Low	184 Å²	184	105.6 Å²	105.6	80%	0.8	56%	0.563	S	S	*	*			trans	-62.1	107.1	157.8	-71.6	-178.2	178.4	178.6	0	105.6	E36 D40	E36-K38 VanDerWaalsContact C-N 3.26Å; E36-K38 PolarHBondContact O-N 3.03Å; K38-D40 PolarHBondContact O-N 3.25Å
39	Q	54.9	Low	62.7	Low	78 Å²	78	105.2 Å²	105.2	36%	0.364	56%	0.558	S	S	.	*			trans	-58.5	130.7	166.6	-78.9	178.2	-12.4	0	0	107.3	R37 A41	R37-Q39 PolarHBondContact O-N 3.22Å; R37-Q39 VanDerWaalsContact O-N 3.08Å; Q39-A41 PolarHBondContact O-N 3.18Å; Q39-A41 VanDerWaalsContact O-N 3.1Å
40	D	47.9	Very low	65	Low	136 Å²	136	107.3 Å²	107.3	73%	0.727	56%	0.561	S	S	*	*			trans	-55.9	118.8	171.7	-76.8	-42.2	0	0	0	107.9	K38 N42 A43	K38-D40 PolarHBondContact O-N 3.25Å; D40-N42 PolarHBondContact O-N 3.08Å; D40-A43 PolarHBondContact O-N 3.46Å; D40-A43 VanDerWaalsContact O-N 3.08Å
41	A	54.3	Low	67.2	Low	103 Å²	103	105.7 Å²	105.7	85%	0.851	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-7.2	-178.1	0	0	0	0	0	113.7	Q39	Q39-A41 PolarHBondContact O-N 3.18Å; Q39-A41 VanDerWaalsContact O-N 3.1Å
42	N	52.5	Low	69.3	Low	160 Å²	160	101.7 Å²	101.7	86%	0.856	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	9.9	-178.2	-70.7	-14.4	0	0	0	114.3	D40	D40-N42 PolarHBondContact O-N 3.08Å
43	A	64.5	Low	71.2	Confident	61 Å²	61	100 Å²	100	50%	0.504	53%	0.526	S	S	.	.	S	Bend	trans	-81.4	130.7	171.5	0	0	0	0	0	110.7	D40 L45	D40-A43 PolarHBondContact O-N 3.46Å; D40-A43 VanDerWaalsContact O-N 3.08Å; A43-L45 PolarHBondContact O-N 3.34Å
44	D	75.1	Confident	73	Confident	171 Å²	171	99.5 Å²	99.5	91%	0.914	52%	0.517	S	S	*	.			trans	-62.2	104.8	172.5	-79.2	-34.6	0	0	0	109.9
45	L	81.2	Confident	74.7	Confident	50 Å²	50	96.7 Å²	96.7	26%	0.262	50%	0.503	S	S	.	.			trans	-73.5	137.5	-179.4	-72.1	163.4	0	0	0	110.7	A43 Y49 W50	A43-L45 PolarHBondContact O-N 3.34Å; L45-Y49 HydrophobicContact CB-CD1 4.27Å; L45-Y49 HydrophobicContact CB-CG 4.14Å; L45-Y49 HydrophobicContact CD1-CD1 3.8Å; L45-Y49 HydrophobicContact CD1-CD2 4.35Å; L45-Y49 HydrophobicContact CD1-CE1 3.7Å; L45-Y49 HydrophobicContact CD1-CE2 4.26Å; L45-Y49 HydrophobicContact CD1-CG 4.15Å; L45-Y49 HydrophobicContact CD2-CD2 3.9Å; L45-Y49 HydrophobicContact CD2-CE2 4.17Å; L45-Y49 HydrophobicContact CD2-CG 4.2Å; L45-Y49 HydrophobicContact CG-CD1 4.48Å; L45-Y49 HydrophobicContact CG-CG 4.41Å; L45-W50 HydrophobicContact CB-CZ2 4.49Å; L45-W50 HydrophobicContact CD1-CZ2 4.18Å
46	P	86.8	Confident	76.6	Confident	45 Å²	45	91.5 Å²	91.5	29%	0.292	47%	0.469	S	S	.	.			trans	-57.3	155.7	178.7	-26	35.1	0	0	0	113.6	E48 Y49 I83	P46-E48 WeakPolarHBondContact CB-OE2 3.21Å; P46-E48 PolarHBondContact O-N 3.07Å; P46-E48 VanDerWaalsContact O-N 3.1Å; P46-Y49 VanDerWaalsContact O-CB 3.29Å; P46-Y49 WeakPolarHBondContact O-CB 3.29Å; P46-Y49 PolarHBondContact O-N 3.06Å; P46-I83 HydrophobicContact CG-CD1 4.06Å; P46-I83 HydrophobicContact CG-CG2 4.11Å
47	S	90.7	Very high	78.3	Confident	81 Å²	81	91.8 Å²	91.8	57%	0.566	47%	0.468	S	S	*	.	H	α-helix	trans	-54.2	-33.4	179.7	67.5	0	0	0	0	113.3	Y49 W50 Q51	S47-Y49 VanDerWaalsContact C-N 3.32Å; S47-Y49 PolarHBondContact O-N 3.27Å; S47-W50 PolarHBondContact O-N 3.13Å; S47-Q51 WeakPolarHBondContact O-CB 3.36Å; S47-Q51 PolarHBondContact O-N 3.32Å
48	E	91.9	Very high	80.1	Confident	72 Å²	72	89.3 Å²	89.3	34%	0.336	46%	0.459	S	S	.	.	H	α-helix	trans	-63.6	-36.7	180	-64.2	83.3	166.9	0	0	111.5	P46 Q51 I52 M77 P78	P46-E48 WeakPolarHBondContact CB-OE2 3.21Å; P46-E48 PolarHBondContact O-N 3.07Å; P46-E48 VanDerWaalsContact O-N 3.1Å; E48-Q51 PolarHBondContact O-N 3.08Å; E48-I52 WeakPolarHBondContact O-CB 3.48Å; E48-I52 VanDerWaalsContact O-CG1 3.29Å; E48-I52 WeakPolarHBondContact O-CG1 3.14Å; E48-I52 PolarHBondContact O-N 2.84Å; E48-M77 HydrophobicContact CB-CE 3.98Å; E48-M77 HydrophobicContact CG-CE 4.26Å; E48-P78 HydrophobicContact CG-CG 4.43Å
49	Y	92.1	Very high	82.1	Confident	26 Å²	26	80.9 Å²	80.9	10%	0.102	42%	0.423	C	S	.	.	H	α-helix	trans	-60.6	-49.2	176.8	-176.7	-79.3	0	0	0	110.4	L45 P46 S47 I52 G53 I83 A87 D90	L45-Y49 HydrophobicContact CB-CD1 4.27Å; L45-Y49 HydrophobicContact CB-CG 4.14Å; L45-Y49 HydrophobicContact CD1-CD1 3.8Å; L45-Y49 HydrophobicContact CD1-CD2 4.35Å; L45-Y49 HydrophobicContact CD1-CE1 3.7Å; L45-Y49 HydrophobicContact CD1-CE2 4.26Å; L45-Y49 HydrophobicContact CD1-CG 4.15Å; L45-Y49 HydrophobicContact CD2-CD2 3.9Å; L45-Y49 HydrophobicContact CD2-CE2 4.17Å; L45-Y49 HydrophobicContact CD2-CG 4.2Å; L45-Y49 HydrophobicContact CG-CD1 4.48Å; L45-Y49 HydrophobicContact CG-CG 4.41Å; P46-Y49 VanDerWaalsContact O-CB 3.29Å; P46-Y49 WeakPolarHBondContact O-CB 3.29Å; P46-Y49 PolarHBondContact O-N 3.06Å; S47-Y49 VanDerWaalsContact C-N 3.32Å; S47-Y49 PolarHBondContact O-N 3.27Å; Y49-I52 PolarHBondContact O-N 3.31Å; Y49-G53 PolarHBondContact O-N 3.42Å; Y49-I83 HydrophobicContact CD2-CG2 4.44Å; Y49-A87 HydrophobicContact CD2-CB 3.29Å; Y49-A87 VanDerWaalsContact CE2-CA 3.46Å; Y49-A87 HydrophobicContact CE2-CB 3.59Å; Y49-A87 HydrophobicContact CG-CB 3.84Å; Y49-D90 VanDerWaalsContact OH-CB 3.31Å; Y49-D90 WeakPolarHBondContact OH-CB 3.46Å
50	W	92.4	Very high	83.8	Confident	164 Å²	164	82.9 Å²	82.9	62%	0.621	43%	0.431	S	S	*	.	H	α-helix	trans	-68	-37.7	179.2	-61.1	108.8	0	0	0	112.3	L45 S47 G53 K54	L45-W50 HydrophobicContact CB-CZ2 4.49Å; L45-W50 HydrophobicContact CD1-CZ2 4.18Å; S47-W50 PolarHBondContact O-N 3.13Å; W50-G53 PolarHBondContact O-N 3.18Å; W50-K54 PolarHBondContact O-N 3.35Å
51	Q	94.2	Very high	85.4	Confident	101 Å²	101	79.4 Å²	79.4	47%	0.472	43%	0.426	S	S	.	.	H	α-helix	trans	-63.2	-44	175.2	-173.8	172.8	1.5	0	0	111.4	S47 E48 G53 K54 I55 M77	S47-Q51 WeakPolarHBondContact O-CB 3.36Å; S47-Q51 PolarHBondContact O-N 3.32Å; E48-Q51 PolarHBondContact O-N 3.08Å; Q51-G53 VanDerWaalsContact C-N 3.33Å; Q51-G53 PolarHBondContact O-N 3.1Å; Q51-K54 WeakPolarHBondContact O-CB 3.48Å; Q51-K54 PolarHBondContact O-N 3.49Å; Q51-I55 HydrophobicContact CG-CD1 4.1Å; Q51-I55 VanDerWaalsContact O-CG1 3.29Å; Q51-I55 WeakPolarHBondContact O-CG1 3.23Å; Q51-I55 PolarHBondContact O-N 3.42Å; Q51-M77 HydrophobicContact CB-CE 3.96Å; Q51-M77 HydrophobicContact CG-CE 3.93Å; Q51-M77 HydrophobicContact CG-SD 4.11Å
52	I	94.7	Very high	86.5	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-57.6	-47.9	172.2	-73.8	167.5	0	0	0	110	E48 Y49 K54 I55 I56 L74 M77 L79 C84 A87 V88	E48-I52 WeakPolarHBondContact O-CB 3.48Å; E48-I52 VanDerWaalsContact O-CG1 3.29Å; E48-I52 WeakPolarHBondContact O-CG1 3.14Å; E48-I52 PolarHBondContact O-N 2.84Å; Y49-I52 PolarHBondContact O-N 3.31Å; I52-K54 VanDerWaalsContact C-N 3.27Å; I52-K54 PolarHBondContact O-N 3.22Å; I52-I55 PolarHBondContact O-N 3.38Å; I52-I55 VanDerWaalsContact O-N 3.08Å; I52-I56 HydrophobicContact CG2-CG1 4.16Å; I52-I56 WeakPolarHBondContact O-CG1 3.29Å; I52-I56 PolarHBondContact O-N 3.43Å; I52-L74 HydrophobicContact CG1-CD1 4.07Å; I52-L74 HydrophobicContact CG2-CD1 4.09Å; I52-M77 HydrophobicContact CD1-CB 4.46Å; I52-M77 HydrophobicContact CG1-CB 4.29Å; I52-M77 HydrophobicContact CG1-CE 4.04Å; I52-M77 HydrophobicContact CG1-CG 4.04Å; I52-L79 HydrophobicContact CD1-CD2 4.46Å; I52-C84 HydrophobicContact CD1-CB 3.45Å; I52-C84 VanDerWaalsContact CD1-CB 3.45Å; I52-A87 HydrophobicContact CB-CB 4.16Å; I52-A87 HydrophobicContact CD1-CB 4.03Å; I52-A87 HydrophobicContact CG2-CB 3.93Å; I52-V88 HydrophobicContact CG2-CG2 3.68Å
53	G	93.1	Very high	88.3	Confident	15 Å²	15	74.8 Å²	74.8	16%	0.155	40%	0.404	C	S	.	.	H	α-helix	trans	-57.7	-39.8	178.1	0	0	0	0	0	113.3	Y49 W50 Q51 K57	Y49-G53 PolarHBondContact O-N 3.42Å; W50-G53 PolarHBondContact O-N 3.18Å; Q51-G53 VanDerWaalsContact C-N 3.33Å; Q51-G53 PolarHBondContact O-N 3.1Å; G53-K57 PolarHBondContact O-N 2.75Å
54	K	93.5	Very high	89.5	Confident	125 Å²	125	76.2 Å²	76.2	54%	0.543	40%	0.4	S	S	.	.	H	α-helix	trans	-64.9	-43.5	174.4	-166.3	-175.9	-178.4	-178.7	0	111.9	W50 Q51 I52 K57 Y58	W50-K54 PolarHBondContact O-N 3.35Å; Q51-K54 WeakPolarHBondContact O-CB 3.48Å; Q51-K54 PolarHBondContact O-N 3.49Å; I52-K54 VanDerWaalsContact C-N 3.27Å; I52-K54 PolarHBondContact O-N 3.22Å; K54-K57 WeakPolarHBondContact O-CB 3.23Å; K54-K57 PolarHBondContact O-N 3.48Å; K54-Y58 HydrophobicContact CD-CE2 4.14Å; K54-Y58 WeakPolarHBondContact CE-OH 3.3Å; K54-Y58 HydrophobicContact CG-CD2 4.28Å; K54-Y58 HydrophobicContact CG-CE2 3.69Å; K54-Y58 WeakPolarHBondContact O-CD2 3.48Å; K54-Y58 PolarHBondContact O-N 3.36Å
55	I	95.1	Very high	90.2	Very high	16 Å²	16	72.2 Å²	72.2	8%	0.082	38%	0.382	C	S	.	.	H	α-helix	trans	-64.4	-44.1	177.9	-63.5	162.7	0	0	0	111	Q51 I52 K57 Y58 L59 S70 A73 L74 M77	Q51-I55 HydrophobicContact CG-CD1 4.1Å; Q51-I55 VanDerWaalsContact O-CG1 3.29Å; Q51-I55 WeakPolarHBondContact O-CG1 3.23Å; Q51-I55 PolarHBondContact O-N 3.42Å; I52-I55 PolarHBondContact O-N 3.38Å; I52-I55 VanDerWaalsContact O-N 3.08Å; I55-K57 VanDerWaalsContact C-N 3.26Å; I55-K57 PolarHBondContact O-N 3.09Å; I55-Y58 PolarHBondContact O-N 3.14Å; I55-Y58 VanDerWaalsContact O-N 3.08Å; I55-L59 PolarHBondContact O-N 3.18Å; I55-S70 VanDerWaalsContact CG2-O 3.23Å; I55-S70 WeakPolarHBondContact CG2-O 3.29Å; I55-A73 HydrophobicContact CD1-CB 4.32Å; I55-A73 HydrophobicContact CG2-CB 4.49Å; I55-L74 HydrophobicContact CG2-CB 3.77Å; I55-M77 HydrophobicContact CD1-CG 3.91Å; I55-M77 HydrophobicContact CD1-SD 4.06Å
56	I	94.3	Very high	90.8	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-59.4	-38.4	175.1	-64.7	-58.6	0	0	0	111.1	I52 Y58 L59 K60 L74 V88 V91	I52-I56 HydrophobicContact CG2-CG1 4.16Å; I52-I56 WeakPolarHBondContact O-CG1 3.29Å; I52-I56 PolarHBondContact O-N 3.43Å; I56-Y58 VanDerWaalsContact C-N 3.34Å; I56-Y58 PolarHBondContact O-N 3.43Å; I56-L59 HydrophobicContact CD1-CD1 3.93Å; I56-L59 WeakPolarHBondContact O-CB 3.43Å; I56-L59 PolarHBondContact O-N 3.4Å; I56-K60 PolarHBondContact O-N 3.28Å; I56-L74 HydrophobicContact CD1-CD2 3.53Å; I56-V88 HydrophobicContact CD1-CG1 4.47Å; I56-V91 HydrophobicContact CB-CG1 4.16Å; I56-V91 HydrophobicContact CG2-CB 4.43Å; I56-V91 HydrophobicContact CG2-CG1 4.01Å
57	K	91.9	Very high	91.1	Very high	161 Å²	161	70 Å²	70	70%	0.7	37%	0.371	S	S	*	.	H	α-helix	trans	-62.5	-39	175.1	-171.6	178	179.4	177.4	0	112.3	G53 K54 I55 K60	G53-K57 PolarHBondContact O-N 2.75Å; K54-K57 WeakPolarHBondContact O-CB 3.23Å; K54-K57 PolarHBondContact O-N 3.48Å; I55-K57 VanDerWaalsContact C-N 3.26Å; I55-K57 PolarHBondContact O-N 3.09Å; K57-K60 PolarHBondContact O-N 2.89Å
58	Y	91.5	Very high	91.2	Very high	126 Å²	126	67.8 Å²	67.8	49%	0.494	35%	0.353	S	S	.	.	H	α-helix	trans	-69	-33.5	175	-70.1	-61.7	0	0	0	113	K54 I55 I56 K60 G61 S70	K54-Y58 HydrophobicContact CD-CE2 4.14Å; K54-Y58 WeakPolarHBondContact CE-OH 3.3Å; K54-Y58 HydrophobicContact CG-CD2 4.28Å; K54-Y58 HydrophobicContact CG-CE2 3.69Å; K54-Y58 WeakPolarHBondContact O-CD2 3.48Å; K54-Y58 PolarHBondContact O-N 3.36Å; I55-Y58 PolarHBondContact O-N 3.14Å; I55-Y58 VanDerWaalsContact O-N 3.08Å; I56-Y58 VanDerWaalsContact C-N 3.34Å; I56-Y58 PolarHBondContact O-N 3.43Å; Y58-K60 PolarHBondContact O-N 3.15Å; Y58-G61 PolarHBondContact O-N 3.45Å; Y58-G61 VanDerWaalsContact O-N 3.13Å; Y58-S70 WeakPolarHBondContact CB-OG 3.36Å
59	L	92.1	Very high	91.3	Very high	7 Å²	7	69.5 Å²	69.5	4%	0.037	36%	0.363	C	S	.	.	H	α-helix	trans	-61.6	-30.7	173.8	-72.9	172.5	0	0	0	112.9	I55 I56 G61 T67 S70 L71 L74 V96	I55-L59 PolarHBondContact O-N 3.18Å; I56-L59 HydrophobicContact CD1-CD1 3.93Å; I56-L59 WeakPolarHBondContact O-CB 3.43Å; I56-L59 PolarHBondContact O-N 3.4Å; L59-G61 PolarHBondContact O-N 3.43Å; L59-T67 HydrophobicContact CD2-CG2 3.93Å; L59-T67 WeakPolarHBondContact CD2-O 3.3Å; L59-S70 VanDerWaalsContact CD2-CB 3.46Å; L59-L71 HydrophobicContact CD1-CD2 4.17Å; L59-L71 HydrophobicContact CD2-CB 4.47Å; L59-L71 HydrophobicContact CD2-CD2 3.76Å; L59-L71 HydrophobicContact CD2-CG 3.63Å; L59-L74 HydrophobicContact CD1-CD2 3.99Å; L59-V96 HydrophobicContact CB-CG1 3.93Å
60	K	89.1	Confident	91.5	Very high	121 Å²	121	68.7 Å²	68.7	53%	0.526	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-7.7	177.6	-67.4	175.8	-179.6	177.9	0	113.6	I56 K57 Y58 G62 V91 V96	I56-K60 PolarHBondContact O-N 3.28Å; K57-K60 PolarHBondContact O-N 2.89Å; Y58-K60 PolarHBondContact O-N 3.15Å; K60-G62 PolarHBondContact O-N 2.97Å; K60-V91 PolarHBondContact NZ-O 3.4Å; K60-V91 VanDerWaalsContact NZ-O 3.15Å; K60-V96 HydrophobicContact CD-CG2 4.21Å; K60-V96 VanDerWaalsContact CE-CG2 3.44Å; K60-V96 HydrophobicContact CG-CG2 3.69Å
61	G	81.8	Confident	91.6	Very high	62 Å²	62	61.1 Å²	61.1	64%	0.639	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-5.8	-171.8	0	0	0	0	0	117.2	Y58 L59 N63	Y58-G61 PolarHBondContact O-N 3.45Å; Y58-G61 VanDerWaalsContact O-N 3.13Å; L59-G61 PolarHBondContact O-N 3.43Å; G61-N63 VanDerWaalsContact C-N 3.32Å; G61-N63 PolarHBondContact O-N 2.88Å
62	G	79.2	Confident	91.7	Very high	69 Å²	69	59.5 Å²	59.5	71%	0.711	33%	0.332	S	S	*	.			trans	78.1	-11.1	169.8	0	0	0	0	0	118	K60	K60-G62 PolarHBondContact O-N 2.97Å
63	N	89.7	Confident	91.7	Very high	97 Å²	97	61.4 Å²	61.4	52%	0.519	35%	0.348	S	S	.	.			trans	-80.2	119.6	174.6	175.1	-9.3	0	0	0	111.3	G61 T65 S66 T67	G61-N63 VanDerWaalsContact C-N 3.32Å; G61-N63 PolarHBondContact O-N 2.88Å; N63-T65 PolarHBondContact O-N 2.96Å; N63-T65 PolarHBondContact OD1-N 3.31Å; N63-T65 VanDerWaalsContact OD1-N 3.07Å; N63-S66 CarbonylContact O-C 3.55Å; N63-S66 WeakPolarHBondContact O-CB 3.4Å; N63-S66 PolarHBondContact O-N 2.82Å; N63-S66 VanDerWaalsContact O-N 3.09Å; N63-T67 PolarHBondContact O-N 3Å; N63-T67 PolarHBondContact O-OG1 3.35Å
64	Q	89.3	Confident	91.9	Very high	91 Å²	91	60.7 Å²	60.7	43%	0.425	34%	0.34	S	S	.	.	H	α-helix	trans	-50.2	-48.2	-178.3	-170.6	-174	21.8	0	0	114.2	T67 I68 E105	Q64-T67 PolarHBondContact O-N 2.99Å; Q64-I68 HydrophobicContact CG-CD1 4.27Å; Q64-I68 WeakPolarHBondContact O-CG1 3.26Å; Q64-I68 PolarHBondContact O-N 3.46Å; Q64-E105 HydrophobicContact CG-CG 4.23Å; Q64-E105 PolarHBondContact NE2-OE2 2.91Å
65	T	90.4	Very high	91.9	Very high	87 Å²	87	59.8 Å²	59.8	53%	0.534	34%	0.336	S	S	.	.	H	α-helix	trans	-67.8	-41.9	-179.1	-58.5	0	0	0	0	110.8	N63 T67 I68 I69	N63-T65 PolarHBondContact O-N 2.96Å; N63-T65 PolarHBondContact OD1-N 3.31Å; N63-T65 VanDerWaalsContact OD1-N 3.07Å; T65-T67 VanDerWaalsContact C-N 3.32Å; T65-T67 PolarHBondContact O-N 3.25Å; T65-I68 PolarHBondContact O-N 2.89Å; T65-I69 HydrophobicContact CG2-CD1 3.9Å; T65-I69 VanDerWaalsContact O-CG1 3.3Å; T65-I69 WeakPolarHBondContact O-CG1 3.31Å; T65-I69 PolarHBondContact O-N 3.49Å
66	S	92.4	Very high	91.9	Very high	42 Å²	42	65.1 Å²	65.1	29%	0.294	37%	0.365	S	S	.	.	H	α-helix	trans	-62.2	-40.8	175.6	-171	0	0	0	0	111.5	N63 I69 S70	N63-S66 CarbonylContact O-C 3.55Å; N63-S66 WeakPolarHBondContact O-CB 3.4Å; N63-S66 PolarHBondContact O-N 2.82Å; N63-S66 VanDerWaalsContact O-N 3.09Å; S66-I69 PolarHBondContact O-N 3.42Å; S66-S70 VanDerWaalsContact O-CB 3.23Å; S66-S70 WeakPolarHBondContact O-CB 3.31Å; S66-S70 PolarHBondContact O-N 3.26Å; S66-S70 PolarHBondContact O-OG 3.49Å
67	T	94.3	Very high	92	Very high	7 Å²	7	66 Å²	66	4%	0.043	37%	0.37	C	S	.	.	H	α-helix	trans	-63.2	-47.2	177.1	-60.7	0	0	0	0	110.8	L59 N63 Q64 T65 I69 S70 L71 L100	L59-T67 HydrophobicContact CD2-CG2 3.93Å; L59-T67 WeakPolarHBondContact CD2-O 3.3Å; N63-T67 PolarHBondContact O-N 3Å; N63-T67 PolarHBondContact O-OG1 3.35Å; Q64-T67 PolarHBondContact O-N 2.99Å; T65-T67 VanDerWaalsContact C-N 3.32Å; T65-T67 PolarHBondContact O-N 3.25Å; T67-I69 PolarHBondContact O-N 3.39Å; T67-S70 PolarHBondContact O-N 3.46Å; T67-L71 HydrophobicContact CG2-CD1 4.18Å; T67-L71 HydrophobicContact CG2-CG 4.42Å; T67-L71 WeakPolarHBondContact O-CB 3.45Å; T67-L71 VanDerWaalsContact O-CG 3.29Å; T67-L71 WeakPolarHBondContact O-CG 3.46Å; T67-L71 PolarHBondContact O-N 3.22Å; T67-L100 HydrophobicContact CG2-CD1 4.1Å; T67-L100 HydrophobicContact CG2-CD2 3.71Å
68	I	93.1	Very high	92.1	Very high	34 Å²	34	61.3 Å²	61.3	17%	0.174	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-46.9	178.3	-67.4	167.2	0	0	0	110.9	Q64 T65 S70 L71 C72 R107	Q64-I68 HydrophobicContact CG-CD1 4.27Å; Q64-I68 WeakPolarHBondContact O-CG1 3.26Å; Q64-I68 PolarHBondContact O-N 3.46Å; T65-I68 PolarHBondContact O-N 2.89Å; I68-S70 VanDerWaalsContact C-N 3.3Å; I68-S70 PolarHBondContact O-N 3.12Å; I68-L71 PolarHBondContact O-N 3.3Å; I68-C72 PolarHBondContact O-N 3.02Å; I68-C72 PolarHBondContact O-SG 3.34Å; I68-R107 HydrophobicContact CD1-CB 3.94Å; I68-R107 HydrophobicContact CG1-CB 4.3Å
69	I	94	Very high	92.2	Very high	108 Å²	108	55.6 Å²	55.6	55%	0.554	33%	0.333	S	S	*	.	H	α-helix	trans	-61.5	-41.6	177.5	-66.7	168.1	0	0	0	110.7	T65 S66 T67 C72 A73	T65-I69 HydrophobicContact CG2-CD1 3.9Å; T65-I69 VanDerWaalsContact O-CG1 3.3Å; T65-I69 WeakPolarHBondContact O-CG1 3.31Å; T65-I69 PolarHBondContact O-N 3.49Å; S66-I69 PolarHBondContact O-N 3.42Å; T67-I69 PolarHBondContact O-N 3.39Å; I69-C72 WeakPolarHBondContact O-CB 3.4Å; I69-C72 PolarHBondContact O-N 3.34Å; I69-A73 WeakPolarHBondContact O-CB 3.49Å; I69-A73 PolarHBondContact O-N 3.01Å
70	S	95.1	Very high	92.2	Very high	10 Å²	10	63.2 Å²	63.2	7%	0.07	37%	0.366	C	S	.	.	H	α-helix	trans	-68.4	-35	178.5	-57.8	0	0	0	0	112.2	I55 Y58 L59 S66 T67 I68 A73 L74	I55-S70 VanDerWaalsContact CG2-O 3.23Å; I55-S70 WeakPolarHBondContact CG2-O 3.29Å; Y58-S70 WeakPolarHBondContact CB-OG 3.36Å; L59-S70 VanDerWaalsContact CD2-CB 3.46Å; S66-S70 VanDerWaalsContact O-CB 3.23Å; S66-S70 WeakPolarHBondContact O-CB 3.31Å; S66-S70 PolarHBondContact O-N 3.26Å; S66-S70 PolarHBondContact O-OG 3.49Å; T67-S70 PolarHBondContact O-N 3.46Å; I68-S70 VanDerWaalsContact C-N 3.3Å; I68-S70 PolarHBondContact O-N 3.12Å; S70-A73 PolarHBondContact O-N 2.81Å; S70-L74 WeakPolarHBondContact O-CB 3.39Å; S70-L74 PolarHBondContact O-N 3.24Å
71	L	95.9	Very high	92.4	Very high	4 Å²	4	60.4 Å²	60.4	2%	0.021	36%	0.359	C	S	.	.	H	α-helix	trans	-66.1	-41.4	172.9	-73	171.1	0	0	0	110.9	L59 T67 I68 L74 K75 L97 L100 C108 I115	L59-L71 HydrophobicContact CD1-CD2 4.17Å; L59-L71 HydrophobicContact CD2-CB 4.47Å; L59-L71 HydrophobicContact CD2-CD2 3.76Å; L59-L71 HydrophobicContact CD2-CG 3.63Å; T67-L71 HydrophobicContact CG2-CD1 4.18Å; T67-L71 HydrophobicContact CG2-CG 4.42Å; T67-L71 WeakPolarHBondContact O-CB 3.45Å; T67-L71 VanDerWaalsContact O-CG 3.29Å; T67-L71 WeakPolarHBondContact O-CG 3.46Å; T67-L71 PolarHBondContact O-N 3.22Å; I68-L71 PolarHBondContact O-N 3.3Å; L71-L74 PolarHBondContact O-N 3.31Å; L71-K75 WeakPolarHBondContact O-CB 3.4Å; L71-K75 PolarHBondContact O-N 3.49Å; L71-L97 HydrophobicContact CD2-CD2 3.83Å; L71-L100 HydrophobicContact CD1-CD1 4.23Å; L71-L100 HydrophobicContact CD2-CD1 3.91Å; L71-L100 HydrophobicContact CG-CD1 4.42Å; L71-C108 HydrophobicContact CD1-CB 4.34Å; L71-C108 WeakPolarHBondContact CD1-O 3.42Å; L71-I115 HydrophobicContact CB-CD1 4.36Å; L71-I115 HydrophobicContact CD2-CD1 3.65Å
72	C	94.9	Very high	92.9	Very high	68 Å²	68	61.6 Å²	61.6	46%	0.459	35%	0.348	S	S	.	.	H	α-helix	trans	-60.2	-49.8	172.9	-72	0	0	0	0	111	I68 I69 L74 K75 D76	I68-C72 PolarHBondContact O-N 3.02Å; I68-C72 PolarHBondContact O-SG 3.34Å; I69-C72 WeakPolarHBondContact O-CB 3.4Å; I69-C72 PolarHBondContact O-N 3.34Å; C72-L74 VanDerWaalsContact C-N 3.32Å; C72-L74 PolarHBondContact O-N 2.8Å; C72-K75 WeakPolarHBondContact O-CB 3.29Å; C72-K75 PolarHBondContact O-N 3.27Å; C72-K75 VanDerWaalsContact O-N 3.14Å; C72-D76 PolarHBondContact O-N 2.79Å; C72-D76 VanDerWaalsContact O-N 3.09Å
73	A	95.6	Very high	93.5	Very high	39 Å²	39	61.7 Å²	61.7	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-59.5	-40.8	177.9	0	0	0	0	0	112.6	I55 I69 S70 D76 M77	I55-A73 HydrophobicContact CD1-CB 4.32Å; I55-A73 HydrophobicContact CG2-CB 4.49Å; I69-A73 WeakPolarHBondContact O-CB 3.49Å; I69-A73 PolarHBondContact O-N 3.01Å; S70-A73 PolarHBondContact O-N 2.81Å; A73-D76 PolarHBondContact O-N 2.99Å; A73-M77 PolarHBondContact O-N 3.15Å
74	L	96.3	Very high	93.7	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67	-38.3	176.9	-174.9	54.1	0	0	0	112.1	I52 I55 I56 L59 S70 L71 C72 D76 M77 L79 V88 I115	I52-L74 HydrophobicContact CG1-CD1 4.07Å; I52-L74 HydrophobicContact CG2-CD1 4.09Å; I55-L74 HydrophobicContact CG2-CB 3.77Å; I56-L74 HydrophobicContact CD1-CD2 3.53Å; L59-L74 HydrophobicContact CD1-CD2 3.99Å; S70-L74 WeakPolarHBondContact O-CB 3.39Å; S70-L74 PolarHBondContact O-N 3.24Å; L71-L74 PolarHBondContact O-N 3.31Å; C72-L74 VanDerWaalsContact C-N 3.32Å; C72-L74 PolarHBondContact O-N 2.8Å; L74-D76 VanDerWaalsContact C-N 3.26Å; L74-D76 PolarHBondContact O-N 3.4Å; L74-M77 HydrophobicContact CD1-CG 4.38Å; L74-M77 VanDerWaalsContact O-CB 3.31Å; L74-M77 WeakPolarHBondContact O-CB 3.44Å; L74-M77 PolarHBondContact O-N 3.3Å; L74-L79 HydrophobicContact CD1-CD2 4.16Å; L74-L79 WeakPolarHBondContact O-CD1 3.35Å; L74-V88 HydrophobicContact CD1-CG2 4.19Å; L74-I115 HydrophobicContact CB-CD1 4.04Å; L74-I115 HydrophobicContact CD2-CD1 3.96Å; L74-I115 HydrophobicContact CD2-CG2 4.18Å; L74-I115 HydrophobicContact CG-CD1 4.06Å; L74-I115 HydrophobicContact CG-CG1 4.45Å; L74-I115 HydrophobicContact CG-CG2 4.41Å
75	K	94.9	Very high	93.9	Very high	106 Å²	106	53.6 Å²	53.6	46%	0.461	29%	0.291	S	S	.	.	H	α-helix	trans	-64.7	-32	177.7	-176.7	-174	167.2	-111.8	0	112.3	L71 C72 M77 K114 I115	L71-K75 WeakPolarHBondContact O-CB 3.4Å; L71-K75 PolarHBondContact O-N 3.49Å; C72-K75 WeakPolarHBondContact O-CB 3.29Å; C72-K75 PolarHBondContact O-N 3.27Å; C72-K75 VanDerWaalsContact O-N 3.14Å; K75-M77 VanDerWaalsContact C-N 3.25Å; K75-M77 PolarHBondContact O-N 3Å; K75-K114 HydrophobicContact CD-CB 4.29Å; K75-K114 HydrophobicContact CD-CD 4.28Å; K75-I115 HydrophobicContact CB-CG1 4.18Å
76	D	95	Very high	94	Very high	128 Å²	128	49.8 Å²	49.8	68%	0.684	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-10.7	178.9	-63.6	-22.5	0	0	0	112.7	C72 A73 L74	C72-D76 PolarHBondContact O-N 2.79Å; C72-D76 VanDerWaalsContact O-N 3.09Å; A73-D76 PolarHBondContact O-N 2.99Å; L74-D76 VanDerWaalsContact C-N 3.26Å; L74-D76 PolarHBondContact O-N 3.4Å
77	M	95	Very high	94	Very high	19 Å²	19	47.8 Å²	47.8	9%	0.094	25%	0.253	C	S	.	.	S	Bend	trans	-68.6	154.8	169.6	-61.2	-58.4	-67.6	0	0	111.1	E48 Q51 I52 I55 A73 L74 K75 L79	E48-M77 HydrophobicContact CB-CE 3.98Å; E48-M77 HydrophobicContact CG-CE 4.26Å; Q51-M77 HydrophobicContact CB-CE 3.96Å; Q51-M77 HydrophobicContact CG-CE 3.93Å; Q51-M77 HydrophobicContact CG-SD 4.11Å; I52-M77 HydrophobicContact CD1-CB 4.46Å; I52-M77 HydrophobicContact CG1-CB 4.29Å; I52-M77 HydrophobicContact CG1-CE 4.04Å; I52-M77 HydrophobicContact CG1-CG 4.04Å; I55-M77 HydrophobicContact CD1-CG 3.91Å; I55-M77 HydrophobicContact CD1-SD 4.06Å; A73-M77 PolarHBondContact O-N 3.15Å; L74-M77 HydrophobicContact CD1-CG 4.38Å; L74-M77 VanDerWaalsContact O-CB 3.31Å; L74-M77 WeakPolarHBondContact O-CB 3.44Å; L74-M77 PolarHBondContact O-N 3.3Å; K75-M77 VanDerWaalsContact C-N 3.25Å; K75-M77 PolarHBondContact O-N 3Å; M77-L79 HydrophobicContact CB-CD2 4.42Å; M77-L79 HydrophobicContact CB-CG 4.43Å; M77-L79 PolarHBondContact O-N 2.83Å
78	P	93.8	Very high	94.1	Very high	62 Å²	62	47.4 Å²	47.4	40%	0.403	25%	0.251	S	S	.	.			trans	-75.5	62.3	179.9	30.8	-34.3	0	0	0	112.7	E48 K80 T81 C84	E48-P78 HydrophobicContact CG-CG 4.43Å; P78-K80 PolarHBondContact O-N 2.94Å; P78-T81 HydrophobicContact CB-CG2 4.36Å; P78-T81 PolarHBondContact O-N 3.04Å; P78-T81 PolarHBondContact O-OG1 3.48Å; P78-C84 WeakPolarHBondContact O-CB 3.45Å
79	L	93.8	Very high	94.1	Very high	6 Å²	6	48.6 Å²	48.6	3%	0.031	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-2.6	-178.7	-64	177.9	0	0	0	114.9	I52 L74 M77 T81 Q85 V88 I115 E118 I119	I52-L79 HydrophobicContact CD1-CD2 4.46Å; L74-L79 HydrophobicContact CD1-CD2 4.16Å; L74-L79 WeakPolarHBondContact O-CD1 3.35Å; M77-L79 HydrophobicContact CB-CD2 4.42Å; M77-L79 HydrophobicContact CB-CG 4.43Å; M77-L79 PolarHBondContact O-N 2.83Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-Q85 WeakPolarHBondContact O-CG 3.35Å; L79-Q85 PolarHBondContact O-NE2 2.97Å; L79-V88 HydrophobicContact CD2-CG2 3.87Å; L79-I115 HydrophobicContact CD1-CB 4.31Å; L79-I115 HydrophobicContact CD1-CG1 4.14Å; L79-I115 HydrophobicContact CD1-CG2 3.85Å; L79-E118 HydrophobicContact CB-CB 4.21Å; L79-I119 HydrophobicContact CB-CG2 4.23Å; L79-I119 HydrophobicContact CD1-CG2 4.48Å; L79-I119 HydrophobicContact CD2-CG2 4.19Å
80	K	92.7	Very high	94	Very high	167 Å²	167	46.5 Å²	46.5	73%	0.726	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-19.9	170.9	-64.7	-175.7	-179.5	-179.3	0	112.5	P78 Q85	P78-K80 PolarHBondContact O-N 2.94Å; K80-Q85 PolarHBondContact O-NE2 3.35Å
81	T	93.6	Very high	93.9	Very high	62 Å²	62	48.1 Å²	48.1	38%	0.38	25%	0.253	S	S	.	.	S	Bend	trans	-80.9	138.9	179.7	62.8	0	0	0	0	110.7	P78 L79 I83 C84 Q85	P78-T81 HydrophobicContact CB-CG2 4.36Å; P78-T81 PolarHBondContact O-N 3.04Å; P78-T81 PolarHBondContact O-OG1 3.48Å; L79-T81 VanDerWaalsContact C-N 3.34Å; T81-I83 PolarHBondContact O-N 2.95Å; T81-C84 PolarHBondContact O-N 3.49Å; T81-C84 VanDerWaalsContact OG1-CB 3.26Å; T81-C84 WeakPolarHBondContact OG1-CB 3.47Å; T81-C84 PolarHBondContact OG1-N 3.11Å; T81-C84 PolarHBondContact OG1-SG 3.08Å; T81-Q85 VanDerWaalsContact O-CG 3.26Å; T81-Q85 WeakPolarHBondContact O-CG 3.26Å; T81-Q85 PolarHBondContact O-N 3.22Å
82	E	91.5	Very high	93.7	Very high	87 Å²	87	49.1 Å²	49.1	41%	0.407	26%	0.264	S	S	.	.	H	α-helix	trans	-55.5	-42.1	179.1	-175.5	178.4	-167.6	0	0	111.2	R37 C84 Q85 L86	R37-E82 IonicContact NH1-OE2 3.35Å; E82-C84 PolarHBondContact O-N 2.72Å; E82-Q85 WeakPolarHBondContact O-CB 3.44Å; E82-Q85 PolarHBondContact O-N 2.76Å; E82-L86 HydrophobicContact CG-CD1 3.87Å; E82-L86 HydrophobicContact CG-CG 4.2Å; E82-L86 WeakPolarHBondContact O-CB 3.07Å; E82-L86 VanDerWaalsContact O-CG 3.26Å; E82-L86 WeakPolarHBondContact O-CG 3.4Å; E82-L86 PolarHBondContact O-N 3.08Å
83	I	91.9	Very high	93.7	Very high	72 Å²	72	45.9 Å²	45.9	37%	0.369	24%	0.242	S	C	.	.	H	α-helix	trans	-58.6	-47.4	179.3	-59.6	172.7	0	0	0	111.5	P46 Y49 T81 L86 A87	P46-I83 HydrophobicContact CG-CD1 4.06Å; P46-I83 HydrophobicContact CG-CG2 4.11Å; Y49-I83 HydrophobicContact CD2-CG2 4.44Å; T81-I83 PolarHBondContact O-N 2.95Å; I83-L86 PolarHBondContact O-N 3.48Å; I83-A87 WeakPolarHBondContact O-CB 3.43Å; I83-A87 PolarHBondContact O-N 3.33Å
84	C	93.6	Very high	93.7	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.02	23%	0.227	C	C	.	.	H	α-helix	trans	-68.7	-36.1	179.5	-69.5	0	0	0	0	112.3	I52 P78 T81 E82 A87 V88	I52-C84 HydrophobicContact CD1-CB 3.45Å; I52-C84 VanDerWaalsContact CD1-CB 3.45Å; P78-C84 WeakPolarHBondContact O-CB 3.45Å; T81-C84 PolarHBondContact O-N 3.49Å; T81-C84 VanDerWaalsContact OG1-CB 3.26Å; T81-C84 WeakPolarHBondContact OG1-CB 3.47Å; T81-C84 PolarHBondContact OG1-N 3.11Å; T81-C84 PolarHBondContact OG1-SG 3.08Å; E82-C84 PolarHBondContact O-N 2.72Å; C84-A87 WeakPolarHBondContact O-CB 3.26Å; C84-A87 PolarHBondContact O-N 3.42Å; C84-V88 WeakPolarHBondContact O-CG2 3.33Å; C84-V88 PolarHBondContact O-N 3Å; C84-V88 VanDerWaalsContact O-N 3.12Å
85	Q	94.2	Very high	93.7	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.065	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-49.5	175.5	-70.6	170.9	-9.5	0	0	110.8	L79 K80 T81 E82 A87 V88 R89 E118 I119 N122 I125	L79-Q85 WeakPolarHBondContact O-CG 3.35Å; L79-Q85 PolarHBondContact O-NE2 2.97Å; K80-Q85 PolarHBondContact O-NE2 3.35Å; T81-Q85 VanDerWaalsContact O-CG 3.26Å; T81-Q85 WeakPolarHBondContact O-CG 3.26Å; T81-Q85 PolarHBondContact O-N 3.22Å; E82-Q85 WeakPolarHBondContact O-CB 3.44Å; E82-Q85 PolarHBondContact O-N 2.76Å; Q85-A87 VanDerWaalsContact C-N 3.33Å; Q85-A87 PolarHBondContact O-N 3.22Å; Q85-V88 PolarHBondContact O-N 3.45Å; Q85-R89 PolarHBondContact O-N 2.89Å; Q85-E118 PolarHBondContact NE2-O 3.22Å; Q85-I119 HydrophobicContact CG-CB 4.24Å; Q85-I119 HydrophobicContact CG-CG2 4.12Å; Q85-N122 PolarHBondContact OE1-ND2 3.19Å; Q85-I125 HydrophobicContact CB-CD1 3.64Å; Q85-I125 VanDerWaalsContact O-CD1 3.27Å; Q85-I125 WeakPolarHBondContact O-CD1 3.49Å
86	L	92	Very high	93.7	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-38	177	-62.4	179	0	0	0	111.3	E82 I83 V88 R89 D90 Q124	E82-L86 HydrophobicContact CG-CD1 3.87Å; E82-L86 HydrophobicContact CG-CG 4.2Å; E82-L86 WeakPolarHBondContact O-CB 3.07Å; E82-L86 VanDerWaalsContact O-CG 3.26Å; E82-L86 WeakPolarHBondContact O-CG 3.4Å; E82-L86 PolarHBondContact O-N 3.08Å; I83-L86 PolarHBondContact O-N 3.48Å; L86-V88 VanDerWaalsContact C-N 3.3Å; L86-V88 PolarHBondContact O-N 2.89Å; L86-R89 CarbonylContact O-C 3.59Å; L86-R89 WeakPolarHBondContact O-CA 3.45Å; L86-R89 WeakPolarHBondContact O-CB 3.5Å; L86-R89 PolarHBondContact O-N 3.48Å; L86-D90 WeakPolarHBondContact O-CB 3.43Å; L86-D90 PolarHBondContact O-N 2.9Å; L86-Q124 VanDerWaalsContact CD2-OE1 3.22Å
87	A	93.8	Very high	93.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56	-42.6	172.9	0	0	0	0	0	112.8	Y49 I52 I83 C84 Q85 R89 V91	Y49-A87 HydrophobicContact CD2-CB 3.29Å; Y49-A87 VanDerWaalsContact CE2-CA 3.46Å; Y49-A87 HydrophobicContact CE2-CB 3.59Å; Y49-A87 HydrophobicContact CG-CB 3.84Å; I52-A87 HydrophobicContact CB-CB 4.16Å; I52-A87 HydrophobicContact CD1-CB 4.03Å; I52-A87 HydrophobicContact CG2-CB 3.93Å; I83-A87 WeakPolarHBondContact O-CB 3.43Å; I83-A87 PolarHBondContact O-N 3.33Å; C84-A87 WeakPolarHBondContact O-CB 3.26Å; C84-A87 PolarHBondContact O-N 3.42Å; Q85-A87 VanDerWaalsContact C-N 3.33Å; Q85-A87 PolarHBondContact O-N 3.22Å; A87-R89 VanDerWaalsContact C-N 3.32Å; A87-R89 PolarHBondContact O-N 3.37Å; A87-V91 VanDerWaalsContact O-CG2 3.3Å; A87-V91 WeakPolarHBondContact O-CG2 3.27Å; A87-V91 PolarHBondContact O-N 3.29Å
88	V	94.8	Very high	93.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-39.1	175.7	176.1	0	0	0	0	111.1	I52 I56 L74 L79 C84 Q85 L86 G93 L97 I119	I52-V88 HydrophobicContact CG2-CG2 3.68Å; I56-V88 HydrophobicContact CD1-CG1 4.47Å; L74-V88 HydrophobicContact CD1-CG2 4.19Å; L79-V88 HydrophobicContact CD2-CG2 3.87Å; C84-V88 WeakPolarHBondContact O-CG2 3.33Å; C84-V88 PolarHBondContact O-N 3Å; C84-V88 VanDerWaalsContact O-N 3.12Å; Q85-V88 PolarHBondContact O-N 3.45Å; L86-V88 VanDerWaalsContact C-N 3.3Å; L86-V88 PolarHBondContact O-N 2.89Å; V88-G93 WeakPolarHBondContact O-CA 3.49Å; V88-G93 PolarHBondContact O-N 2.8Å; V88-L97 HydrophobicContact CG1-CD1 3.99Å; V88-I119 HydrophobicContact CB-CD1 4.45Å; V88-I119 HydrophobicContact CG1-CD1 3.78Å
89	R	93.3	Very high	93.9	Very high	58 Å²	58	39 Å²	39	22%	0.219	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-53.7	175.4	-177.5	-164.5	69	-169.1	-4.7	111.2	Q85 L86 A87 V91 G92 I94 I125	Q85-R89 PolarHBondContact O-N 2.89Å; L86-R89 CarbonylContact O-C 3.59Å; L86-R89 WeakPolarHBondContact O-CA 3.45Å; L86-R89 WeakPolarHBondContact O-CB 3.5Å; L86-R89 PolarHBondContact O-N 3.48Å; A87-R89 VanDerWaalsContact C-N 3.32Å; A87-R89 PolarHBondContact O-N 3.37Å; R89-V91 VanDerWaalsContact C-N 3.31Å; R89-V91 PolarHBondContact O-N 3.4Å; R89-G92 PolarHBondContact O-N 2.85Å; R89-I94 HydrophobicContact CB-CD1 3.82Å; R89-I94 HydrophobicContact CG-CD1 3.76Å; R89-I125 HydrophobicContact CB-CG1 4.42Å
90	D	92.3	Very high	94	Very high	65 Å²	65	39.7 Å²	39.7	35%	0.348	20%	0.203	S	C	.	.	H	α-helix	trans	-67.3	-30.5	-167.3	-62.8	-19.6	0	0	0	112.5	Y49 L86 G92	Y49-D90 VanDerWaalsContact OH-CB 3.31Å; Y49-D90 WeakPolarHBondContact OH-CB 3.46Å; L86-D90 WeakPolarHBondContact O-CB 3.43Å; L86-D90 PolarHBondContact O-N 2.9Å; D90-G92 PolarHBondContact O-N 2.95Å
91	V	92.2	Very high	94.1	Very high	44 Å²	44	31.8 Å²	31.8	27%	0.267	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	5.8	177.1	-167.4	0	0	0	0	112.5	I56 K60 A87 R89 G93	I56-V91 HydrophobicContact CB-CG1 4.16Å; I56-V91 HydrophobicContact CG2-CB 4.43Å; I56-V91 HydrophobicContact CG2-CG1 4.01Å; K60-V91 PolarHBondContact NZ-O 3.4Å; K60-V91 VanDerWaalsContact NZ-O 3.15Å; A87-V91 VanDerWaalsContact O-CG2 3.3Å; A87-V91 WeakPolarHBondContact O-CG2 3.27Å; A87-V91 PolarHBondContact O-N 3.29Å; R89-V91 VanDerWaalsContact C-N 3.31Å; R89-V91 PolarHBondContact O-N 3.4Å; V91-G93 VanDerWaalsContact C-N 3.34Å
92	G	93.3	Very high	94.1	Very high	24 Å²	24	34.6 Å²	34.6	25%	0.247	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	27.2	-178.3	0	0	0	0	0	113	R89 D90 I94	R89-G92 PolarHBondContact O-N 2.85Å; D90-G92 PolarHBondContact O-N 2.95Å; G92-I94 VanDerWaalsContact C-N 3.34Å
93	G	95	Very high	94.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.5	-30.9	179.1	0	0	0	0	0	113.1	V88 V91 E95 V96 L97	V88-G93 WeakPolarHBondContact O-CA 3.49Å; V88-G93 PolarHBondContact O-N 2.8Å; V91-G93 VanDerWaalsContact C-N 3.34Å; G93-E95 PolarHBondContact O-N 3.14Å; G93-V96 PolarHBondContact O-N 3.36Å; G93-L97 WeakPolarHBondContact O-CB 3.46Å; G93-L97 WeakPolarHBondContact O-CG 3.18Å; G93-L97 PolarHBondContact O-N 3.44Å
94	I	95.6	Very high	94.2	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-59.8	-48.4	178.1	-61.4	172.1	0	0	0	111	R89 G92 V96 L97 I98 I119 I125 V129 I132	R89-I94 HydrophobicContact CB-CD1 3.82Å; R89-I94 HydrophobicContact CG-CD1 3.76Å; G92-I94 VanDerWaalsContact C-N 3.34Å; I94-V96 VanDerWaalsContact C-N 3.34Å; I94-V96 PolarHBondContact O-N 2.85Å; I94-L97 PolarHBondContact O-N 3.44Å; I94-I98 HydrophobicContact CG2-CG1 4.29Å; I94-I98 WeakPolarHBondContact O-CG1 3.18Å; I94-I98 PolarHBondContact O-N 3.38Å; I94-I119 HydrophobicContact CG1-CD1 4.43Å; I94-I125 HydrophobicContact CD1-CB 4.47Å; I94-I125 HydrophobicContact CD1-CG1 4.41Å; I94-I125 HydrophobicContact CD1-CG2 3.83Å; I94-I125 HydrophobicContact CG1-CG2 4.45Å; I94-V129 HydrophobicContact CG2-CG2 3.71Å; I94-I132 HydrophobicContact CG2-CD1 4.23Å
95	E	95.5	Very high	94.1	Very high	107 Å²	107	38.9 Å²	38.9	50%	0.5	20%	0.204	S	C	.	.	H	α-helix	trans	-59.5	-45.9	178.8	-172.2	-173.4	167.5	0	0	111.2	G93 L97 I98 N99	G93-E95 PolarHBondContact O-N 3.14Å; E95-L97 VanDerWaalsContact C-N 3.34Å; E95-L97 PolarHBondContact O-N 3.06Å; E95-I98 PolarHBondContact O-N 3.06Å; E95-N99 WeakPolarHBondContact O-CB 3.45Å; E95-N99 PolarHBondContact O-N 3.38Å; E95-N99 PolarHBondContact O-ND2 3.24Å; E95-N99 PolarHBondContact O-OD1 2.88Å
96	V	95.3	Very high	94.1	Very high	19 Å²	19	41 Å²	41	12%	0.115	22%	0.218	C	C	.	.	H	α-helix	trans	-59.5	-46.1	176.6	178.8	0	0	0	0	111	L59 K60 G93 I94 N99 L100	L59-V96 HydrophobicContact CB-CG1 3.93Å; K60-V96 HydrophobicContact CD-CG2 4.21Å; K60-V96 VanDerWaalsContact CE-CG2 3.44Å; K60-V96 HydrophobicContact CG-CG2 3.69Å; G93-V96 PolarHBondContact O-N 3.36Å; I94-V96 VanDerWaalsContact C-N 3.34Å; I94-V96 PolarHBondContact O-N 2.85Å; V96-N99 PolarHBondContact O-N 3.43Å; V96-L100 HydrophobicContact CG1-CD1 4.25Å; V96-L100 VanDerWaalsContact O-CG 3.25Å; V96-L100 WeakPolarHBondContact O-CG 3.43Å; V96-L100 PolarHBondContact O-N 3.15Å
97	L	96.6	Very high	94.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-43.4	179.1	-70.1	167.4	0	0	0	111.5	L71 V88 G93 I94 E95 L100 L101 S112 I115 L116 I119	L71-L97 HydrophobicContact CD2-CD2 3.83Å; V88-L97 HydrophobicContact CG1-CD1 3.99Å; G93-L97 WeakPolarHBondContact O-CB 3.46Å; G93-L97 WeakPolarHBondContact O-CG 3.18Å; G93-L97 PolarHBondContact O-N 3.44Å; I94-L97 PolarHBondContact O-N 3.44Å; E95-L97 VanDerWaalsContact C-N 3.34Å; E95-L97 PolarHBondContact O-N 3.06Å; L97-L100 WeakPolarHBondContact O-CB 3.44Å; L97-L100 PolarHBondContact O-N 3.35Å; L97-L101 WeakPolarHBondContact O-CG 3.25Å; L97-L101 PolarHBondContact O-N 2.89Å; L97-S112 VanDerWaalsContact C-OG 3.26Å; L97-S112 WeakPolarHBondContact CA-OG 3.38Å; L97-S112 WeakPolarHBondContact CB-OG 3.49Å; L97-S112 PolarHBondContact O-OG 3.32Å; L97-I115 HydrophobicContact CD1-CB 4.4Å; L97-I115 HydrophobicContact CD1-CG2 3.58Å; L97-I115 HydrophobicContact CD2-CB 4.23Å; L97-I115 HydrophobicContact CD2-CD1 3.97Å; L97-I115 HydrophobicContact CD2-CG2 4.13Å; L97-L116 HydrophobicContact CB-CD1 4.34Å; L97-L116 HydrophobicContact CB-CD2 4.02Å; L97-L116 HydrophobicContact CB-CG 4.1Å; L97-L116 HydrophobicContact CD1-CD2 4.15Å; L97-L116 HydrophobicContact CD1-CG 4.39Å; L97-I119 HydrophobicContact CD1-CD1 4.09Å
98	I	96.5	Very high	94.3	Very high	5 Å²	5	48 Å²	48	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-64.4	-44.5	176.8	-66.8	-60.7	0	0	0	111	I94 E95 L100 L101 L116 V129 P137	I94-I98 HydrophobicContact CG2-CG1 4.29Å; I94-I98 WeakPolarHBondContact O-CG1 3.18Å; I94-I98 PolarHBondContact O-N 3.38Å; E95-I98 PolarHBondContact O-N 3.06Å; I98-L100 VanDerWaalsContact C-N 3.26Å; I98-L100 PolarHBondContact O-N 2.89Å; I98-L101 HydrophobicContact CD1-CD1 3.99Å; I98-L101 WeakPolarHBondContact O-CB 3.25Å; I98-L101 PolarHBondContact O-N 3.33Å; I98-L116 HydrophobicContact CD1-CD1 3.94Å; I98-L116 HydrophobicContact CD1-CD2 4.33Å; I98-V129 HydrophobicContact CD1-CG1 4.35Å; I98-P137 HydrophobicContact CG2-CG 4Å
99	N	94.7	Very high	94.3	Very high	77 Å²	77	49.4 Å²	49.4	41%	0.412	25%	0.25	S	S	.	.	H	α-helix	trans	-62	-35.4	177.7	-66.3	-12	0	0	0	111.7	E95 V96 L101 E102	E95-N99 WeakPolarHBondContact O-CB 3.45Å; E95-N99 PolarHBondContact O-N 3.38Å; E95-N99 PolarHBondContact O-ND2 3.24Å; E95-N99 PolarHBondContact O-OD1 2.88Å; V96-N99 PolarHBondContact O-N 3.43Å; N99-L101 PolarHBondContact O-N 3.24Å; N99-E102 PolarHBondContact O-N 3.35Å; N99-E102 VanDerWaalsContact O-N 3.11Å
100	L	94.8	Very high	94.4	Very high	19 Å²	19	48 Å²	48	10%	0.099	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-25.5	174.1	-70.9	170.5	0	0	0	112.9	T67 L71 V96 L97 I98 E102 T103 C108	T67-L100 HydrophobicContact CG2-CD1 4.1Å; T67-L100 HydrophobicContact CG2-CD2 3.71Å; L71-L100 HydrophobicContact CD1-CD1 4.23Å; L71-L100 HydrophobicContact CD2-CD1 3.91Å; L71-L100 HydrophobicContact CG-CD1 4.42Å; V96-L100 HydrophobicContact CG1-CD1 4.25Å; V96-L100 VanDerWaalsContact O-CG 3.25Å; V96-L100 WeakPolarHBondContact O-CG 3.43Å; V96-L100 PolarHBondContact O-N 3.15Å; L97-L100 WeakPolarHBondContact O-CB 3.44Å; L97-L100 PolarHBondContact O-N 3.35Å; I98-L100 VanDerWaalsContact C-N 3.26Å; I98-L100 PolarHBondContact O-N 2.89Å; L100-E102 PolarHBondContact O-N 3.48Å; L100-T103 HydrophobicContact CD2-CG2 4.43Å; L100-T103 PolarHBondContact O-N 3.37Å; L100-T103 PolarHBondContact O-OG1 2.93Å; L100-C108 HydrophobicContact CD2-CB 4.43Å
101	L	95.5	Very high	94.6	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-67.9	-25.1	175.6	-59.1	-175.1	0	0	0	112.9	L97 I98 N99 K109 L113 L116 P137 L138 L141	L97-L101 WeakPolarHBondContact O-CG 3.25Å; L97-L101 PolarHBondContact O-N 2.89Å; I98-L101 HydrophobicContact CD1-CD1 3.99Å; I98-L101 WeakPolarHBondContact O-CB 3.25Å; I98-L101 PolarHBondContact O-N 3.33Å; N99-L101 PolarHBondContact O-N 3.24Å; L101-K109 WeakPolarHBondContact O-CE 3.34Å; L101-L113 HydrophobicContact CD1-CD2 4.05Å; L101-L113 HydrophobicContact CD2-CD2 3.67Å; L101-L113 HydrophobicContact CD2-CG 3.63Å; L101-L116 HydrophobicContact CD1-CD1 3.8Å; L101-L116 HydrophobicContact CD2-CD1 4.38Å; L101-L116 HydrophobicContact CG-CD1 4.33Å; L101-P137 HydrophobicContact CB-CB 4.3Å; L101-L138 HydrophobicContact CD1-CD2 3.67Å; L101-L138 HydrophobicContact CD1-CG 4.1Å; L101-L141 HydrophobicContact CB-CD1 3.81Å; L101-L141 HydrophobicContact CD1-CD1 4.27Å; L101-L141 HydrophobicContact CD2-CD1 3.96Å; L101-L141 HydrophobicContact CG-CD1 4.23Å
102	E	93.9	Very high	94.8	Very high	121 Å²	121	43.5 Å²	43.5	57%	0.565	23%	0.225	S	C	*	.	H	α-helix	trans	-90	-10.8	-178.3	-61.2	-172.2	127.3	0	0	113.4	N99 L100 P137	N99-E102 PolarHBondContact O-N 3.35Å; N99-E102 VanDerWaalsContact O-N 3.11Å; L100-E102 PolarHBondContact O-N 3.48Å; E102-P137 HydrophobicContact CG-CB 3.9Å; E102-P137 HydrophobicContact CG-CG 3.91Å
103	T	92.9	Very high	95	Very high	51 Å²	51	42.4 Å²	42.4	31%	0.313	21%	0.213	S	C	.	.	S	Bend	trans	-65.5	174.9	175.5	66.8	0	0	0	0	111.8	L100 K109	L100-T103 HydrophobicContact CD2-CG2 4.43Å; L100-T103 PolarHBondContact O-N 3.37Å; L100-T103 PolarHBondContact O-OG1 2.93Å; T103-K109 WeakPolarHBondContact O-CE 3.49Å; T103-K109 PolarHBondContact O-NZ 3.42Å
104	D	91.7	Very high	95.1	Very high	156 Å²	156	46.5 Å²	46.5	83%	0.834	23%	0.231	S	C	*	.	S	Bend	trans	-90.3	-14	172.6	-69.9	-43.6	0	0	0	113.4	V106	D104-V106 PolarHBondContact O-N 3.15Å
105	E	93.1	Very high	95.2	Very high	45 Å²	45	46.3 Å²	46.3	21%	0.21	23%	0.23	C	C	.	.			trans	-77.8	108	-172.1	179.6	55.1	-156	0	0	112.4	Q64 R107 C108 K109	Q64-E105 HydrophobicContact CG-CG 4.23Å; Q64-E105 PolarHBondContact NE2-OE2 2.91Å; E105-R107 VanDerWaalsContact C-N 3.29Å; E105-R107 HydrophobicContact CG-CB 4.4Å; E105-R107 PolarHBondContact O-N 3.13Å; E105-R107 WeakPolarHBondContact OE1-CB 3.47Å; E105-R107 IonicContact OE1-CZ 3.03Å; E105-R107 IonicContact OE1-NE 2.72Å; E105-R107 PolarHBondContact OE1-NE 2.88Å; E105-R107 IonicContact OE1-NH2 3.9Å; E105-R107 PolarHBondContact OE1-NH2 3.18Å; E105-R107 VanDerWaalsContact OE1-NH2 3.08Å; E105-C108 HydrophobicContact CB-CB 4.05Å; E105-C108 HydrophobicContact CG-CB 3.99Å; E105-C108 VanDerWaalsContact CG-SG 3.52Å; E105-C108 WeakPolarHBondContact O-CB 3.29Å; E105-C108 PolarHBondContact O-N 2.64Å; E105-C108 VanDerWaalsContact O-N 3.11Å; E105-K109 PolarHBondContact O-N 3.09Å; E105-K109 VanDerWaalsContact O-N 3.09Å
106	V	94.1	Very high	95.3	Very high	59 Å²	59	41.3 Å²	41.3	36%	0.358	21%	0.207	S	C	.	.	H	α-helix	trans	-57.1	-39.5	-178	177.6	0	0	0	0	112.3	D104 C108 K109 L110 L149	D104-V106 PolarHBondContact O-N 3.15Å; V106-C108 PolarHBondContact O-N 2.63Å; V106-K109 PolarHBondContact O-N 3.28Å; V106-L110 HydrophobicContact CG1-CD1 3.91Å; V106-L110 HydrophobicContact CG1-CG 4.32Å; V106-L110 WeakPolarHBondContact O-CB 3.4Å; V106-L110 WeakPolarHBondContact O-CG 3.47Å; V106-L110 PolarHBondContact O-N 3.46Å; V106-L149 HydrophobicContact CG1-CD1 4.31Å
107	R	94.2	Very high	95.3	Very high	148 Å²	148	42.5 Å²	42.5	56%	0.558	21%	0.21	S	C	*	.	H	α-helix	trans	-65.8	-38.6	179.3	-68.4	176.5	-69.7	179.8	-0.5	112.2	I68 E105 L110 G111	I68-R107 HydrophobicContact CD1-CB 3.94Å; I68-R107 HydrophobicContact CG1-CB 4.3Å; E105-R107 VanDerWaalsContact C-N 3.29Å; E105-R107 HydrophobicContact CG-CB 4.4Å; E105-R107 PolarHBondContact O-N 3.13Å; E105-R107 WeakPolarHBondContact OE1-CB 3.47Å; E105-R107 IonicContact OE1-CZ 3.03Å; E105-R107 IonicContact OE1-NE 2.72Å; E105-R107 PolarHBondContact OE1-NE 2.88Å; E105-R107 IonicContact OE1-NH2 3.9Å; E105-R107 PolarHBondContact OE1-NH2 3.18Å; E105-R107 VanDerWaalsContact OE1-NH2 3.08Å; R107-L110 PolarHBondContact O-N 3.41Å; R107-G111 PolarHBondContact O-N 3.07Å
108	C	94.3	Very high	95.3	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.034	22%	0.219	C	C	.	.	H	α-helix	trans	-64.5	-45.1	175.3	-68.8	0	0	0	0	111.1	L71 L100 E105 V106 G111 S112	L71-C108 HydrophobicContact CD1-CB 4.34Å; L71-C108 WeakPolarHBondContact CD1-O 3.42Å; L100-C108 HydrophobicContact CD2-CB 4.43Å; E105-C108 HydrophobicContact CB-CB 4.05Å; E105-C108 HydrophobicContact CG-CB 3.99Å; E105-C108 VanDerWaalsContact CG-SG 3.52Å; E105-C108 WeakPolarHBondContact O-CB 3.29Å; E105-C108 PolarHBondContact O-N 2.64Å; E105-C108 VanDerWaalsContact O-N 3.11Å; V106-C108 PolarHBondContact O-N 2.63Å; C108-G111 PolarHBondContact O-N 2.77Å; C108-S112 WeakPolarHBondContact O-CB 3.39Å; C108-S112 PolarHBondContact O-N 3.06Å
109	K	95.9	Very high	95.3	Very high	29 Å²	29	44 Å²	44	13%	0.126	22%	0.218	C	C	.	.	H	α-helix	trans	-59	-49	175.4	-65	178.8	-179.7	-178.6	0	112	L101 T103 E105 V106 G111 S112 L113 L141 L149	L101-K109 WeakPolarHBondContact O-CE 3.34Å; T103-K109 WeakPolarHBondContact O-CE 3.49Å; T103-K109 PolarHBondContact O-NZ 3.42Å; E105-K109 PolarHBondContact O-N 3.09Å; E105-K109 VanDerWaalsContact O-N 3.09Å; V106-K109 PolarHBondContact O-N 3.28Å; K109-G111 PolarHBondContact O-N 3.44Å; K109-S112 PolarHBondContact O-N 2.86Å; K109-L113 WeakPolarHBondContact O-CB 3.35Å; K109-L113 WeakPolarHBondContact O-CG 3.49Å; K109-L113 PolarHBondContact O-N 3.22Å; K109-L141 HydrophobicContact CD-CD2 3.82Å; K109-L149 HydrophobicContact CB-CD1 4.5Å; K109-L149 HydrophobicContact CB-CD2 3.54Å; K109-L149 HydrophobicContact CD-CD1 4.05Å; K109-L149 HydrophobicContact CD-CD2 4.5Å
110	L	96.1	Very high	95.3	Very high	30 Å²	30	40.4 Å²	40.4	16%	0.157	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-44.4	178.6	-74.4	169.8	0	0	0	111.8	V106 R107 K114 D148 L149 L152	V106-L110 HydrophobicContact CG1-CD1 3.91Å; V106-L110 HydrophobicContact CG1-CG 4.32Å; V106-L110 WeakPolarHBondContact O-CB 3.4Å; V106-L110 WeakPolarHBondContact O-CG 3.47Å; V106-L110 PolarHBondContact O-N 3.46Å; R107-L110 PolarHBondContact O-N 3.41Å; L110-K114 WeakPolarHBondContact O-CB 3.24Å; L110-K114 VanDerWaalsContact O-CG 3.25Å; L110-K114 WeakPolarHBondContact O-CG 3.47Å; L110-K114 PolarHBondContact O-N 3.36Å; L110-D148 HydrophobicContact CD2-CB 3.7Å; L110-L149 HydrophobicContact CD2-CD2 3.62Å; L110-L149 HydrophobicContact CD2-CG 4.09Å; L110-L149 HydrophobicContact CG-CD2 3.71Å; L110-L149 HydrophobicContact CG-CG 4.37Å; L110-L152 HydrophobicContact CD2-CD1 3.89Å
111	G	95.4	Very high	95.2	Very high	14 Å²	14	44.5 Å²	44.5	14%	0.144	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-47.5	176.4	0	0	0	0	0	111.7	R107 C108 K109 K114 I115	R107-G111 PolarHBondContact O-N 3.07Å; C108-G111 PolarHBondContact O-N 2.77Å; K109-G111 PolarHBondContact O-N 3.44Å; G111-K114 PolarHBondContact O-N 3.37Å; G111-I115 WeakPolarHBondContact O-CD1 3.44Å; G111-I115 PolarHBondContact O-N 3.16Å
112	S	96.9	Very high	95.1	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-49.5	177.6	176.7	0	0	0	0	112.3	L97 C108 K109 K114 I115 L116	L97-S112 VanDerWaalsContact C-OG 3.26Å; L97-S112 WeakPolarHBondContact CA-OG 3.38Å; L97-S112 WeakPolarHBondContact CB-OG 3.49Å; L97-S112 PolarHBondContact O-OG 3.32Å; C108-S112 WeakPolarHBondContact O-CB 3.39Å; C108-S112 PolarHBondContact O-N 3.06Å; K109-S112 PolarHBondContact O-N 2.86Å; S112-K114 VanDerWaalsContact C-N 3.32Å; S112-K114 PolarHBondContact O-N 2.9Å; S112-I115 PolarHBondContact O-N 2.95Å; S112-I115 VanDerWaalsContact O-N 3.15Å; S112-L116 WeakPolarHBondContact O-CB 3.37Å; S112-L116 WeakPolarHBondContact O-CG 3.22Å; S112-L116 PolarHBondContact O-N 3.41Å
113	L	97.4	Very high	95	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.7	-37.8	178.8	-70.3	173.7	0	0	0	112.8	L101 K109 I115 L116 K117 L138 L141 L149 L152 C153 V156	L101-L113 HydrophobicContact CD1-CD2 4.05Å; L101-L113 HydrophobicContact CD2-CD2 3.67Å; L101-L113 HydrophobicContact CD2-CG 3.63Å; K109-L113 WeakPolarHBondContact O-CB 3.35Å; K109-L113 WeakPolarHBondContact O-CG 3.49Å; K109-L113 PolarHBondContact O-N 3.22Å; L113-I115 VanDerWaalsContact C-N 3.31Å; L113-I115 PolarHBondContact O-N 3.31Å; L113-L116 PolarHBondContact O-N 3.35Å; L113-K117 VanDerWaalsContact O-CB 3.29Å; L113-K117 WeakPolarHBondContact O-CB 3.15Å; L113-K117 PolarHBondContact O-N 3.26Å; L113-L138 HydrophobicContact CD2-CD2 3.59Å; L113-L141 HydrophobicContact CD1-CD1 4.29Å; L113-L141 HydrophobicContact CD2-CD1 4.49Å; L113-L149 HydrophobicContact CD1-CD2 3.84Å; L113-L152 HydrophobicContact CB-CB 3.82Å; L113-L152 HydrophobicContact CB-CD1 4.3Å; L113-L152 HydrophobicContact CD1-CB 4.04Å; L113-C153 HydrophobicContact CD1-CB 4.24Å; L113-C153 HydrophobicContact CD2-CB 4.42Å; L113-V156 HydrophobicContact CD2-CG2 4.26Å
114	K	96.8	Very high	94.9	Very high	86 Å²	86	40.4 Å²	40.4	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-62	-38.3	176.2	-76.4	172.4	-177.9	179.7	0	112.1	K75 L110 G111 S112 L152	K75-K114 HydrophobicContact CD-CB 4.29Å; K75-K114 HydrophobicContact CD-CD 4.28Å; L110-K114 WeakPolarHBondContact O-CB 3.24Å; L110-K114 VanDerWaalsContact O-CG 3.25Å; L110-K114 WeakPolarHBondContact O-CG 3.47Å; L110-K114 PolarHBondContact O-N 3.36Å; G111-K114 PolarHBondContact O-N 3.37Å; S112-K114 VanDerWaalsContact C-N 3.32Å; S112-K114 PolarHBondContact O-N 2.9Å; K114-L152 HydrophobicContact CG-CD1 3.8Å; K114-L152 HydrophobicContact CG-CD2 4.18Å
115	I	97.4	Very high	95	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-72.7	-50.1	176.1	-67.5	155.6	0	0	0	110.2	L71 L74 K75 L79 L97 G111 S112 L113 K117 E118 I119	L71-I115 HydrophobicContact CB-CD1 4.36Å; L71-I115 HydrophobicContact CD2-CD1 3.65Å; L74-I115 HydrophobicContact CB-CD1 4.04Å; L74-I115 HydrophobicContact CD2-CD1 3.96Å; L74-I115 HydrophobicContact CD2-CG2 4.18Å; L74-I115 HydrophobicContact CG-CD1 4.06Å; L74-I115 HydrophobicContact CG-CG1 4.45Å; L74-I115 HydrophobicContact CG-CG2 4.41Å; K75-I115 HydrophobicContact CB-CG1 4.18Å; L79-I115 HydrophobicContact CD1-CB 4.31Å; L79-I115 HydrophobicContact CD1-CG1 4.14Å; L79-I115 HydrophobicContact CD1-CG2 3.85Å; L97-I115 HydrophobicContact CD1-CB 4.4Å; L97-I115 HydrophobicContact CD1-CG2 3.58Å; L97-I115 HydrophobicContact CD2-CB 4.23Å; L97-I115 HydrophobicContact CD2-CD1 3.97Å; L97-I115 HydrophobicContact CD2-CG2 4.13Å; G111-I115 WeakPolarHBondContact O-CD1 3.44Å; G111-I115 PolarHBondContact O-N 3.16Å; S112-I115 PolarHBondContact O-N 2.95Å; S112-I115 VanDerWaalsContact O-N 3.15Å; L113-I115 VanDerWaalsContact C-N 3.31Å; L113-I115 PolarHBondContact O-N 3.31Å; I115-K117 PolarHBondContact O-N 3.31Å; I115-E118 PolarHBondContact O-N 3.43Å; I115-I119 HydrophobicContact CG2-CD1 4.46Å; I115-I119 PolarHBondContact O-N 3.05Å; I115-I119 VanDerWaalsContact O-N 3.14Å
116	L	97.4	Very high	95	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-53.9	-41.7	178.4	-74.8	170.6	0	0	0	111.4	L97 I98 L101 S112 L113 E118 I119 T120 V156	L97-L116 HydrophobicContact CB-CD1 4.34Å; L97-L116 HydrophobicContact CB-CD2 4.02Å; L97-L116 HydrophobicContact CB-CG 4.1Å; L97-L116 HydrophobicContact CD1-CD2 4.15Å; L97-L116 HydrophobicContact CD1-CG 4.39Å; I98-L116 HydrophobicContact CD1-CD1 3.94Å; I98-L116 HydrophobicContact CD1-CD2 4.33Å; L101-L116 HydrophobicContact CD1-CD1 3.8Å; L101-L116 HydrophobicContact CD2-CD1 4.38Å; L101-L116 HydrophobicContact CG-CD1 4.33Å; S112-L116 WeakPolarHBondContact O-CB 3.37Å; S112-L116 WeakPolarHBondContact O-CG 3.22Å; S112-L116 PolarHBondContact O-N 3.41Å; L113-L116 PolarHBondContact O-N 3.35Å; L116-E118 VanDerWaalsContact C-N 3.34Å; L116-E118 PolarHBondContact O-N 3.08Å; L116-I119 HydrophobicContact CD2-CD1 4.25Å; L116-I119 PolarHBondContact O-N 3.49Å; L116-T120 VanDerWaalsContact O-CB 3.24Å; L116-T120 WeakPolarHBondContact O-CB 3.49Å; L116-T120 WeakPolarHBondContact O-CG2 2.63Å; L116-T120 PolarHBondContact O-N 2.97Å; L116-T120 PolarHBondContact O-OG1 3.11Å; L116-V156 HydrophobicContact CB-CG1 4.27Å; L116-V156 HydrophobicContact CB-CG2 3.96Å
117	K	96.4	Very high	94.9	Very high	44 Å²	44	34.1 Å²	34.1	19%	0.191	16%	0.156	C	C	.	.	H	α-helix	trans	-55.3	-46	176.9	-179.4	-174.6	70.4	160.3	0	112.9	L113 I115 T120 L152 E155 V156 N159	L113-K117 VanDerWaalsContact O-CB 3.29Å; L113-K117 WeakPolarHBondContact O-CB 3.15Å; L113-K117 PolarHBondContact O-N 3.26Å; I115-K117 PolarHBondContact O-N 3.31Å; K117-T120 PolarHBondContact O-OG1 3.35Å; K117-L152 HydrophobicContact CD-CD2 4.33Å; K117-E155 HydrophobicContact CD-CB 4.48Å; K117-E155 HydrophobicContact CD-CG 3.96Å; K117-E155 WeakPolarHBondContact CD-OE1 3.38Å; K117-E155 WeakPolarHBondContact CD-OE2 3Å; K117-E155 HydrophobicContact CG-CG 4.13Å; K117-E155 IonicContact NZ-OE1 3.07Å; K117-E155 IonicContact NZ-OE2 2.8Å; K117-V156 HydrophobicContact CB-CG2 4.05Å; K117-N159 PolarHBondContact O-ND2 2.99Å
118	E	95.5	Very high	94.9	Very high	38 Å²	38	28.4 Å²	28.4	18%	0.178	14%	0.139	C	C	.	.	H	α-helix	trans	-73	-40.7	-177.7	-65.6	-56.1	143.8	0	0	111.7	L79 Q85 I115 L116 K121	L79-E118 HydrophobicContact CB-CB 4.21Å; Q85-E118 PolarHBondContact NE2-O 3.22Å; I115-E118 PolarHBondContact O-N 3.43Å; L116-E118 VanDerWaalsContact C-N 3.34Å; L116-E118 PolarHBondContact O-N 3.08Å; E118-K121 IonicContact OE1-NZ 4Å; E118-K121 IonicContact OE2-NZ 3.08Å; E118-K121 PolarHBondContact OE2-NZ 3.02Å
119	I	96.1	Very high	94.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-79.7	-28.7	-175.6	69.1	175.4	0	0	0	113.5	L79 Q85 V88 I94 L97 I115 L116 K121 N122 I125	L79-I119 HydrophobicContact CB-CG2 4.23Å; L79-I119 HydrophobicContact CD1-CG2 4.48Å; L79-I119 HydrophobicContact CD2-CG2 4.19Å; Q85-I119 HydrophobicContact CG-CB 4.24Å; Q85-I119 HydrophobicContact CG-CG2 4.12Å; V88-I119 HydrophobicContact CB-CD1 4.45Å; V88-I119 HydrophobicContact CG1-CD1 3.78Å; I94-I119 HydrophobicContact CG1-CD1 4.43Å; L97-I119 HydrophobicContact CD1-CD1 4.09Å; I115-I119 HydrophobicContact CG2-CD1 4.46Å; I115-I119 PolarHBondContact O-N 3.05Å; I115-I119 VanDerWaalsContact O-N 3.14Å; L116-I119 HydrophobicContact CD2-CD1 4.25Å; L116-I119 PolarHBondContact O-N 3.49Å; I119-K121 PolarHBondContact O-N 3.01Å; I119-K121 VanDerWaalsContact O-N 3.14Å; I119-N122 WeakPolarHBondContact O-CB 3.49Å; I119-N122 PolarHBondContact O-N 3.1Å; I119-I125 HydrophobicContact CB-CD1 3.88Å; I119-I125 HydrophobicContact CB-CG2 4.46Å; I119-I125 HydrophobicContact CD1-CG2 4.24Å; I119-I125 HydrophobicContact CG1-CD1 4.46Å; I119-I125 HydrophobicContact CG1-CG2 4.05Å
120	T	95.7	Very high	94.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-3.8	179.6	51.1	0	0	0	0	114	L116 K117 N122 I125 R126 V129 V156 N159 V160	L116-T120 VanDerWaalsContact O-CB 3.24Å; L116-T120 WeakPolarHBondContact O-CB 3.49Å; L116-T120 WeakPolarHBondContact O-CG2 2.63Å; L116-T120 PolarHBondContact O-N 2.97Å; L116-T120 PolarHBondContact O-OG1 3.11Å; K117-T120 PolarHBondContact O-OG1 3.35Å; T120-N122 PolarHBondContact O-N 3.14Å; T120-I125 HydrophobicContact CG2-CG2 4.29Å; T120-R126 WeakPolarHBondContact O-CD 3.45Å; T120-R126 WeakPolarHBondContact O-CG 3.45Å; T120-V129 HydrophobicContact CG2-CG2 4.09Å; T120-V156 HydrophobicContact CG2-CG1 4.31Å; T120-N159 WeakPolarHBondContact OG1-CB 3.17Å; T120-N159 PolarHBondContact OG1-ND2 3.43Å; T120-N159 VanDerWaalsContact OG1-ND2 3.1Å; T120-V160 HydrophobicContact CG2-CG2 3.75Å
121	K	92.6	Very high	94.6	Very high	106 Å²	106	29.5 Å²	29.5	46%	0.461	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.5	166.2	-64.8	174	-177.4	166.9	0	111.7	E118 I119	E118-K121 IonicContact OE1-NZ 4Å; E118-K121 IonicContact OE2-NZ 3.08Å; E118-K121 PolarHBondContact OE2-NZ 3.02Å; I119-K121 PolarHBondContact O-N 3.01Å; I119-K121 VanDerWaalsContact O-N 3.14Å
122	N	93.1	Very high	94.5	Very high	12 Å²	12	33 Å²	33	6%	0.064	16%	0.16	C	C	.	.	S	Bend	trans	-77.4	126.2	177.3	-170.3	-67.3	0	0	0	111.7	Q85 I119 T120 Q124 I125 R126	Q85-N122 PolarHBondContact OE1-ND2 3.19Å; I119-N122 WeakPolarHBondContact O-CB 3.49Å; I119-N122 PolarHBondContact O-N 3.1Å; T120-N122 PolarHBondContact O-N 3.14Å; N122-Q124 VanDerWaalsContact C-N 3.34Å; N122-Q124 PolarHBondContact O-N 3.4Å; N122-Q124 WeakPolarHBondContact OD1-CB 3.32Å; N122-Q124 PolarHBondContact OD1-N 3.38Å; N122-I125 HydrophobicContact CB-CB 4.19Å; N122-I125 HydrophobicContact CB-CD1 4.05Å; N122-I125 HydrophobicContact CB-CG1 4.05Å; N122-I125 PolarHBondContact O-N 3.37Å; N122-I125 VanDerWaalsContact O-N 3.15Å; N122-R126 WeakPolarHBondContact O-CG 3.35Å; N122-R126 PolarHBondContact O-N 3Å; N122-R126 VanDerWaalsContact O-N 3.13Å
123	P	91.8	Very high	94.3	Very high	50 Å²	50	34.5 Å²	34.5	33%	0.325	18%	0.176	S	C	.	.	H	α-helix	trans	-56	-39.8	-179.8	-26.3	34.3	0	0	0	115.5	I34 I125 R126 K127	I34-P123 HydrophobicContact CD1-CB 3.24Å; I34-P123 HydrophobicContact CD1-CG 4.03Å; P123-I125 VanDerWaalsContact C-N 3.32Å; P123-I125 PolarHBondContact O-N 2.7Å; P123-R126 WeakPolarHBondContact O-CB 3.17Å; P123-R126 PolarHBondContact O-N 3.44Å; P123-K127 PolarHBondContact O-N 3.09Å
124	Q	90.9	Very high	94.1	Very high	25 Å²	25	34.5 Å²	34.5	12%	0.117	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-37	-179.7	-62.8	-176.4	-21.8	0	0	111.3	L86 N122 K127 S128	L86-Q124 VanDerWaalsContact CD2-OE1 3.22Å; N122-Q124 VanDerWaalsContact C-N 3.34Å; N122-Q124 PolarHBondContact O-N 3.4Å; N122-Q124 WeakPolarHBondContact OD1-CB 3.32Å; N122-Q124 PolarHBondContact OD1-N 3.38Å; Q124-K127 WeakPolarHBondContact O-CB 3.38Å; Q124-K127 PolarHBondContact O-N 2.91Å; Q124-S128 PolarHBondContact O-N 3.37Å; Q124-S128 PolarHBondContact O-OG 3.45Å
125	I	93.7	Very high	94	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-70.5	-36.7	177.8	-63.8	-176.1	0	0	0	111.4	Q85 R89 I94 I119 T120 N122 P123 K127 S128 V129	Q85-I125 HydrophobicContact CB-CD1 3.64Å; Q85-I125 VanDerWaalsContact O-CD1 3.27Å; Q85-I125 WeakPolarHBondContact O-CD1 3.49Å; R89-I125 HydrophobicContact CB-CG1 4.42Å; I94-I125 HydrophobicContact CD1-CB 4.47Å; I94-I125 HydrophobicContact CD1-CG1 4.41Å; I94-I125 HydrophobicContact CD1-CG2 3.83Å; I94-I125 HydrophobicContact CG1-CG2 4.45Å; I119-I125 HydrophobicContact CB-CD1 3.88Å; I119-I125 HydrophobicContact CB-CG2 4.46Å; I119-I125 HydrophobicContact CD1-CG2 4.24Å; I119-I125 HydrophobicContact CG1-CD1 4.46Å; I119-I125 HydrophobicContact CG1-CG2 4.05Å; T120-I125 HydrophobicContact CG2-CG2 4.29Å; N122-I125 HydrophobicContact CB-CB 4.19Å; N122-I125 HydrophobicContact CB-CD1 4.05Å; N122-I125 HydrophobicContact CB-CG1 4.05Å; N122-I125 PolarHBondContact O-N 3.37Å; N122-I125 VanDerWaalsContact O-N 3.15Å; P123-I125 VanDerWaalsContact C-N 3.32Å; P123-I125 PolarHBondContact O-N 2.7Å; I125-K127 VanDerWaalsContact C-N 3.26Å; I125-K127 PolarHBondContact O-N 3.28Å; I125-S128 PolarHBondContact O-N 3.3Å; I125-V129 HydrophobicContact CG2-CG2 4.25Å; I125-V129 WeakPolarHBondContact O-CG2 2.95Å; I125-V129 PolarHBondContact O-N 3.29Å
126	R	94.2	Very high	93.9	Very high	39 Å²	39	33.1 Å²	33.1	15%	0.147	17%	0.171	C	C	.	.	H	α-helix	trans	-56.8	-43.1	173.8	-63.1	-173.7	-66.7	-160	4.8	111.5	T120 N122 P123 T130 N159 N162	T120-R126 WeakPolarHBondContact O-CD 3.45Å; T120-R126 WeakPolarHBondContact O-CG 3.45Å; N122-R126 WeakPolarHBondContact O-CG 3.35Å; N122-R126 PolarHBondContact O-N 3Å; N122-R126 VanDerWaalsContact O-N 3.13Å; P123-R126 WeakPolarHBondContact O-CB 3.17Å; P123-R126 PolarHBondContact O-N 3.44Å; R126-T130 PolarHBondContact O-N 2.83Å; R126-T130 VanDerWaalsContact O-N 3.09Å; R126-T130 PolarHBondContact O-OG1 3Å; R126-N159 WeakPolarHBondContact CD-O 3.43Å; R126-N162 PolarHBondContact NH1-ND2 3.12Å
127	K	91.7	Very high	93.8	Very high	90 Å²	90	33.5 Å²	33.5	39%	0.391	17%	0.174	S	C	.	.	H	α-helix	trans	-62.6	-51.3	175.4	-173.7	169.2	-178.3	172.1	0	110.7	D32 P123 Q124 I125 V129 T130 D131	D32-K127 PolarHBondContact O-NZ 3.03Å; P123-K127 PolarHBondContact O-N 3.09Å; Q124-K127 WeakPolarHBondContact O-CB 3.38Å; Q124-K127 PolarHBondContact O-N 2.91Å; I125-K127 VanDerWaalsContact C-N 3.26Å; I125-K127 PolarHBondContact O-N 3.28Å; K127-V129 PolarHBondContact O-N 3.43Å; K127-T130 CarbonylContact O-C 3.58Å; K127-T130 WeakPolarHBondContact O-CA 3.38Å; K127-T130 WeakPolarHBondContact O-CB 3.31Å; K127-T130 PolarHBondContact O-N 2.85Å; K127-D131 WeakPolarHBondContact CG-OD2 3.34Å; K127-D131 VanDerWaalsContact O-CG 3.3Å; K127-D131 PolarHBondContact O-N 2.9Å
128	S	93.2	Very high	93.8	Very high	28 Å²	28	31.4 Å²	31.4	20%	0.196	17%	0.165	C	C	.	.	H	α-helix	trans	-56.9	-43	176.8	-55.7	0	0	0	0	113.7	Q124 I125 T130 D131 I132	Q124-S128 PolarHBondContact O-N 3.37Å; Q124-S128 PolarHBondContact O-OG 3.45Å; I125-S128 PolarHBondContact O-N 3.3Å; S128-T130 VanDerWaalsContact C-N 3.29Å; S128-T130 PolarHBondContact O-N 3.41Å; S128-D131 PolarHBondContact O-N 3.48Å; S128-I132 WeakPolarHBondContact O-CG1 2.9Å; S128-I132 PolarHBondContact O-N 3.36Å; S128-I132 VanDerWaalsContact O-N 3.08Å
129	V	95	Very high	93.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-38.7	175.7	171.2	0	0	0	0	111.2	I94 I98 T120 I125 K127 G134 V160	I94-V129 HydrophobicContact CG2-CG2 3.71Å; I98-V129 HydrophobicContact CD1-CG1 4.35Å; T120-V129 HydrophobicContact CG2-CG2 4.09Å; I125-V129 HydrophobicContact CG2-CG2 4.25Å; I125-V129 WeakPolarHBondContact O-CG2 2.95Å; I125-V129 PolarHBondContact O-N 3.29Å; K127-V129 PolarHBondContact O-N 3.43Å; V129-G134 WeakPolarHBondContact O-CA 3Å; V129-G134 PolarHBondContact O-N 2.78Å; V129-V160 HydrophobicContact CB-CG2 4.42Å; V129-V160 HydrophobicContact CG1-CG1 4.33Å; V129-V160 HydrophobicContact CG1-CG2 4.08Å
130	T	93	Very high	93.8	Very high	8 Å²	8	32.6 Å²	32.6	5%	0.049	17%	0.172	C	C	.	.	H	α-helix	trans	-70.2	-40.9	178.1	-55.6	0	0	0	0	111.6	R126 K127 S128 G133 V160 R165 A166	R126-T130 PolarHBondContact O-N 2.83Å; R126-T130 VanDerWaalsContact O-N 3.09Å; R126-T130 PolarHBondContact O-OG1 3Å; K127-T130 CarbonylContact O-C 3.58Å; K127-T130 WeakPolarHBondContact O-CA 3.38Å; K127-T130 WeakPolarHBondContact O-CB 3.31Å; K127-T130 PolarHBondContact O-N 2.85Å; S128-T130 VanDerWaalsContact C-N 3.29Å; S128-T130 PolarHBondContact O-N 3.41Å; T130-G133 PolarHBondContact O-N 3.19Å; T130-V160 WeakPolarHBondContact OG1-CG1 3.45Å; T130-R165 HydrophobicContact CG2-CB 4.03Å; T130-R165 HydrophobicContact CG2-CG 3.78Å; T130-A166 HydrophobicContact CG2-CB 4.36Å
131	D	91.9	Very high	93.7	Very high	78 Å²	78	33.2 Å²	33.2	42%	0.417	18%	0.175	S	C	.	.	H	α-helix	trans	-69.9	-37.3	-176.8	-69.1	-27	0	0	0	112.9	K127 S128 G133 R165	K127-D131 WeakPolarHBondContact CG-OD2 3.34Å; K127-D131 VanDerWaalsContact O-CG 3.3Å; K127-D131 PolarHBondContact O-N 2.9Å; S128-D131 PolarHBondContact O-N 3.48Å; D131-G133 PolarHBondContact O-N 3.31Å; D131-R165 IonicContact OD1-CZ 2.82Å; D131-R165 IonicContact OD1-NH1 2.8Å; D131-R165 PolarHBondContact OD1-NH1 2.99Å
132	I	92.9	Very high	93.8	Very high	87 Å²	87	28.3 Å²	28.3	45%	0.446	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-8.3	175.3	-63.3	166.7	0	0	0	111.6	I94 S128	I94-I132 HydrophobicContact CG2-CD1 4.23Å; S128-I132 WeakPolarHBondContact O-CG1 2.9Å; S128-I132 PolarHBondContact O-N 3.36Å; S128-I132 VanDerWaalsContact O-N 3.08Å
133	G	93.3	Very high	93.8	Very high	33 Å²	33	34.1 Å²	34.1	34%	0.34	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	19.2	-178.6	0	0	0	0	0	114.1	T130 D131 L135 Q136 P137	T130-G133 PolarHBondContact O-N 3.19Å; D131-G133 PolarHBondContact O-N 3.31Å; G133-L135 PolarHBondContact O-N 2.86Å; G133-Q136 PolarHBondContact O-N 3.16Å; G133-Q136 VanDerWaalsContact O-N 3.16Å; G133-P137 WeakPolarHBondContact O-CD 3.36Å
134	G	93.4	Very high	93.8	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.5	-176.1	0	0	0	0	0	115.3	V129 Q136 P137 L138	V129-G134 WeakPolarHBondContact O-CA 3Å; V129-G134 PolarHBondContact O-N 2.78Å; G134-Q136 VanDerWaalsContact C-N 3.35Å; G134-P137 WeakPolarHBondContact O-CD 3.44Å; G134-L138 WeakPolarHBondContact O-CD1 3.27Å; G134-L138 VanDerWaalsContact O-CG 3.27Å; G134-L138 WeakPolarHBondContact O-CG 3.5Å; G134-L138 PolarHBondContact O-N 2.98Å
135	L	94.8	Very high	93.8	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-70.4	-26.9	174.9	-73.4	-179.8	0	0	0	114	G133 L138 V139 V160 A166 T169 V170	G133-L135 PolarHBondContact O-N 2.86Å; L135-L138 HydrophobicContact CD2-CD1 4.01Å; L135-L138 PolarHBondContact O-N 3.02Å; L135-V139 WeakPolarHBondContact O-CB 3.45Å; L135-V139 VanDerWaalsContact O-CG2 3.29Å; L135-V139 WeakPolarHBondContact O-CG2 3.48Å; L135-V139 PolarHBondContact O-N 2.92Å; L135-V160 HydrophobicContact CD1-CG1 4.35Å; L135-V160 HydrophobicContact CD2-CB 4.25Å; L135-V160 HydrophobicContact CD2-CG1 3.83Å; L135-V160 HydrophobicContact CG-CG1 4.25Å; L135-A166 VanDerWaalsContact CD1-CA 3.45Å; L135-A166 HydrophobicContact CD1-CB 3.67Å; L135-A166 WeakPolarHBondContact CD1-O 3.48Å; L135-T169 HydrophobicContact CB-CG2 3.76Å; L135-T169 HydrophobicContact CD1-CG2 3.91Å; L135-T169 HydrophobicContact CG-CG2 4.49Å; L135-V170 HydrophobicContact CD1-CG2 4.14Å; L135-V170 HydrophobicContact CD2-CG2 4.24Å
136	Q	95.3	Very high	93.7	Very high	56 Å²	56	42.1 Å²	42.1	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-67.5	-50.7	178.5	172.6	59.4	-0	0	0	111.9	G133 G134 L138 V139 N140 Y173	G133-Q136 PolarHBondContact O-N 3.16Å; G133-Q136 VanDerWaalsContact O-N 3.16Å; G134-Q136 VanDerWaalsContact C-N 3.35Å; Q136-L138 VanDerWaalsContact C-N 3.29Å; Q136-L138 PolarHBondContact O-N 3.45Å; Q136-V139 PolarHBondContact O-N 3.4Å; Q136-N140 PolarHBondContact NE2-ND2 2.98Å; Q136-N140 PolarHBondContact O-N 3.33Å; Q136-N140 PolarHBondContact O-ND2 3.42Å; Q136-Y173 HydrophobicContact CB-CD2 4.04Å; Q136-Y173 HydrophobicContact CB-CE1 4.33Å; Q136-Y173 HydrophobicContact CB-CE2 3.65Å; Q136-Y173 HydrophobicContact CG-CD1 4.49Å; Q136-Y173 HydrophobicContact CG-CE1 4.19Å; Q136-Y173 HydrophobicContact CG-CE2 4.38Å; Q136-Y173 VanDerWaalsContact OE1-CD2 3.27Å; Q136-Y173 VanDerWaalsContact OE1-CE1 3.31Å
137	P	95.6	Very high	93.6	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.058	23%	0.233	C	C	.	.	H	α-helix	trans	-55.1	-42.7	171.5	-28.3	35.2	0	0	0	113.2	I98 L101 E102 G133 G134 N140 L141	I98-P137 HydrophobicContact CG2-CG 4Å; L101-P137 HydrophobicContact CB-CB 4.3Å; E102-P137 HydrophobicContact CG-CB 3.9Å; E102-P137 HydrophobicContact CG-CG 3.91Å; G133-P137 WeakPolarHBondContact O-CD 3.36Å; G134-P137 WeakPolarHBondContact O-CD 3.44Å; P137-N140 PolarHBondContact O-N 2.99Å; P137-L141 WeakPolarHBondContact O-CG 3.4Å; P137-L141 PolarHBondContact O-N 3.4Å
138	L	96.5	Very high	93.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-49.6	177.5	-70.7	167.2	0	0	0	111.5	L101 L113 G134 L135 Q136 N140 L141 L142 C153 V156 I157	L101-L138 HydrophobicContact CD1-CD2 3.67Å; L101-L138 HydrophobicContact CD1-CG 4.1Å; L113-L138 HydrophobicContact CD2-CD2 3.59Å; G134-L138 WeakPolarHBondContact O-CD1 3.27Å; G134-L138 VanDerWaalsContact O-CG 3.27Å; G134-L138 WeakPolarHBondContact O-CG 3.5Å; G134-L138 PolarHBondContact O-N 2.98Å; L135-L138 HydrophobicContact CD2-CD1 4.01Å; L135-L138 PolarHBondContact O-N 3.02Å; Q136-L138 VanDerWaalsContact C-N 3.29Å; Q136-L138 PolarHBondContact O-N 3.45Å; L138-N140 VanDerWaalsContact C-N 3.26Å; L138-N140 PolarHBondContact O-N 2.79Å; L138-L141 PolarHBondContact O-N 3.23Å; L138-L141 VanDerWaalsContact O-N 3.09Å; L138-L142 PolarHBondContact O-N 2.67Å; L138-C153 VanDerWaalsContact C-SG 3.59Å; L138-C153 PolarHBondContact O-SG 3.46Å; L138-V156 HydrophobicContact CD1-CG1 3.72Å; L138-V156 HydrophobicContact CD2-CB 4.24Å; L138-V156 HydrophobicContact CD2-CG1 3.9Å; L138-I157 HydrophobicContact CB-CD1 4.09Å; L138-I157 HydrophobicContact CB-CG1 3.97Å; L138-I157 HydrophobicContact CD1-CG1 4.4Å
139	V	95.8	Very high	93.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-35.8	178.1	170	0	0	0	0	111.9	L135 Q136 L142 Y173 Y178	L135-V139 WeakPolarHBondContact O-CB 3.45Å; L135-V139 VanDerWaalsContact O-CG2 3.29Å; L135-V139 WeakPolarHBondContact O-CG2 3.48Å; L135-V139 PolarHBondContact O-N 2.92Å; Q136-V139 PolarHBondContact O-N 3.4Å; V139-L142 WeakPolarHBondContact O-CB 3.46Å; V139-L142 PolarHBondContact O-N 3.47Å; V139-Y173 WeakPolarHBondContact CG1-O 3.28Å; V139-Y178 HydrophobicContact CG1-CD2 4.31Å
140	N	94.8	Very high	93.7	Very high	62 Å²	62	46.7 Å²	46.7	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-66.4	-38.6	175.2	-69.8	-25.8	0	0	0	112.2	Q136 P137 L138 L142 R143	Q136-N140 PolarHBondContact NE2-ND2 2.98Å; Q136-N140 PolarHBondContact O-N 3.33Å; Q136-N140 PolarHBondContact O-ND2 3.42Å; P137-N140 PolarHBondContact O-N 2.99Å; L138-N140 VanDerWaalsContact C-N 3.26Å; L138-N140 PolarHBondContact O-N 2.79Å; N140-L142 VanDerWaalsContact C-N 3.26Å; N140-L142 PolarHBondContact O-N 2.94Å; N140-R143 WeakPolarHBondContact O-CB 3.4Å; N140-R143 PolarHBondContact O-N 3.45Å; N140-R143 VanDerWaalsContact O-N 3.08Å
141	L	95.2	Very high	93.7	Very high	13 Å²	13	47 Å²	47	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-25.3	177.8	-75.9	-178.7	0	0	0	113.9	L101 K109 L113 P137 L138 R143 S144	L101-L141 HydrophobicContact CB-CD1 3.81Å; L101-L141 HydrophobicContact CD1-CD1 4.27Å; L101-L141 HydrophobicContact CD2-CD1 3.96Å; L101-L141 HydrophobicContact CG-CD1 4.23Å; K109-L141 HydrophobicContact CD-CD2 3.82Å; L113-L141 HydrophobicContact CD1-CD1 4.29Å; L113-L141 HydrophobicContact CD2-CD1 4.49Å; P137-L141 WeakPolarHBondContact O-CG 3.4Å; P137-L141 PolarHBondContact O-N 3.4Å; L138-L141 PolarHBondContact O-N 3.23Å; L138-L141 VanDerWaalsContact O-N 3.09Å; L141-R143 PolarHBondContact O-N 3.43Å; L141-R143 VanDerWaalsContact O-N 3.1Å; L141-S144 VanDerWaalsContact O-CB 3.26Å; L141-S144 WeakPolarHBondContact O-CB 3.42Å; L141-S144 PolarHBondContact O-N 3.25Å; L141-S144 PolarHBondContact O-OG 3.11Å
142	L	94.8	Very high	94	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.021	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.9	172.4	-64.5	177.4	0	0	0	113	L138 V139 N140 S144 K150 C153 A154 I157 L179 L182	L138-L142 PolarHBondContact O-N 2.67Å; V139-L142 WeakPolarHBondContact O-CB 3.46Å; V139-L142 PolarHBondContact O-N 3.47Å; N140-L142 VanDerWaalsContact C-N 3.26Å; N140-L142 PolarHBondContact O-N 2.94Å; L142-S144 VanDerWaalsContact C-N 3.34Å; L142-K150 WeakPolarHBondContact O-CE 3.46Å; L142-C153 HydrophobicContact CD2-CB 4.1Å; L142-A154 HydrophobicContact CD2-CB 4.32Å; L142-I157 HydrophobicContact CD1-CD1 3.68Å; L142-I157 HydrophobicContact CD2-CD1 4.22Å; L142-I157 HydrophobicContact CG-CD1 4.02Å; L142-L179 HydrophobicContact CD1-CD2 3.67Å; L142-L179 HydrophobicContact CD1-CG 3.92Å; L142-L179 HydrophobicContact CD2-CD2 4.14Å; L142-L182 HydrophobicContact CD2-CD1 4.04Å
143	R	93	Very high	94.2	Very high	133 Å²	133	40 Å²	40	50%	0.502	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-9.9	176.6	-54.7	179.5	-172.7	-176.4	1.2	113.4	N140 L141 Y178	N140-R143 WeakPolarHBondContact O-CB 3.4Å; N140-R143 PolarHBondContact O-N 3.45Å; N140-R143 VanDerWaalsContact O-N 3.08Å; L141-R143 PolarHBondContact O-N 3.43Å; L141-R143 VanDerWaalsContact O-N 3.1Å; R143-Y178 HydrophobicContact CG-CD1 4.14Å; R143-Y178 HydrophobicContact CG-CD2 4.44Å; R143-Y178 HydrophobicContact CG-CE1 3.87Å; R143-Y178 HydrophobicContact CG-CE2 4.19Å; R143-Y178 HydrophobicContact CG-CG 4.44Å; R143-Y178 VanDerWaalsContact NE-CE2 3.31Å; R143-Y178 PolarHBondContact NE-OH 3.27Å; R143-Y178 PolarHBondContact NH2-OH 3.1Å; R143-Y178 VanDerWaalsContact NH2-OH 3.14Å
144	S	91.2	Very high	94.4	Very high	26 Å²	26	38.4 Å²	38.4	18%	0.182	18%	0.184	C	C	.	.			trans	-63.8	153.6	-176.2	67.5	0	0	0	0	112.7	L141 L142 N146 K150	L141-S144 VanDerWaalsContact O-CB 3.26Å; L141-S144 WeakPolarHBondContact O-CB 3.42Å; L141-S144 PolarHBondContact O-N 3.25Å; L141-S144 PolarHBondContact O-OG 3.11Å; L142-S144 VanDerWaalsContact C-N 3.34Å; S144-N146 VanDerWaalsContact C-N 3.27Å; S144-K150 WeakPolarHBondContact O-CD 3.33Å; S144-K150 WeakPolarHBondContact O-CE 3.5Å; S144-K150 PolarHBondContact O-NZ 3.46Å
145	L	90.3	Very high	94.5	Very high	169 Å²	169	40 Å²	40	89%	0.885	19%	0.192	S	C	*	.	S	Bend	trans	-78.4	-15.1	174.2	-63.3	177.2	0	0	0	112.6	R147	L145-R147 PolarHBondContact O-N 3.27Å
146	N	92.1	Very high	94.6	Very high	49 Å²	49	40 Å²	40	26%	0.262	19%	0.192	S	C	.	.			trans	-79.5	119.1	-178.5	-175	-56.1	0	0	0	110.6	S144 D148 L149 K150	S144-N146 VanDerWaalsContact C-N 3.27Å; N146-D148 WeakPolarHBondContact OD1-CB 3.28Å; N146-D148 PolarHBondContact OD1-N 2.84Å; N146-L149 HydrophobicContact CB-CB 4.1Å; N146-L149 HydrophobicContact CB-CD1 3.87Å; N146-L149 HydrophobicContact CB-CG 3.95Å; N146-L149 PolarHBondContact O-N 3.26Å; N146-L149 PolarHBondContact OD1-N 3.3Å; N146-K150 PolarHBondContact O-N 2.98Å
147	R	91	Very high	94.7	Very high	125 Å²	125	37.3 Å²	37.3	47%	0.472	18%	0.179	S	C	.	.	H	α-helix	trans	-64.8	-41.1	-177.3	-62.1	-175.6	-172.1	175.3	4.5	112.4	L145 L149 K150 C151 D200 V203	L145-R147 PolarHBondContact O-N 3.27Å; R147-L149 PolarHBondContact O-N 2.92Å; R147-K150 WeakPolarHBondContact O-CB 3.35Å; R147-K150 PolarHBondContact O-N 3.2Å; R147-C151 WeakPolarHBondContact O-CB 3.48Å; R147-C151 PolarHBondContact O-N 2.79Å; R147-D200 WeakPolarHBondContact CD-OD1 3Å; R147-D200 IonicContact CZ-OD1 3.86Å; R147-D200 VanDerWaalsContact CZ-OD1 3.28Å; R147-D200 IonicContact NE-OD1 3.8Å; R147-D200 IonicContact NH1-OD1 2.73Å; R147-D200 PolarHBondContact NH1-OD1 3.13Å; R147-D200 IonicContact NH1-OD2 3.05Å; R147-D200 PolarHBondContact NH1-OD2 3.11Å; R147-V203 HydrophobicContact CB-CG2 4.11Å
148	D	92.6	Very high	94.8	Very high	73 Å²	73	37 Å²	37	39%	0.39	18%	0.177	S	C	.	.	H	α-helix	trans	-66.2	-38.5	-179.6	-57.5	-41.7	0	0	0	111.7	L110 N146 C151 L152	L110-D148 HydrophobicContact CD2-CB 3.7Å; N146-D148 WeakPolarHBondContact OD1-CB 3.28Å; N146-D148 PolarHBondContact OD1-N 2.84Å; D148-C151 PolarHBondContact O-N 2.89Å; D148-L152 WeakPolarHBondContact O-CG 3.42Å; D148-L152 PolarHBondContact O-N 3.03Å
149	L	95	Very high	94.8	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-46.6	173.4	-72.2	-177.4	0	0	0	111.2	V106 K109 L110 L113 N146 R147 C153	V106-L149 HydrophobicContact CG1-CD1 4.31Å; K109-L149 HydrophobicContact CB-CD1 4.5Å; K109-L149 HydrophobicContact CB-CD2 3.54Å; K109-L149 HydrophobicContact CD-CD1 4.05Å; K109-L149 HydrophobicContact CD-CD2 4.5Å; L110-L149 HydrophobicContact CD2-CD2 3.62Å; L110-L149 HydrophobicContact CD2-CG 4.09Å; L110-L149 HydrophobicContact CG-CD2 3.71Å; L110-L149 HydrophobicContact CG-CG 4.37Å; L113-L149 HydrophobicContact CD1-CD2 3.84Å; N146-L149 HydrophobicContact CB-CB 4.1Å; N146-L149 HydrophobicContact CB-CD1 3.87Å; N146-L149 HydrophobicContact CB-CG 3.95Å; N146-L149 PolarHBondContact O-N 3.26Å; N146-L149 PolarHBondContact OD1-N 3.3Å; R147-L149 PolarHBondContact O-N 2.92Å; L149-C153 WeakPolarHBondContact O-CB 3.44Å; L149-C153 PolarHBondContact O-N 3Å
150	K	94.4	Very high	94.8	Very high	50 Å²	50	38.3 Å²	38.3	22%	0.217	18%	0.184	C	C	.	.	H	α-helix	trans	-59.2	-48	177.1	-79.5	171.4	154.2	161	0	112.1	L142 S144 N146 R147 C153 A154 L182 V203	L142-K150 WeakPolarHBondContact O-CE 3.46Å; S144-K150 WeakPolarHBondContact O-CD 3.33Å; S144-K150 WeakPolarHBondContact O-CE 3.5Å; S144-K150 PolarHBondContact O-NZ 3.46Å; N146-K150 PolarHBondContact O-N 2.98Å; R147-K150 WeakPolarHBondContact O-CB 3.35Å; R147-K150 PolarHBondContact O-N 3.2Å; K150-C153 PolarHBondContact O-N 3.47Å; K150-A154 WeakPolarHBondContact O-CB 3.48Å; K150-A154 PolarHBondContact O-N 3.36Å; K150-L182 HydrophobicContact CB-CD2 4.13Å; K150-L182 HydrophobicContact CD-CD2 3.79Å; K150-L182 HydrophobicContact CG-CD2 4.15Å; K150-V203 HydrophobicContact CB-CG1 4.49Å
151	C	94.8	Very high	94.8	Very high	16 Å²	16	35.3 Å²	35.3	11%	0.108	17%	0.168	C	C	.	.	H	α-helix	trans	-57.4	-57.6	179.8	176.1	0	0	0	0	111.5	R147 D148 C153 A154 E155 V203 C206	R147-C151 WeakPolarHBondContact O-CB 3.48Å; R147-C151 PolarHBondContact O-N 2.79Å; D148-C151 PolarHBondContact O-N 2.89Å; C151-C153 VanDerWaalsContact C-N 3.31Å; C151-C153 PolarHBondContact O-N 2.81Å; C151-A154 PolarHBondContact O-N 3.06Å; C151-E155 PolarHBondContact O-N 3.43Å; C151-E155 VanDerWaalsContact O-N 3.11Å; C151-V203 HydrophobicContact CB-CG2 3.93Å; C151-C206 WeakPolarHBondContact O-CB 3.48Å; C151-C206 PolarHBondContact SG-SG 3.15Å
152	L	96.7	Very high	94.6	Very high	17 Å²	17	36 Å²	36	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-36.8	-178.8	-69.2	168	0	0	0	112.1	L110 L113 K114 K117 D148 E155 V156	L110-L152 HydrophobicContact CD2-CD1 3.89Å; L113-L152 HydrophobicContact CB-CB 3.82Å; L113-L152 HydrophobicContact CB-CD1 4.3Å; L113-L152 HydrophobicContact CD1-CB 4.04Å; K114-L152 HydrophobicContact CG-CD1 3.8Å; K114-L152 HydrophobicContact CG-CD2 4.18Å; K117-L152 HydrophobicContact CD-CD2 4.33Å; D148-L152 WeakPolarHBondContact O-CG 3.42Å; D148-L152 PolarHBondContact O-N 3.03Å; L152-E155 PolarHBondContact O-N 3.46Å; L152-V156 WeakPolarHBondContact O-CG2 2.88Å; L152-V156 PolarHBondContact O-N 3.29Å
153	C	96.7	Very high	94.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.4	-43.9	176.9	-176.5	0	0	0	0	112.1	L113 L138 L142 L149 K150 C151 E155 V156 I157	L113-C153 HydrophobicContact CD1-CB 4.24Å; L113-C153 HydrophobicContact CD2-CB 4.42Å; L138-C153 VanDerWaalsContact C-SG 3.59Å; L138-C153 PolarHBondContact O-SG 3.46Å; L142-C153 HydrophobicContact CD2-CB 4.1Å; L149-C153 WeakPolarHBondContact O-CB 3.44Å; L149-C153 PolarHBondContact O-N 3Å; K150-C153 PolarHBondContact O-N 3.47Å; C151-C153 VanDerWaalsContact C-N 3.31Å; C151-C153 PolarHBondContact O-N 2.81Å; C153-E155 VanDerWaalsContact C-N 3.29Å; C153-E155 PolarHBondContact O-N 2.93Å; C153-V156 PolarHBondContact O-N 3.09Å; C153-I157 VanDerWaalsContact O-CG1 3.3Å; C153-I157 WeakPolarHBondContact O-CG1 3.31Å; C153-I157 PolarHBondContact O-N 3.32Å
154	A	97.5	Very high	94.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.7	-38.8	176.7	0	0	0	0	0	111.2	L142 K150 C151 I157 A158 L179 L182 C206 A210	L142-A154 HydrophobicContact CD2-CB 4.32Å; K150-A154 WeakPolarHBondContact O-CB 3.48Å; K150-A154 PolarHBondContact O-N 3.36Å; C151-A154 PolarHBondContact O-N 3.06Å; A154-I157 PolarHBondContact O-N 3.5Å; A154-A158 WeakPolarHBondContact O-CB 3.3Å; A154-A158 PolarHBondContact O-N 3.32Å; A154-L179 HydrophobicContact CB-CD2 4.16Å; A154-L182 HydrophobicContact CB-CD1 3.94Å; A154-C206 HydrophobicContact CB-CB 3.95Å; A154-A210 HydrophobicContact CB-CB 4.36Å; A154-A210 WeakPolarHBondContact O-CB 3.42Å
155	E	96.6	Very high	94.2	Very high	33 Å²	33	38.4 Å²	38.4	15%	0.154	18%	0.181	C	C	.	.	H	α-helix	trans	-65.7	-41.8	176.7	-159.6	172.9	-176.6	0	0	112.6	K117 C151 L152 C153 A158 N159 L209	K117-E155 HydrophobicContact CD-CB 4.48Å; K117-E155 HydrophobicContact CD-CG 3.96Å; K117-E155 WeakPolarHBondContact CD-OE1 3.38Å; K117-E155 WeakPolarHBondContact CD-OE2 3Å; K117-E155 HydrophobicContact CG-CG 4.13Å; K117-E155 IonicContact NZ-OE1 3.07Å; K117-E155 IonicContact NZ-OE2 2.8Å; C151-E155 PolarHBondContact O-N 3.43Å; C151-E155 VanDerWaalsContact O-N 3.11Å; L152-E155 PolarHBondContact O-N 3.46Å; C153-E155 VanDerWaalsContact C-N 3.29Å; C153-E155 PolarHBondContact O-N 2.93Å; E155-A158 WeakPolarHBondContact O-CB 3.08Å; E155-A158 PolarHBondContact O-N 2.97Å; E155-N159 PolarHBondContact O-N 3.29Å; E155-N159 VanDerWaalsContact O-N 3.1Å; E155-L209 HydrophobicContact CG-CD2 4.46Å
156	V	97.4	Very high	94.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.3	-44.3	172.4	174.2	0	0	0	0	111	L113 L116 K117 T120 L138 L152 C153 A158 N159 V160	L113-V156 HydrophobicContact CD2-CG2 4.26Å; L116-V156 HydrophobicContact CB-CG1 4.27Å; L116-V156 HydrophobicContact CB-CG2 3.96Å; K117-V156 HydrophobicContact CB-CG2 4.05Å; T120-V156 HydrophobicContact CG2-CG1 4.31Å; L138-V156 HydrophobicContact CD1-CG1 3.72Å; L138-V156 HydrophobicContact CD2-CB 4.24Å; L138-V156 HydrophobicContact CD2-CG1 3.9Å; L152-V156 WeakPolarHBondContact O-CG2 2.88Å; L152-V156 PolarHBondContact O-N 3.29Å; C153-V156 PolarHBondContact O-N 3.09Å; V156-A158 VanDerWaalsContact C-N 3.3Å; V156-A158 PolarHBondContact O-N 3.41Å; V156-N159 PolarHBondContact O-N 3.1Å; V156-V160 HydrophobicContact CG1-CG2 4.37Å; V156-V160 VanDerWaalsContact O-CG2 3.31Å; V156-V160 WeakPolarHBondContact O-CG2 3.41Å; V156-V160 PolarHBondContact O-N 3.23Å
157	I	97.5	Very high	94.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.1	-40.7	176.2	-70.4	168.7	0	0	0	110.6	L138 L142 C153 A154 N159 V160 A161 V170 L179 A210	L138-I157 HydrophobicContact CB-CD1 4.09Å; L138-I157 HydrophobicContact CB-CG1 3.97Å; L138-I157 HydrophobicContact CD1-CG1 4.4Å; L142-I157 HydrophobicContact CD1-CD1 3.68Å; L142-I157 HydrophobicContact CD2-CD1 4.22Å; L142-I157 HydrophobicContact CG-CD1 4.02Å; C153-I157 VanDerWaalsContact O-CG1 3.3Å; C153-I157 WeakPolarHBondContact O-CG1 3.31Å; C153-I157 PolarHBondContact O-N 3.32Å; A154-I157 PolarHBondContact O-N 3.5Å; I157-N159 PolarHBondContact O-N 3Å; I157-V160 PolarHBondContact O-N 3.11Å; I157-A161 WeakPolarHBondContact O-CB 3.43Å; I157-A161 PolarHBondContact O-N 2.91Å; I157-V170 HydrophobicContact CG2-CG1 4.48Å; I157-V170 HydrophobicContact CG2-CG2 3.9Å; I157-L179 HydrophobicContact CG2-CD1 4.32Å; I157-A210 HydrophobicContact CG2-CB 4.35Å
158	A	97.4	Very high	94.7	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.017	13%	0.127	C	C	.	.	H	α-helix	trans	-58.5	-48.7	177.1	0	0	0	0	0	111.7	A154 E155 V156 V160 A161 N162 L209 A210 S213	A154-A158 WeakPolarHBondContact O-CB 3.3Å; A154-A158 PolarHBondContact O-N 3.32Å; E155-A158 WeakPolarHBondContact O-CB 3.08Å; E155-A158 PolarHBondContact O-N 2.97Å; V156-A158 VanDerWaalsContact C-N 3.3Å; V156-A158 PolarHBondContact O-N 3.41Å; A158-V160 PolarHBondContact O-N 2.72Å; A158-A161 PolarHBondContact O-N 3.28Å; A158-N162 PolarHBondContact O-ND2 3.45Å; A158-L209 HydrophobicContact CB-CB 4.32Å; A158-L209 HydrophobicContact CB-CD2 4.07Å; A158-L209 HydrophobicContact CB-CG 3.79Å; A158-A210 HydrophobicContact CB-CB 4.14Å; A158-S213 VanDerWaalsContact O-CB 3.31Å; A158-S213 WeakPolarHBondContact O-CB 3.26Å; A158-S213 PolarHBondContact O-OG 3.28Å; A158-S213 VanDerWaalsContact O-OG 3.1Å
159	N	96.2	Very high	94.9	Very high	28 Å²	28	25.6 Å²	25.6	15%	0.15	12%	0.115	C	C	.	.	H	α-helix	trans	-57.4	-52.3	177	-70.7	-14.4	0	0	0	111.1	K117 T120 R126 E155 V156 I157 N162	K117-N159 PolarHBondContact O-ND2 2.99Å; T120-N159 WeakPolarHBondContact OG1-CB 3.17Å; T120-N159 PolarHBondContact OG1-ND2 3.43Å; T120-N159 VanDerWaalsContact OG1-ND2 3.1Å; R126-N159 WeakPolarHBondContact CD-O 3.43Å; E155-N159 PolarHBondContact O-N 3.29Å; E155-N159 VanDerWaalsContact O-N 3.1Å; V156-N159 PolarHBondContact O-N 3.1Å; I157-N159 PolarHBondContact O-N 3Å; N159-N162 PolarHBondContact O-ND2 3.36Å
160	V	95.6	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68.9	-34.2	-175	-179.4	0	0	0	0	112.5	T120 V129 T130 L135 V156 I157 A158 N162 C163 A166	T120-V160 HydrophobicContact CG2-CG2 3.75Å; V129-V160 HydrophobicContact CB-CG2 4.42Å; V129-V160 HydrophobicContact CG1-CG1 4.33Å; V129-V160 HydrophobicContact CG1-CG2 4.08Å; T130-V160 WeakPolarHBondContact OG1-CG1 3.45Å; L135-V160 HydrophobicContact CD1-CG1 4.35Å; L135-V160 HydrophobicContact CD2-CB 4.25Å; L135-V160 HydrophobicContact CD2-CG1 3.83Å; L135-V160 HydrophobicContact CG-CG1 4.25Å; V156-V160 HydrophobicContact CG1-CG2 4.37Å; V156-V160 VanDerWaalsContact O-CG2 3.31Å; V156-V160 WeakPolarHBondContact O-CG2 3.41Å; V156-V160 PolarHBondContact O-N 3.23Å; I157-V160 PolarHBondContact O-N 3.11Å; A158-V160 PolarHBondContact O-N 2.72Å; V160-N162 PolarHBondContact O-N 3.35Å; V160-C163 PolarHBondContact O-N 3.28Å; V160-C163 VanDerWaalsContact O-N 3.11Å; V160-A166 HydrophobicContact CG1-CB 3.85Å; V160-A166 WeakPolarHBondContact O-CB 3.29Å
161	A	95.1	Very high	95	Very high	0 Å²	0	26 Å²	26	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	3.1	-178.8	0	0	0	0	0	114.8	I157 A158 C163 R167	I157-A161 WeakPolarHBondContact O-CB 3.43Å; I157-A161 PolarHBondContact O-N 2.91Å; A158-A161 PolarHBondContact O-N 3.28Å; A161-C163 VanDerWaalsContact C-N 3.27Å; A161-R167 HydrophobicContact CB-CG 4.35Å; A161-R167 WeakPolarHBondContact O-CD 3.47Å; A161-R167 WeakPolarHBondContact O-CG 3.43Å; A161-R167 PolarHBondContact O-NH1 3.02Å
162	N	90.3	Very high	95	Very high	28 Å²	28	30.6 Å²	30.6	15%	0.15	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-27.4	164.6	-73.9	-62.7	0	0	0	112.4	E31 R126 A158 N159 V160 R167 K216	E31-N162 VanDerWaalsContact OE2-O 3.08Å; R126-N162 PolarHBondContact NH1-ND2 3.12Å; A158-N162 PolarHBondContact O-ND2 3.45Å; N159-N162 PolarHBondContact O-ND2 3.36Å; V160-N162 PolarHBondContact O-N 3.35Å; N162-R167 VanDerWaalsContact C-NH1 3.32Å; N162-R167 PolarHBondContact O-NH1 3.14Å; N162-K216 PolarHBondContact OD1-NZ 2.96Å
163	C	88.6	Confident	95	Very high	13 Å²	13	34.5 Å²	34.5	9%	0.088	15%	0.148	C	C	.	.	S	Bend	trans	-73.9	138.2	172.1	172.6	0	0	0	0	111.8	D32 V160 A161 R165 A166 R167	D32-C163 PolarHBondContact OD1-SG 3.18Å; V160-C163 PolarHBondContact O-N 3.28Å; V160-C163 VanDerWaalsContact O-N 3.11Å; A161-C163 VanDerWaalsContact C-N 3.27Å; C163-R165 PolarHBondContact O-N 3.06Å; C163-R165 PolarHBondContact SG-N 2.83Å; C163-R165 VanDerWaalsContact SG-N 3.45Å; C163-A166 HydrophobicContact CB-CB 3.88Å; C163-A166 WeakPolarHBondContact O-CB 3.27Å; C163-A166 PolarHBondContact O-N 3.3Å; C163-R167 PolarHBondContact O-N 3.14Å; C163-R167 VanDerWaalsContact O-N 3.12Å
164	H	89.1	Confident	94.9	Very high	66 Å²	66	35.8 Å²	35.8	31%	0.306	16%	0.162	S	C	.	.	H	α-helix	trans	-56.9	-48.1	176.5	161.8	94	0	0	0	111.6	A166 R167 R168	H164-A166 VanDerWaalsContact C-N 3.28Å; H164-A166 PolarHBondContact O-N 3.23Å; H164-R167 WeakPolarHBondContact O-CB 3.49Å; H164-R167 PolarHBondContact O-N 3.37Å; H164-R168 PolarHBondContact O-N 3.36Å
165	R	92.5	Very high	94.9	Very high	133 Å²	133	35.8 Å²	35.8	50%	0.502	16%	0.162	S	C	.	.	H	α-helix	trans	-60	-40.8	-179.8	-172.5	179	178.5	-179.8	3.9	110.8	T130 D131 C163 R168 T169	T130-R165 HydrophobicContact CG2-CB 4.03Å; T130-R165 HydrophobicContact CG2-CG 3.78Å; D131-R165 IonicContact OD1-CZ 2.82Å; D131-R165 IonicContact OD1-NH1 2.8Å; D131-R165 PolarHBondContact OD1-NH1 2.99Å; C163-R165 PolarHBondContact O-N 3.06Å; C163-R165 PolarHBondContact SG-N 2.83Å; C163-R165 VanDerWaalsContact SG-N 3.45Å; R165-R168 WeakPolarHBondContact O-CB 3.33Å; R165-R168 PolarHBondContact O-N 3.01Å; R165-T169 PolarHBondContact O-N 3.28Å; R165-T169 PolarHBondContact O-OG1 3.43Å
166	A	94.8	Very high	94.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60	-47.8	176.2	0	0	0	0	0	112.8	T130 L135 V160 C163 H164 R168 T169 V170	T130-A166 HydrophobicContact CG2-CB 4.36Å; L135-A166 VanDerWaalsContact CD1-CA 3.45Å; L135-A166 HydrophobicContact CD1-CB 3.67Å; L135-A166 WeakPolarHBondContact CD1-O 3.48Å; V160-A166 HydrophobicContact CG1-CB 3.85Å; V160-A166 WeakPolarHBondContact O-CB 3.29Å; C163-A166 HydrophobicContact CB-CB 3.88Å; C163-A166 WeakPolarHBondContact O-CB 3.27Å; C163-A166 PolarHBondContact O-N 3.3Å; H164-A166 VanDerWaalsContact C-N 3.28Å; H164-A166 PolarHBondContact O-N 3.23Å; A166-R168 VanDerWaalsContact C-N 3.27Å; A166-R168 PolarHBondContact O-N 3.45Å; A166-T169 PolarHBondContact O-N 3.37Å; A166-T169 VanDerWaalsContact O-N 3.11Å; A166-V170 WeakPolarHBondContact O-CG2 3.44Å; A166-V170 PolarHBondContact O-N 3.44Å
167	R	95.4	Very high	94.9	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-55.7	-41.7	176.9	-70	-170.3	-79.2	-92.8	2.7	112.5	A161 N162 C163 H164 R171 S213 N220	A161-R167 HydrophobicContact CB-CG 4.35Å; A161-R167 WeakPolarHBondContact O-CD 3.47Å; A161-R167 WeakPolarHBondContact O-CG 3.43Å; A161-R167 PolarHBondContact O-NH1 3.02Å; N162-R167 VanDerWaalsContact C-NH1 3.32Å; N162-R167 PolarHBondContact O-NH1 3.14Å; C163-R167 PolarHBondContact O-N 3.14Å; C163-R167 VanDerWaalsContact O-N 3.12Å; H164-R167 WeakPolarHBondContact O-CB 3.49Å; H164-R167 PolarHBondContact O-N 3.37Å; R167-R171 PolarHBondContact O-N 3.49Å; R167-S213 WeakPolarHBondContact CD-O 3.41Å; R167-N220 PolarHBondContact O-ND2 2.96Å; R167-N220 VanDerWaalsContact O-ND2 3.13Å
168	R	95.1	Very high	94.8	Very high	126 Å²	126	45.3 Å²	45.3	48%	0.475	20%	0.201	S	C	.	.	H	α-helix	trans	-64.4	-46.5	176.7	176.5	179.7	177.4	172.1	-0.3	111.1	H164 R165 A166 R171 Q172	H164-R168 PolarHBondContact O-N 3.36Å; R165-R168 WeakPolarHBondContact O-CB 3.33Å; R165-R168 PolarHBondContact O-N 3.01Å; A166-R168 VanDerWaalsContact C-N 3.27Å; A166-R168 PolarHBondContact O-N 3.45Å; R168-R171 WeakPolarHBondContact O-CB 3.42Å; R168-R171 PolarHBondContact O-N 3.09Å; R168-Q172 HydrophobicContact CG-CG 4.4Å; R168-Q172 WeakPolarHBondContact O-CG 3.43Å; R168-Q172 PolarHBondContact O-N 2.86Å
169	T	95	Very high	94.8	Very high	20 Å²	20	45.2 Å²	45.2	12%	0.123	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-44.1	-178.7	-57.3	0	0	0	0	112	L135 R165 A166 R171 Q172 Y173	L135-T169 HydrophobicContact CB-CG2 3.76Å; L135-T169 HydrophobicContact CD1-CG2 3.91Å; L135-T169 HydrophobicContact CG-CG2 4.49Å; R165-T169 PolarHBondContact O-N 3.28Å; R165-T169 PolarHBondContact O-OG1 3.43Å; A166-T169 PolarHBondContact O-N 3.37Å; A166-T169 VanDerWaalsContact O-N 3.11Å; T169-R171 VanDerWaalsContact C-N 3.25Å; T169-R171 PolarHBondContact O-N 3.15Å; T169-Q172 PolarHBondContact O-N 3.23Å; T169-Q172 VanDerWaalsContact O-N 3.15Å; T169-Y173 HydrophobicContact CG2-CD2 3.55Å; T169-Y173 HydrophobicContact CG2-CE2 3.32Å; T169-Y173 VanDerWaalsContact O-CD2 3.27Å; T169-Y173 WeakPolarHBondContact O-CD2 3.36Å; T169-Y173 PolarHBondContact O-N 3.28Å; T169-Y173 VanDerWaalsContact O-N 3.12Å
170	V	96.7	Very high	94.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-54.9	-42.9	174	174.1	0	0	0	0	111.1	L135 I157 A166 G175 I176 L179	L135-V170 HydrophobicContact CD1-CG2 4.14Å; L135-V170 HydrophobicContact CD2-CG2 4.24Å; I157-V170 HydrophobicContact CG2-CG1 4.48Å; I157-V170 HydrophobicContact CG2-CG2 3.9Å; A166-V170 WeakPolarHBondContact O-CG2 3.44Å; A166-V170 PolarHBondContact O-N 3.44Å; V170-G175 WeakPolarHBondContact O-CA 3.48Å; V170-G175 PolarHBondContact O-N 3.37Å; V170-I176 HydrophobicContact CG1-CD1 4.16Å; V170-L179 HydrophobicContact CG1-CD1 4.18Å
171	R	96.2	Very high	94.9	Very high	61 Å²	61	47.1 Å²	47.1	23%	0.23	22%	0.219	C	C	.	.	H	α-helix	trans	-67.5	-44.5	177	-179	-178.6	63.2	-122.1	5.5	112.7	R167 R168 T169 Y173 G174 I176 K219 N220 A223	R167-R171 PolarHBondContact O-N 3.49Å; R168-R171 WeakPolarHBondContact O-CB 3.42Å; R168-R171 PolarHBondContact O-N 3.09Å; T169-R171 VanDerWaalsContact C-N 3.25Å; T169-R171 PolarHBondContact O-N 3.15Å; R171-Y173 VanDerWaalsContact C-N 3.26Å; R171-Y173 PolarHBondContact O-N 3.46Å; R171-G174 PolarHBondContact O-N 2.65Å; R171-I176 HydrophobicContact CB-CG1 4.25Å; R171-K219 VanDerWaalsContact CZ-CB 3.42Å; R171-N220 VanDerWaalsContact CB-OD1 3.28Å; R171-N220 WeakPolarHBondContact CB-OD1 3.26Å; R171-N220 VanDerWaalsContact CD-OD1 3.3Å; R171-N220 WeakPolarHBondContact CD-OD1 3.44Å; R171-N220 PolarHBondContact NH1-OD1 3.39Å; R171-A223 HydrophobicContact CG-CB 4.4Å
172	Q	95.4	Very high	94.9	Very high	113 Å²	113	47.8 Å²	47.8	53%	0.528	22%	0.223	S	C	.	.	H	α-helix	trans	-59.6	-37.7	-178.2	-77.7	174.1	-29.9	0	0	112.2	R168 T169 G174	R168-Q172 HydrophobicContact CG-CG 4.4Å; R168-Q172 WeakPolarHBondContact O-CG 3.43Å; R168-Q172 PolarHBondContact O-N 2.86Å; T169-Q172 PolarHBondContact O-N 3.23Å; T169-Q172 VanDerWaalsContact O-N 3.15Å; Q172-G174 VanDerWaalsContact C-N 3.26Å; Q172-G174 PolarHBondContact O-N 3.24Å
173	Y	95.5	Very high	95.1	Very high	99 Å²	99	46.5 Å²	46.5	39%	0.388	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	9.6	178	-62.5	-56.9	0	0	0	114.3	Q136 V139 T169 R171 G175	Q136-Y173 HydrophobicContact CB-CD2 4.04Å; Q136-Y173 HydrophobicContact CB-CE1 4.33Å; Q136-Y173 HydrophobicContact CB-CE2 3.65Å; Q136-Y173 HydrophobicContact CG-CD1 4.49Å; Q136-Y173 HydrophobicContact CG-CE1 4.19Å; Q136-Y173 HydrophobicContact CG-CE2 4.38Å; Q136-Y173 VanDerWaalsContact OE1-CD2 3.27Å; Q136-Y173 VanDerWaalsContact OE1-CE1 3.31Å; V139-Y173 WeakPolarHBondContact CG1-O 3.28Å; T169-Y173 HydrophobicContact CG2-CD2 3.55Å; T169-Y173 HydrophobicContact CG2-CE2 3.32Å; T169-Y173 VanDerWaalsContact O-CD2 3.27Å; T169-Y173 WeakPolarHBondContact O-CD2 3.36Å; T169-Y173 PolarHBondContact O-N 3.28Å; T169-Y173 VanDerWaalsContact O-N 3.12Å; R171-Y173 VanDerWaalsContact C-N 3.26Å; R171-Y173 PolarHBondContact O-N 3.46Å; Y173-G175 VanDerWaalsContact C-N 3.26Å; Y173-G175 PolarHBondContact O-N 3.5Å
174	G	94.9	Very high	95.4	Very high	27 Å²	27	50 Å²	50	28%	0.278	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	10.9	177.2	0	0	0	0	0	114.6	R171 Q172 I176 K177 Y178	R171-G174 PolarHBondContact O-N 2.65Å; Q172-G174 VanDerWaalsContact C-N 3.26Å; Q172-G174 PolarHBondContact O-N 3.24Å; G174-I176 PolarHBondContact O-N 3.22Å; G174-I176 VanDerWaalsContact O-N 3.16Å; G174-K177 PolarHBondContact O-N 3.48Å; G174-K177 VanDerWaalsContact O-N 3.15Å; G174-Y178 WeakPolarHBondContact O-CD2 3.39Å
175	G	96.3	Very high	95.4	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-54.7	-34.5	-177.7	0	0	0	0	0	113.9	V170 Y173 K177 Y178 L179	V170-G175 WeakPolarHBondContact O-CA 3.48Å; V170-G175 PolarHBondContact O-N 3.37Å; Y173-G175 VanDerWaalsContact C-N 3.26Å; Y173-G175 PolarHBondContact O-N 3.5Å; G175-K177 VanDerWaalsContact C-N 3.31Å; G175-K177 PolarHBondContact O-N 3.41Å; G175-Y178 PolarHBondContact O-N 2.97Å; G175-Y178 VanDerWaalsContact O-N 3.12Å; G175-L179 WeakPolarHBondContact O-CG 3.24Å; G175-L179 PolarHBondContact O-N 2.9Å
176	I	97.4	Very high	95.2	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-56.5	-42.4	179	-58.9	-60.9	0	0	0	112.2	V170 R171 G174 Y178 L179 V180 C214 N220 A223 M224	V170-I176 HydrophobicContact CG1-CD1 4.16Å; R171-I176 HydrophobicContact CB-CG1 4.25Å; G174-I176 PolarHBondContact O-N 3.22Å; G174-I176 VanDerWaalsContact O-N 3.16Å; I176-Y178 VanDerWaalsContact C-N 3.34Å; I176-Y178 PolarHBondContact O-N 3.48Å; I176-L179 PolarHBondContact O-N 3.28Å; I176-V180 HydrophobicContact CG2-CG2 4.38Å; I176-V180 WeakPolarHBondContact O-CB 3.44Å; I176-V180 VanDerWaalsContact O-CG2 3.26Å; I176-V180 WeakPolarHBondContact O-CG2 3.5Å; I176-V180 PolarHBondContact O-N 3.49Å; I176-C214 HydrophobicContact CD1-CB 3.92Å; I176-N220 HydrophobicContact CD1-CB 4.42Å; I176-A223 HydrophobicContact CB-CB 4.42Å; I176-A223 HydrophobicContact CG1-CB 4.36Å; I176-A223 HydrophobicContact CG2-CB 4.07Å; I176-M224 HydrophobicContact CG2-CB 4.23Å; I176-M224 HydrophobicContact CG2-CG 3.51Å
177	K	96.8	Very high	94.9	Very high	153 Å²	153	46.8 Å²	46.8	67%	0.665	24%	0.237	S	C	*	.	H	α-helix	trans	-65.4	-39.8	179.5	-69.5	-176.1	177.7	-176.6	0	111.5	G174 G175 A181 A227	G174-K177 PolarHBondContact O-N 3.48Å; G174-K177 VanDerWaalsContact O-N 3.15Å; G175-K177 VanDerWaalsContact C-N 3.31Å; G175-K177 PolarHBondContact O-N 3.41Å; K177-A181 PolarHBondContact O-N 3.19Å; K177-A227 HydrophobicContact CG-CB 4.22Å
178	Y	96.3	Very high	94.4	Very high	76 Å²	76	46.9 Å²	46.9	30%	0.298	24%	0.238	S	C	.	.	H	α-helix	trans	-70.2	-40.9	178.4	-58.6	-57.9	0	0	0	111.8	V139 R143 G174 G175 I176 A181 L182	V139-Y178 HydrophobicContact CG1-CD2 4.31Å; R143-Y178 HydrophobicContact CG-CD1 4.14Å; R143-Y178 HydrophobicContact CG-CD2 4.44Å; R143-Y178 HydrophobicContact CG-CE1 3.87Å; R143-Y178 HydrophobicContact CG-CE2 4.19Å; R143-Y178 HydrophobicContact CG-CG 4.44Å; R143-Y178 VanDerWaalsContact NE-CE2 3.31Å; R143-Y178 PolarHBondContact NE-OH 3.27Å; R143-Y178 PolarHBondContact NH2-OH 3.1Å; R143-Y178 VanDerWaalsContact NH2-OH 3.14Å; G174-Y178 WeakPolarHBondContact O-CD2 3.39Å; G175-Y178 PolarHBondContact O-N 2.97Å; G175-Y178 VanDerWaalsContact O-N 3.12Å; I176-Y178 VanDerWaalsContact C-N 3.34Å; I176-Y178 PolarHBondContact O-N 3.48Å; Y178-A181 WeakPolarHBondContact O-CB 3.38Å; Y178-A181 PolarHBondContact O-N 3.1Å; Y178-L182 WeakPolarHBondContact O-CG 3.01Å; Y178-L182 PolarHBondContact O-N 3.13Å; Y178-L182 VanDerWaalsContact O-N 3.16Å
179	L	97.3	Very high	94	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-44.2	174.5	-69.1	176.4	0	0	0	111.4	L142 A154 I157 V170 G175 I176 A181 L182 L183 A210 L211	L142-L179 HydrophobicContact CD1-CD2 3.67Å; L142-L179 HydrophobicContact CD1-CG 3.92Å; L142-L179 HydrophobicContact CD2-CD2 4.14Å; A154-L179 HydrophobicContact CB-CD2 4.16Å; I157-L179 HydrophobicContact CG2-CD1 4.32Å; V170-L179 HydrophobicContact CG1-CD1 4.18Å; G175-L179 WeakPolarHBondContact O-CG 3.24Å; G175-L179 PolarHBondContact O-N 2.9Å; I176-L179 PolarHBondContact O-N 3.28Å; L179-A181 VanDerWaalsContact C-N 3.29Å; L179-A181 PolarHBondContact O-N 3.31Å; L179-L182 HydrophobicContact CD2-CD1 4.33Å; L179-L182 WeakPolarHBondContact O-CB 3.46Å; L179-L182 PolarHBondContact O-N 2.87Å; L179-L182 VanDerWaalsContact O-N 3.08Å; L179-L183 WeakPolarHBondContact O-CD1 3.31Å; L179-A210 HydrophobicContact CD1-CB 3.88Å; L179-A210 HydrophobicContact CD2-CB 3.66Å; L179-A210 HydrophobicContact CG-CB 4.37Å; L179-L211 HydrophobicContact CB-CD2 3.59Å; L179-L211 HydrophobicContact CB-CG 3.96Å; L179-L211 HydrophobicContact CD1-CD2 4.13Å
180	V	97.3	Very high	93.5	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-39.1	174.3	172.4	0	0	0	0	111.4	I176 L182 L183 L211 A227 V229 L232	I176-V180 HydrophobicContact CG2-CG2 4.38Å; I176-V180 WeakPolarHBondContact O-CB 3.44Å; I176-V180 VanDerWaalsContact O-CG2 3.26Å; I176-V180 WeakPolarHBondContact O-CG2 3.5Å; I176-V180 PolarHBondContact O-N 3.49Å; V180-L182 VanDerWaalsContact C-N 3.26Å; V180-L182 PolarHBondContact O-N 2.98Å; V180-L183 WeakPolarHBondContact O-CB 3.45Å; V180-L183 PolarHBondContact O-N 3.44Å; V180-L183 VanDerWaalsContact O-N 3.16Å; V180-L211 HydrophobicContact CG2-CD1 3.84Å; V180-L211 HydrophobicContact CG2-CD2 4.14Å; V180-A227 HydrophobicContact CB-CB 4.14Å; V180-A227 HydrophobicContact CG1-CB 4.16Å; V180-A227 HydrophobicContact CG2-CB 3.98Å; V180-V229 HydrophobicContact CG1-CB 4.24Å; V180-V229 HydrophobicContact CG2-CB 4.06Å; V180-V229 HydrophobicContact CG2-CG2 4.1Å; V180-L232 HydrophobicContact CG1-CD1 3.75Å; V180-L232 VanDerWaalsContact O-CD1 3.29Å; V180-L232 WeakPolarHBondContact O-CD1 3.36Å
181	A	95.8	Very high	92.9	Very high	63 Å²	63	54.1 Å²	54.1	52%	0.521	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-27.3	175.6	0	0	0	0	0	113.4	K177 Y178 L179 L183 D184	K177-A181 PolarHBondContact O-N 3.19Å; Y178-A181 WeakPolarHBondContact O-CB 3.38Å; Y178-A181 PolarHBondContact O-N 3.1Å; L179-A181 VanDerWaalsContact C-N 3.29Å; L179-A181 PolarHBondContact O-N 3.31Å; A181-L183 VanDerWaalsContact C-N 3.25Å; A181-L183 PolarHBondContact O-N 3.44Å; A181-D184 PolarHBondContact O-N 3.24Å
182	L	95.4	Very high	92.3	Very high	15 Å²	15	55.7 Å²	55.7	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-68.8	-22.9	175.5	-63.4	-175.5	0	0	0	113.1	L142 K150 A154 Y178 L179 V180 D184 V203 A204	L142-L182 HydrophobicContact CD2-CD1 4.04Å; K150-L182 HydrophobicContact CB-CD2 4.13Å; K150-L182 HydrophobicContact CD-CD2 3.79Å; K150-L182 HydrophobicContact CG-CD2 4.15Å; A154-L182 HydrophobicContact CB-CD1 3.94Å; Y178-L182 WeakPolarHBondContact O-CG 3.01Å; Y178-L182 PolarHBondContact O-N 3.13Å; Y178-L182 VanDerWaalsContact O-N 3.16Å; L179-L182 HydrophobicContact CD2-CD1 4.33Å; L179-L182 WeakPolarHBondContact O-CB 3.46Å; L179-L182 PolarHBondContact O-N 2.87Å; L179-L182 VanDerWaalsContact O-N 3.08Å; V180-L182 VanDerWaalsContact C-N 3.26Å; V180-L182 PolarHBondContact O-N 2.98Å; L182-D184 PolarHBondContact O-N 3.49Å; L182-V203 HydrophobicContact CB-CG1 4.48Å; L182-V203 HydrophobicContact CD2-CG1 3.98Å; L182-A204 VanDerWaalsContact O-CA 3.28Å; L182-A204 WeakPolarHBondContact O-CA 3.49Å; L182-A204 WeakPolarHBondContact O-CB 3.4Å
183	L	95.4	Very high	91.8	Very high	1 Å²	1	54 Å²	54	1%	0.005	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-11	177.3	-83.8	64	0	0	0	112.2	L179 V180 A181 C185 L211 V229 L232 L233 L236	L179-L183 WeakPolarHBondContact O-CD1 3.31Å; V180-L183 WeakPolarHBondContact O-CB 3.45Å; V180-L183 PolarHBondContact O-N 3.44Å; V180-L183 VanDerWaalsContact O-N 3.16Å; A181-L183 VanDerWaalsContact C-N 3.25Å; A181-L183 PolarHBondContact O-N 3.44Å; L183-C185 PolarHBondContact O-N 2.99Å; L183-L211 HydrophobicContact CD1-CD1 3.5Å; L183-L211 HydrophobicContact CD1-CG 4.3Å; L183-L211 HydrophobicContact CD2-CD1 3.64Å; L183-L211 HydrophobicContact CG-CD1 4.25Å; L183-V229 HydrophobicContact CD2-CG2 4.16Å; L183-L232 HydrophobicContact CB-CB 4.22Å; L183-L232 HydrophobicContact CB-CD1 4.07Å; L183-L233 HydrophobicContact CD2-CD2 4.01Å; L183-L236 HydrophobicContact CB-CD1 3.81Å; L183-L236 HydrophobicContact CD2-CD1 3.95Å; L183-L236 HydrophobicContact CG-CD1 3.74Å
184	D	93.8	Very high	91.6	Very high	87 Å²	87	52.2 Å²	52.2	47%	0.465	30%	0.304	S	S	.	.			trans	-73.7	94	175.1	-165	19.3	0	0	0	111	A181 L182 P186 L232 R235	A181-D184 PolarHBondContact O-N 3.24Å; L182-D184 PolarHBondContact O-N 3.49Å; D184-P186 WeakPolarHBondContact O-CD 3.29Å; D184-L232 HydrophobicContact CB-CD2 4.27Å; D184-R235 IonicContact OD1-CZ 3.78Å; D184-R235 VanDerWaalsContact OD1-CZ 3.27Å; D184-R235 IonicContact OD1-NH1 3.57Å; D184-R235 PolarHBondContact OD1-NH1 2.99Å; D184-R235 IonicContact OD1-NH2 2.67Å; D184-R235 PolarHBondContact OD1-NH2 3.31Å
185	C	90.7	Very high	91.4	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.02	32%	0.317	C	S	.	.			trans	-116	90.3	179	-169.4	0	0	0	0	110	L183 S187 L188 A204	L183-C185 PolarHBondContact O-N 2.99Å; C185-S187 PolarHBondContact O-N 3.36Å; C185-L188 PolarHBondContact O-N 3.03Å; C185-A204 HydrophobicContact CB-CB 3.81Å
186	P	88.4	Confident	91	Very high	105 Å²	105	60.4 Å²	60.4	68%	0.682	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-61.8	-29	174.8	-23.6	34.2	0	0	0	112.8	D184 L188	D184-P186 WeakPolarHBondContact O-CD 3.29Å; P186-L188 PolarHBondContact O-N 3.44Å
187	S	86.9	Confident	90.7	Very high	22 Å²	22	60.8 Å²	60.8	15%	0.154	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-80.9	7.8	-175.3	-46.9	0	0	0	0	114.5	C185 N189 S190 V197 D200	C185-S187 PolarHBondContact O-N 3.36Å; S187-N189 PolarHBondContact O-N 3.38Å; S187-N189 VanDerWaalsContact O-N 3.08Å; S187-S190 WeakPolarHBondContact CA-OG 3.5Å; S187-S190 WeakPolarHBondContact O-CB 3.47Å; S187-S190 PolarHBondContact O-N 3.33Å; S187-S190 PolarHBondContact O-OG 3.22Å; S187-V197 WeakPolarHBondContact O-CG1 2.95Å; S187-D200 PolarHBondContact OG-OD2 3.29Å
188	L	86.3	Confident	90.4	Very high	5 Å²	5	58.5 Å²	58.5	3%	0.026	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-54.5	-32.9	-171.1	-169.7	67.5	0	0	0	114.5	C185 P186 L236 S239	C185-L188 PolarHBondContact O-N 3.03Å; P186-L188 PolarHBondContact O-N 3.44Å; L188-L236 HydrophobicContact CD1-CD2 3.97Å; L188-L236 HydrophobicContact CD2-CD2 4.13Å; L188-S239 WeakPolarHBondContact CD1-OG 3.26Å
189	N	86.1	Confident	90.1	Very high	111 Å²	111	60.6 Å²	60.6	59%	0.594	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-117.6	17.4	-178.8	-62.1	-40.6	0	0	0	112.1	S187 V191	S187-N189 PolarHBondContact O-N 3.38Å; S187-N189 VanDerWaalsContact O-N 3.08Å; N189-V191 PolarHBondContact O-N 2.94Å
190	S	85.4	Confident	89.8	Confident	46 Å²	46	62.3 Å²	62.3	32%	0.322	35%	0.354	S	S	.	.			trans	-66	133.1	-177.6	-71.6	0	0	0	0	111.3	S187	S187-S190 WeakPolarHBondContact CA-OG 3.5Å; S187-S190 WeakPolarHBondContact O-CB 3.47Å; S187-S190 PolarHBondContact O-N 3.33Å; S187-S190 PolarHBondContact O-OG 3.22Å
191	V	82.4	Confident	89.6	Confident	140 Å²	140	62.9 Å²	62.9	85%	0.848	36%	0.357	S	S	*	.	S	Bend	trans	-127.6	126.5	174	-175.6	0	0	0	0	107.2	N189	N189-V191 PolarHBondContact O-N 2.94Å
192	P	84.6	Confident	89.5	Confident	95 Å²	95	63.2 Å²	63.2	62%	0.617	35%	0.348	S	S	*	.	S	Bend	cis	-75.5	157.4	4.5	32.5	-35.9	0	0	0	113.8	T194	P192-T194 HydrophobicContact CG-CG2 4.21Å; P192-T194 PolarHBondContact O-N 3.46Å
193	M	85.5	Confident	89.5	Confident	78 Å²	78	63.4 Å²	63.4	38%	0.384	35%	0.349	S	S	.	.			trans	-75.4	91	172.8	-171.4	62.5	68.7	0	0	109.4	V197 E198 I201 H241	M193-V197 HydrophobicContact CE-CG1 4.26Å; M193-V197 HydrophobicContact SD-CB 3.95Å; M193-V197 HydrophobicContact SD-CG1 3.42Å; M193-V197 WeakPolarHBondContact SD-CG1 3.5Å; M193-E198 HydrophobicContact CG-CG 3.6Å; M193-E198 HydrophobicContact SD-CG 3.75Å; M193-I201 HydrophobicContact CE-CD1 3.79Å; M193-I201 HydrophobicContact SD-CD1 3.81Å; M193-H241 WeakPolarHBondContact CE-CE1 3.28Å; M193-H241 WeakPolarHBondContact CE-NE2 3.47Å
194	T	91.1	Very high	89.5	Confident	61 Å²	61	63.4 Å²	63.4	37%	0.374	35%	0.349	S	S	.	.			trans	-83.9	159.9	175.1	71.4	0	0	0	0	110.4	P192 E196 V197 E198	P192-T194 HydrophobicContact CG-CG2 4.21Å; P192-T194 PolarHBondContact O-N 3.46Å; T194-E196 PolarHBondContact O-N 3.02Å; T194-E196 PolarHBondContact OG1-N 3.08Å; T194-V197 WeakPolarHBondContact O-CB 3.39Å; T194-V197 PolarHBondContact O-N 3.18Å; T194-V197 WeakPolarHBondContact OG1-CG2 3.45Å; T194-V197 PolarHBondContact OG1-N 3.42Å; T194-E198 PolarHBondContact O-N 2.87Å
195	S	90	Very high	89.6	Confident	78 Å²	78	61.3 Å²	61.3	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-17.1	175.4	-50	0	0	0	0	113.6	R199	S195-R199 WeakPolarHBondContact O-CG 3.49Å; S195-R199 PolarHBondContact O-N 3.29Å; S195-R199 PolarHBondContact O-NE 3.12Å
196	E	89.1	Confident	89.9	Confident	120 Å²	120	61.2 Å²	61.2	56%	0.561	33%	0.334	S	S	*	.	H	α-helix	trans	-78.3	-42.3	171.9	-67.4	-177.4	174.3	0	0	111.7	T194 R199 D200	T194-E196 PolarHBondContact O-N 3.02Å; T194-E196 PolarHBondContact OG1-N 3.08Å; E196-R199 PolarHBondContact O-N 2.75Å; E196-D200 PolarHBondContact O-N 3.04Å
197	V	90.2	Very high	90.3	Very high	13 Å²	13	56.2 Å²	56.2	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-43.8	175.1	175.9	0	0	0	0	110.5	S187 M193 T194 R199 D200 I201	S187-V197 WeakPolarHBondContact O-CG1 2.95Å; M193-V197 HydrophobicContact CE-CG1 4.26Å; M193-V197 HydrophobicContact SD-CB 3.95Å; M193-V197 HydrophobicContact SD-CG1 3.42Å; M193-V197 WeakPolarHBondContact SD-CG1 3.5Å; T194-V197 WeakPolarHBondContact O-CB 3.39Å; T194-V197 PolarHBondContact O-N 3.18Å; T194-V197 WeakPolarHBondContact OG1-CG2 3.45Å; T194-V197 PolarHBondContact OG1-N 3.42Å; V197-R199 VanDerWaalsContact C-N 3.3Å; V197-R199 PolarHBondContact O-N 3.12Å; V197-D200 PolarHBondContact O-N 3.22Å; V197-D200 VanDerWaalsContact O-N 3.14Å; V197-I201 HydrophobicContact CG1-CD1 3.83Å; V197-I201 HydrophobicContact CG1-CG1 4.5Å; V197-I201 WeakPolarHBondContact O-CG1 3.37Å; V197-I201 PolarHBondContact O-N 3.43Å
198	E	90.6	Very high	90.8	Very high	105 Å²	105	55.1 Å²	55.1	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-42.8	175.8	-68.7	178.1	163.2	0	0	111.8	M193 T194 I201 E202	M193-E198 HydrophobicContact CG-CG 3.6Å; M193-E198 HydrophobicContact SD-CG 3.75Å; T194-E198 PolarHBondContact O-N 2.87Å; E198-I201 PolarHBondContact O-N 3.24Å; E198-E202 WeakPolarHBondContact O-CB 3.34Å; E198-E202 PolarHBondContact O-N 3.35Å
199	R	90.4	Very high	91.3	Very high	120 Å²	120	56.7 Å²	56.7	45%	0.453	30%	0.303	S	S	.	.	H	α-helix	trans	-64.5	-39	176.2	-80.9	-179.5	-82.7	165.8	-3.2	112.2	S195 E196 V197 E202 V203	S195-R199 WeakPolarHBondContact O-CG 3.49Å; S195-R199 PolarHBondContact O-N 3.29Å; S195-R199 PolarHBondContact O-NE 3.12Å; E196-R199 PolarHBondContact O-N 2.75Å; V197-R199 VanDerWaalsContact C-N 3.3Å; V197-R199 PolarHBondContact O-N 3.12Å; R199-E202 PolarHBondContact O-N 3.27Å; R199-V203 VanDerWaalsContact O-CG2 3.28Å; R199-V203 WeakPolarHBondContact O-CG2 3.47Å; R199-V203 PolarHBondContact O-N 3.24Å
200	D	90.9	Very high	91.9	Very high	37 Å²	37	51.4 Å²	51.4	20%	0.198	27%	0.274	C	S	.	.	H	α-helix	trans	-66.9	-39.8	177.5	-71.5	-14.2	0	0	0	112.1	R147 S187 E196 V197 E202 A204	R147-D200 WeakPolarHBondContact CD-OD1 3Å; R147-D200 IonicContact CZ-OD1 3.86Å; R147-D200 VanDerWaalsContact CZ-OD1 3.28Å; R147-D200 IonicContact NE-OD1 3.8Å; R147-D200 IonicContact NH1-OD1 2.73Å; R147-D200 PolarHBondContact NH1-OD1 3.13Å; R147-D200 IonicContact NH1-OD2 3.05Å; R147-D200 PolarHBondContact NH1-OD2 3.11Å; S187-D200 PolarHBondContact OG-OD2 3.29Å; E196-D200 PolarHBondContact O-N 3.04Å; V197-D200 PolarHBondContact O-N 3.22Å; V197-D200 VanDerWaalsContact O-N 3.14Å; D200-E202 VanDerWaalsContact C-N 3.35Å; D200-A204 PolarHBondContact O-N 2.92Å
201	I	93.2	Very high	92.5	Very high	16 Å²	16	49.2 Å²	49.2	8%	0.082	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-43.2	173.7	-66.3	162	0	0	0	109.9	M193 V197 E198 V203 A204 R205 H241 M244	M193-I201 HydrophobicContact CE-CD1 3.79Å; M193-I201 HydrophobicContact SD-CD1 3.81Å; V197-I201 HydrophobicContact CG1-CD1 3.83Å; V197-I201 HydrophobicContact CG1-CG1 4.5Å; V197-I201 WeakPolarHBondContact O-CG1 3.37Å; V197-I201 PolarHBondContact O-N 3.43Å; E198-I201 PolarHBondContact O-N 3.24Å; I201-V203 PolarHBondContact O-N 2.85Å; I201-A204 PolarHBondContact O-N 3.39Å; I201-R205 WeakPolarHBondContact O-CB 3.35Å; I201-R205 PolarHBondContact O-N 3.14Å; I201-H241 WeakPolarHBondContact CD1-NE2 3.47Å; I201-M244 HydrophobicContact CG2-CE 3.79Å; I201-M244 WeakPolarHBondContact O-CE 3.38Å
202	E	93.8	Very high	93.2	Very high	70 Å²	70	44.8 Å²	44.8	33%	0.327	23%	0.227	S	C	.	.	H	α-helix	trans	-65.4	-38.1	-179.3	-175.2	59.8	-168.6	0	0	112.8	E198 R199 D200 A204 R205 C206	E198-E202 WeakPolarHBondContact O-CB 3.34Å; E198-E202 PolarHBondContact O-N 3.35Å; R199-E202 PolarHBondContact O-N 3.27Å; D200-E202 VanDerWaalsContact C-N 3.35Å; E202-A204 PolarHBondContact O-N 3.37Å; E202-R205 VanDerWaalsContact CD-NE 3.34Å; E202-R205 PolarHBondContact O-N 3.02Å; E202-R205 IonicContact OE1-CZ 3.63Å; E202-R205 IonicContact OE1-NE 2.78Å; E202-R205 PolarHBondContact OE1-NE 3.06Å; E202-R205 IonicContact OE1-NH2 3.37Å; E202-R205 PolarHBondContact OE1-NH2 3.02Å; E202-R205 IonicContact OE2-CZ 3.78Å; E202-R205 IonicContact OE2-NE 3.99Å; E202-R205 PolarHBondContact OE2-NE 3.35Å; E202-R205 IonicContact OE2-NH2 2.89Å; E202-C206 PolarHBondContact O-N 2.73Å; E202-C206 PolarHBondContact O-SG 2.65Å; E202-C206 VanDerWaalsContact O-SG 3.4Å
203	V	94.4	Very high	93.8	Very high	18 Å²	18	40.8 Å²	40.8	11%	0.109	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-46.8	172.7	171.8	0	0	0	0	110.9	R147 K150 C151 L182 R199 I201 R205 C206 G207	R147-V203 HydrophobicContact CB-CG2 4.11Å; K150-V203 HydrophobicContact CB-CG1 4.49Å; C151-V203 HydrophobicContact CB-CG2 3.93Å; L182-V203 HydrophobicContact CB-CG1 4.48Å; L182-V203 HydrophobicContact CD2-CG1 3.98Å; R199-V203 VanDerWaalsContact O-CG2 3.28Å; R199-V203 WeakPolarHBondContact O-CG2 3.47Å; R199-V203 PolarHBondContact O-N 3.24Å; I201-V203 PolarHBondContact O-N 2.85Å; V203-R205 VanDerWaalsContact C-N 3.32Å; V203-R205 PolarHBondContact O-N 3.15Å; V203-C206 PolarHBondContact O-N 2.98Å; V203-G207 PolarHBondContact O-N 3.37Å
204	A	95.6	Very high	94.4	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-35.5	178.5	0	0	0	0	0	112	L182 C185 D200 I201 E202 G207 A208 M244	L182-A204 VanDerWaalsContact O-CA 3.28Å; L182-A204 WeakPolarHBondContact O-CA 3.49Å; L182-A204 WeakPolarHBondContact O-CB 3.4Å; C185-A204 HydrophobicContact CB-CB 3.81Å; D200-A204 PolarHBondContact O-N 2.92Å; I201-A204 PolarHBondContact O-N 3.39Å; E202-A204 PolarHBondContact O-N 3.37Å; A204-G207 PolarHBondContact O-N 3.29Å; A204-A208 WeakPolarHBondContact O-CB 3.36Å; A204-A208 PolarHBondContact O-N 3.2Å; A204-M244 HydrophobicContact CB-CE 3.66Å
205	R	96.2	Very high	94.6	Very high	44 Å²	44	34.2 Å²	34.2	17%	0.166	17%	0.166	C	C	.	.	H	α-helix	trans	-63.6	-47	176.2	-170.7	-167.6	71.4	72.9	4.2	111	I201 E202 V203 G207 A208 L209 N243 M244 P247	I201-R205 WeakPolarHBondContact O-CB 3.35Å; I201-R205 PolarHBondContact O-N 3.14Å; E202-R205 VanDerWaalsContact CD-NE 3.34Å; E202-R205 PolarHBondContact O-N 3.02Å; E202-R205 IonicContact OE1-CZ 3.63Å; E202-R205 IonicContact OE1-NE 2.78Å; E202-R205 PolarHBondContact OE1-NE 3.06Å; E202-R205 IonicContact OE1-NH2 3.37Å; E202-R205 PolarHBondContact OE1-NH2 3.02Å; E202-R205 IonicContact OE2-CZ 3.78Å; E202-R205 IonicContact OE2-NE 3.99Å; E202-R205 PolarHBondContact OE2-NE 3.35Å; E202-R205 IonicContact OE2-NH2 2.89Å; V203-R205 VanDerWaalsContact C-N 3.32Å; V203-R205 PolarHBondContact O-N 3.15Å; R205-G207 VanDerWaalsContact C-N 3.32Å; R205-G207 PolarHBondContact O-N 2.95Å; R205-A208 WeakPolarHBondContact O-CB 3.41Å; R205-A208 PolarHBondContact O-N 3.12Å; R205-L209 PolarHBondContact O-N 3.4Å; R205-N243 WeakPolarHBondContact CD-O 3.05Å; R205-N243 WeakPolarHBondContact CG-O 3.42Å; R205-M244 HydrophobicContact CB-CE 3.78Å; R205-M244 HydrophobicContact CB-SD 4.08Å; R205-P247 HydrophobicContact CG-CG 4.28Å
206	C	96.7	Very high	94.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.4	-37.8	176.3	-68.6	0	0	0	0	111.9	C151 A154 E202 V203 L209 A210	C151-C206 WeakPolarHBondContact O-CB 3.48Å; C151-C206 PolarHBondContact SG-SG 3.15Å; A154-C206 HydrophobicContact CB-CB 3.95Å; E202-C206 PolarHBondContact O-N 2.73Å; E202-C206 PolarHBondContact O-SG 2.65Å; E202-C206 VanDerWaalsContact O-SG 3.4Å; V203-C206 PolarHBondContact O-N 2.98Å; C206-L209 PolarHBondContact O-N 3.01Å; C206-A210 PolarHBondContact O-N 2.8Å
207	G	97.1	Very high	95.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59	-46.1	171	0	0	0	0	0	112.5	V203 A204 R205 A210 L211	V203-G207 PolarHBondContact O-N 3.37Å; A204-G207 PolarHBondContact O-N 3.29Å; R205-G207 VanDerWaalsContact C-N 3.32Å; R205-G207 PolarHBondContact O-N 2.95Å; G207-A210 PolarHBondContact O-N 3.05Å; G207-L211 WeakPolarHBondContact O-CG 3.49Å; G207-L211 PolarHBondContact O-N 2.85Å
208	A	97.7	Very high	95.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-41.9	176.5	0	0	0	0	0	112	A204 R205 A210 L211 W212 P247 V248	A204-A208 WeakPolarHBondContact O-CB 3.36Å; A204-A208 PolarHBondContact O-N 3.2Å; R205-A208 WeakPolarHBondContact O-CB 3.41Å; R205-A208 PolarHBondContact O-N 3.12Å; A208-A210 VanDerWaalsContact C-N 3.33Å; A208-A210 PolarHBondContact O-N 3.21Å; A208-L211 PolarHBondContact O-N 3.47Å; A208-W212 PolarHBondContact O-N 3.42Å; A208-P247 HydrophobicContact CB-CB 3.97Å; A208-P247 HydrophobicContact CB-CG 4.02Å; A208-V248 HydrophobicContact CB-CG2 3.92Å
209	L	97.4	Very high	95.7	Very high	38 Å²	38	35.6 Å²	35.6	20%	0.199	16%	0.155	C	C	.	.	H	α-helix	trans	-61.9	-41	177.3	-172.6	67.3	0	0	0	112	E155 A158 R205 C206 W212 S213 P247	E155-L209 HydrophobicContact CG-CD2 4.46Å; A158-L209 HydrophobicContact CB-CB 4.32Å; A158-L209 HydrophobicContact CB-CD2 4.07Å; A158-L209 HydrophobicContact CB-CG 3.79Å; R205-L209 PolarHBondContact O-N 3.4Å; C206-L209 PolarHBondContact O-N 3.01Å; L209-W212 HydrophobicContact CD1-CE3 4.08Å; L209-W212 HydrophobicContact CD1-CZ3 4.49Å; L209-W212 PolarHBondContact O-N 2.69Å; L209-S213 PolarHBondContact O-N 3.08Å; L209-S213 VanDerWaalsContact O-N 3.13Å; L209-S213 PolarHBondContact O-OG 3.09Å; L209-P247 HydrophobicContact CB-CB 4.22Å; L209-P247 HydrophobicContact CD1-CB 4.29Å
210	A	97.8	Very high	96	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.7	-42	175.2	0	0	0	0	0	112.2	A154 I157 A158 L179 C206 G207 A208 S213 C214	A154-A210 HydrophobicContact CB-CB 4.36Å; A154-A210 WeakPolarHBondContact O-CB 3.42Å; I157-A210 HydrophobicContact CG2-CB 4.35Å; A158-A210 HydrophobicContact CB-CB 4.14Å; L179-A210 HydrophobicContact CD1-CB 3.88Å; L179-A210 HydrophobicContact CD2-CB 3.66Å; L179-A210 HydrophobicContact CG-CB 4.37Å; C206-A210 PolarHBondContact O-N 2.8Å; G207-A210 PolarHBondContact O-N 3.05Å; A208-A210 VanDerWaalsContact C-N 3.33Å; A208-A210 PolarHBondContact O-N 3.21Å; A210-S213 PolarHBondContact O-N 3.33Å; A210-C214 WeakPolarHBondContact O-CB 3.39Å; A210-C214 PolarHBondContact O-N 3.15Å; A210-C214 PolarHBondContact O-SG 3.03Å
211	L	97.8	Very high	96.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.5	-39.4	175.7	-74.8	-174.8	0	0	0	112.3	L179 V180 L183 G207 A208 S213 C214 S215 M224 V229	L179-L211 HydrophobicContact CB-CD2 3.59Å; L179-L211 HydrophobicContact CB-CG 3.96Å; L179-L211 HydrophobicContact CD1-CD2 4.13Å; V180-L211 HydrophobicContact CG2-CD1 3.84Å; V180-L211 HydrophobicContact CG2-CD2 4.14Å; L183-L211 HydrophobicContact CD1-CD1 3.5Å; L183-L211 HydrophobicContact CD1-CG 4.3Å; L183-L211 HydrophobicContact CD2-CD1 3.64Å; L183-L211 HydrophobicContact CG-CD1 4.25Å; G207-L211 WeakPolarHBondContact O-CG 3.49Å; G207-L211 PolarHBondContact O-N 2.85Å; A208-L211 PolarHBondContact O-N 3.47Å; L211-S213 PolarHBondContact O-N 2.88Å; L211-C214 CarbonylContact O-C 3.59Å; L211-C214 PolarHBondContact O-N 3.15Å; L211-S215 VanDerWaalsContact O-CB 3.24Å; L211-S215 WeakPolarHBondContact O-CB 3.36Å; L211-S215 PolarHBondContact O-N 3.08Å; L211-M224 HydrophobicContact CB-CE 4.03Å; L211-M224 HydrophobicContact CD1-CE 4.35Å; L211-M224 HydrophobicContact CD2-CE 4.21Å; L211-M224 HydrophobicContact CD2-CG 4.09Å; L211-M224 HydrophobicContact CD2-SD 4.27Å; L211-M224 HydrophobicContact CG-CE 4.44Å; L211-V229 HydrophobicContact CD1-CG2 4.08Å
212	W	97.9	Very high	96.4	Very high	46 Å²	46	30.7 Å²	30.7	17%	0.174	14%	0.137	C	C	.	.	H	α-helix	trans	-57.8	-51	174.7	-177.9	14	0	0	0	110.6	A208 L209 C214 S215 I246 P247 G250 T251 H288	A208-W212 PolarHBondContact O-N 3.42Å; L209-W212 HydrophobicContact CD1-CE3 4.08Å; L209-W212 HydrophobicContact CD1-CZ3 4.49Å; L209-W212 PolarHBondContact O-N 2.69Å; W212-C214 VanDerWaalsContact C-N 3.31Å; W212-C214 PolarHBondContact O-N 3.41Å; W212-S215 WeakPolarHBondContact O-CB 3.12Å; W212-S215 PolarHBondContact O-N 3.26Å; W212-S215 PolarHBondContact O-OG 3.17Å; W212-I246 HydrophobicContact CH2-CG2 4.42Å; W212-I246 HydrophobicContact CZ3-CG2 4.05Å; W212-P247 HydrophobicContact CE3-CB 3.96Å; W212-G250 PolarHBondContact NE1-O 2.71Å; W212-T251 VanDerWaalsContact CA-OG1 3.27Å; W212-T251 WeakPolarHBondContact CA-OG1 3.43Å; W212-T251 WeakPolarHBondContact CB-OG1 3.3Å; W212-T251 PolarHBondContact N-OG1 3.19Å; W212-H288 AromaticContact CH2-CE1 3.47Å; W212-H288 VanDerWaalsContact CH2-CE1 3.47Å; W212-H288 WeakPolarHBondContact CH2-CE1 3.5Å; W212-H288 AromaticContact CH2-NE2 3.29Å; W212-H288 VanDerWaalsContact CH2-NE2 3.29Å; W212-H288 WeakPolarHBondContact CH2-NE2 3.43Å; W212-H288 AromaticContact CZ2-CE1 3.31Å; W212-H288 WeakPolarHBondContact CZ2-CE1 3.22Å; W212-H288 AromaticContact CZ2-NE2 3.67Å
213	S	96.9	Very high	96.5	Very high	12 Å²	12	28.5 Å²	28.5	8%	0.084	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-39.6	177.2	-57.5	0	0	0	0	112.2	A158 R167 L209 A210 L211 S215	A158-S213 VanDerWaalsContact O-CB 3.31Å; A158-S213 WeakPolarHBondContact O-CB 3.26Å; A158-S213 PolarHBondContact O-OG 3.28Å; A158-S213 VanDerWaalsContact O-OG 3.1Å; R167-S213 WeakPolarHBondContact CD-O 3.41Å; L209-S213 PolarHBondContact O-N 3.08Å; L209-S213 VanDerWaalsContact O-N 3.13Å; L209-S213 PolarHBondContact O-OG 3.09Å; A210-S213 PolarHBondContact O-N 3.33Å; L211-S213 PolarHBondContact O-N 2.88Å; S213-S215 VanDerWaalsContact C-N 3.32Å; S213-S215 PolarHBondContact O-N 3.35Å
214	C	97.1	Very high	96.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-68.8	-28.5	176.1	-71.8	0	0	0	0	113.5	I176 A210 L211 W212 K216 S217 N220	I176-C214 HydrophobicContact CD1-CB 3.92Å; A210-C214 WeakPolarHBondContact O-CB 3.39Å; A210-C214 PolarHBondContact O-N 3.15Å; A210-C214 PolarHBondContact O-SG 3.03Å; L211-C214 CarbonylContact O-C 3.59Å; L211-C214 PolarHBondContact O-N 3.15Å; W212-C214 VanDerWaalsContact C-N 3.31Å; W212-C214 PolarHBondContact O-N 3.41Å; C214-K216 PolarHBondContact O-N 3.34Å; C214-S217 PolarHBondContact O-N 3.43Å; C214-N220 WeakPolarHBondContact O-CB 3.37Å; C214-N220 PolarHBondContact O-ND2 3.38Å
215	S	96.8	Very high	96.7	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-69.8	-16.4	-172.6	70.5	0	0	0	0	113	L211 W212 S213 S217 K221 E254	L211-S215 VanDerWaalsContact O-CB 3.24Å; L211-S215 WeakPolarHBondContact O-CB 3.36Å; L211-S215 PolarHBondContact O-N 3.08Å; W212-S215 WeakPolarHBondContact O-CB 3.12Å; W212-S215 PolarHBondContact O-N 3.26Å; W212-S215 PolarHBondContact O-OG 3.17Å; S213-S215 VanDerWaalsContact C-N 3.32Å; S213-S215 PolarHBondContact O-N 3.35Å; S215-S217 PolarHBondContact O-N 3.47Å; S215-K221 WeakPolarHBondContact O-CE 3.38Å; S215-K221 WeakPolarHBondContact O-CG 3.32Å; S215-E254 WeakPolarHBondContact OG-CB 3.46Å; S215-E254 WeakPolarHBondContact OG-CG 3.47Å
216	K	94.7	Very high	96.7	Very high	66 Å²	66	39.1 Å²	39.1	29%	0.287	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-23.4	172.8	-65	178.7	174.4	179.7	0	113.8	N162 C214	N162-K216 PolarHBondContact OD1-NZ 2.96Å; C214-K216 PolarHBondContact O-N 3.34Å
217	S	94.8	Very high	96.7	Very high	14 Å²	14	40.7 Å²	40.7	10%	0.098	18%	0.184	C	C	.	.	S	Bend	trans	-94	126.2	177	177	0	0	0	0	112.8	C214 S215 K219 N220 K221	C214-S217 PolarHBondContact O-N 3.43Å; S215-S217 PolarHBondContact O-N 3.47Å; S217-K219 VanDerWaalsContact C-N 3.3Å; S217-K219 PolarHBondContact O-N 2.9Å; S217-N220 WeakPolarHBondContact O-CA 3.35Å; S217-N220 WeakPolarHBondContact O-CB 3.44Å; S217-N220 PolarHBondContact O-N 3.34Å; S217-K221 PolarHBondContact O-N 2.97Å
218	R	95.3	Very high	96.6	Very high	135 Å²	135	42.3 Å²	42.3	51%	0.509	20%	0.201	S	C	.	.	H	α-helix	trans	-50	-45.5	174.8	179.7	166.7	-175.7	-117.7	2.1	113.6	N220 K221 L222 E258	R218-N220 VanDerWaalsContact C-N 3.28Å; R218-N220 PolarHBondContact O-N 3.45Å; R218-K221 WeakPolarHBondContact O-CB 3.5Å; R218-K221 PolarHBondContact O-N 3.46Å; R218-L222 PolarHBondContact O-N 3.07Å; R218-L222 VanDerWaalsContact O-N 3.15Å; R218-E258 WeakPolarHBondContact CD-OE1 3.46Å; R218-E258 VanDerWaalsContact CG-OE1 3.32Å; R218-E258 WeakPolarHBondContact CG-OE1 3.11Å; R218-E258 IonicContact NE-OE1 2.69Å; R218-E258 IonicContact NE-OE2 2.71Å; R218-E258 PolarHBondContact NE-OE2 2.98Å; R218-E258 VanDerWaalsContact NE-OE2 3.14Å
219	K	96.4	Very high	96.6	Very high	131 Å²	131	42.3 Å²	42.3	57%	0.57	20%	0.201	S	C	*	.	H	α-helix	trans	-65.2	-29.3	178.4	-71.7	173.9	-173.6	165.1	0	112.5	R171 S217 A223	R171-K219 VanDerWaalsContact CZ-CB 3.42Å; S217-K219 VanDerWaalsContact C-N 3.3Å; S217-K219 PolarHBondContact O-N 2.9Å; K219-A223 PolarHBondContact O-N 3.31Å
220	N	96.8	Very high	96.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-75.2	-41.8	173	-74.6	1.2	0	0	0	111.8	R167 R171 I176 C214 S217 R218 L222 A223 M224	R167-N220 PolarHBondContact O-ND2 2.96Å; R167-N220 VanDerWaalsContact O-ND2 3.13Å; R171-N220 VanDerWaalsContact CB-OD1 3.28Å; R171-N220 WeakPolarHBondContact CB-OD1 3.26Å; R171-N220 VanDerWaalsContact CD-OD1 3.3Å; R171-N220 WeakPolarHBondContact CD-OD1 3.44Å; R171-N220 PolarHBondContact NH1-OD1 3.39Å; I176-N220 HydrophobicContact CD1-CB 4.42Å; C214-N220 WeakPolarHBondContact O-CB 3.37Å; C214-N220 PolarHBondContact O-ND2 3.38Å; S217-N220 WeakPolarHBondContact O-CA 3.35Å; S217-N220 WeakPolarHBondContact O-CB 3.44Å; S217-N220 PolarHBondContact O-N 3.34Å; R218-N220 VanDerWaalsContact C-N 3.28Å; R218-N220 PolarHBondContact O-N 3.45Å; N220-L222 PolarHBondContact O-N 2.89Å; N220-A223 WeakPolarHBondContact O-CB 3.42Å; N220-A223 PolarHBondContact O-N 3.43Å; N220-M224 VanDerWaalsContact O-CG 3.25Å; N220-M224 WeakPolarHBondContact O-CG 3.43Å; N220-M224 PolarHBondContact O-N 2.93Å
221	K	97	Very high	96.4	Very high	13 Å²	13	45.5 Å²	45.5	6%	0.057	22%	0.224	C	C	.	.	H	α-helix	trans	-51.7	-45.5	173.3	-60.2	174.5	-170.3	-178.1	0	110.7	S215 S217 R218 M224 K225 E254 S257 E258 Y261	S215-K221 WeakPolarHBondContact O-CE 3.38Å; S215-K221 WeakPolarHBondContact O-CG 3.32Å; S217-K221 PolarHBondContact O-N 2.97Å; R218-K221 WeakPolarHBondContact O-CB 3.5Å; R218-K221 PolarHBondContact O-N 3.46Å; K221-M224 PolarHBondContact O-N 2.88Å; K221-K225 PolarHBondContact O-N 3.23Å; K221-E254 WeakPolarHBondContact CE-O 3.41Å; K221-E254 PolarHBondContact NZ-O 3.47Å; K221-S257 PolarHBondContact NZ-OG 3.2Å; K221-E258 HydrophobicContact CD-CG 3.81Å; K221-Y261 HydrophobicContact CB-CE2 3.95Å; K221-Y261 WeakPolarHBondContact O-CE2 3.29Å; K221-Y261 PolarHBondContact O-OH 3.33Å
222	L	95.6	Very high	96.4	Very high	57 Å²	57	46.8 Å²	46.8	30%	0.298	23%	0.23	S	C	.	.	H	α-helix	trans	-65.7	-41.7	176.2	-66.6	175.6	0	0	0	113.1	R218 N220 M224 K225 R226	R218-L222 PolarHBondContact O-N 3.07Å; R218-L222 VanDerWaalsContact O-N 3.15Å; N220-L222 PolarHBondContact O-N 2.89Å; L222-M224 VanDerWaalsContact C-N 3.35Å; L222-K225 PolarHBondContact O-N 2.8Å; L222-R226 WeakPolarHBondContact O-CG 3.48Å; L222-R226 PolarHBondContact O-N 3.39Å
223	A	97	Very high	96.3	Very high	23 Å²	23	44.6 Å²	44.6	19%	0.19	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-39.8	177.2	0	0	0	0	0	112.1	R171 I176 K219 N220 R226 A227	R171-A223 HydrophobicContact CG-CB 4.4Å; I176-A223 HydrophobicContact CB-CB 4.42Å; I176-A223 HydrophobicContact CG1-CB 4.36Å; I176-A223 HydrophobicContact CG2-CB 4.07Å; K219-A223 PolarHBondContact O-N 3.31Å; N220-A223 WeakPolarHBondContact O-CB 3.42Å; N220-A223 PolarHBondContact O-N 3.43Å; A223-R226 PolarHBondContact O-N 3.35Å; A223-A227 WeakPolarHBondContact O-CB 3.2Å; A223-A227 PolarHBondContact O-N 3.2Å
224	M	97.7	Very high	96.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.3	-43.4	175.3	-66.7	164	60.1	0	0	111.1	I176 L211 N220 K221 L222 R226 A227 G228 V229 T251	I176-M224 HydrophobicContact CG2-CB 4.23Å; I176-M224 HydrophobicContact CG2-CG 3.51Å; L211-M224 HydrophobicContact CB-CE 4.03Å; L211-M224 HydrophobicContact CD1-CE 4.35Å; L211-M224 HydrophobicContact CD2-CE 4.21Å; L211-M224 HydrophobicContact CD2-CG 4.09Å; L211-M224 HydrophobicContact CD2-SD 4.27Å; L211-M224 HydrophobicContact CG-CE 4.44Å; N220-M224 VanDerWaalsContact O-CG 3.25Å; N220-M224 WeakPolarHBondContact O-CG 3.43Å; N220-M224 PolarHBondContact O-N 2.93Å; K221-M224 PolarHBondContact O-N 2.88Å; L222-M224 VanDerWaalsContact C-N 3.35Å; M224-R226 PolarHBondContact O-N 3.03Å; M224-A227 CarbonylContact O-C 3.59Å; M224-A227 WeakPolarHBondContact O-CB 3.27Å; M224-A227 PolarHBondContact O-N 3.09Å; M224-A227 VanDerWaalsContact O-N 3.11Å; M224-G228 PolarHBondContact O-N 3.42Å; M224-V229 HydrophobicContact CB-CB 4.28Å; M224-V229 HydrophobicContact CB-CG1 3.89Å; M224-V229 HydrophobicContact CE-CG2 4.41Å; M224-V229 WeakPolarHBondContact O-CB 3.27Å; M224-V229 WeakPolarHBondContact O-CG1 3.37Å; M224-V229 PolarHBondContact O-N 3.33Å; M224-T251 HydrophobicContact CE-CG2 3.49Å; M224-T251 VanDerWaalsContact CE-CG2 3.49Å
225	K	96.1	Very high	96.2	Very high	73 Å²	73	49.1 Å²	49.1	32%	0.317	24%	0.239	S	C	.	.	H	α-helix	trans	-59.8	-47	175.8	-170.6	171.2	-176.5	171.5	0	111.4	K221 L222 A227 G228 I230 S260 Y261	K221-K225 PolarHBondContact O-N 3.23Å; L222-K225 PolarHBondContact O-N 2.8Å; K225-A227 PolarHBondContact O-N 2.97Å; K225-G228 PolarHBondContact O-N 3.39Å; K225-I230 HydrophobicContact CD-CD1 4.38Å; K225-I230 HydrophobicContact CG-CD1 4Å; K225-S260 PolarHBondContact NZ-O 3.38Å; K225-S260 PolarHBondContact NZ-OG 3.32Å; K225-S260 VanDerWaalsContact NZ-OG 3.09Å; K225-Y261 HydrophobicContact CB-CE2 4.15Å; K225-Y261 HydrophobicContact CD-CE2 4.42Å; K225-Y261 PolarHBondContact N-OH 3.32Å
226	R	96	Very high	96.1	Very high	214 Å²	214	49.1 Å²	49.1	81%	0.808	24%	0.239	S	C	*	.	H	α-helix	trans	-63.1	-26.5	175.9	-70.3	174.9	-173.9	169	1.7	113.2	L222 A223 M224 G228	L222-R226 WeakPolarHBondContact O-CG 3.48Å; L222-R226 PolarHBondContact O-N 3.39Å; A223-R226 PolarHBondContact O-N 3.35Å; M224-R226 PolarHBondContact O-N 3.03Å; R226-G228 VanDerWaalsContact C-N 3.27Å
227	A	96.5	Very high	96.1	Very high	32 Å²	32	46 Å²	46	26%	0.264	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-0.7	175.5	0	0	0	0	0	113.4	K177 V180 A223 M224 K225	K177-A227 HydrophobicContact CG-CB 4.22Å; V180-A227 HydrophobicContact CB-CB 4.14Å; V180-A227 HydrophobicContact CG1-CB 4.16Å; V180-A227 HydrophobicContact CG2-CB 3.98Å; A223-A227 WeakPolarHBondContact O-CB 3.2Å; A223-A227 PolarHBondContact O-N 3.2Å; M224-A227 CarbonylContact O-C 3.59Å; M224-A227 WeakPolarHBondContact O-CB 3.27Å; M224-A227 PolarHBondContact O-N 3.09Å; M224-A227 VanDerWaalsContact O-N 3.11Å; K225-A227 PolarHBondContact O-N 2.97Å
228	G	95.8	Very high	96.1	Very high	35 Å²	35	51.1 Å²	51.1	36%	0.361	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	26	176.3	0	0	0	0	0	114.6	M224 K225 R226 I230 S231	M224-G228 PolarHBondContact O-N 3.42Å; K225-G228 PolarHBondContact O-N 3.39Å; R226-G228 VanDerWaalsContact C-N 3.27Å; G228-I230 PolarHBondContact O-N 3.34Å; G228-S231 PolarHBondContact O-OG 3.23Å
229	V	97.2	Very high	95.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-27.9	-175.5	73.7	0	0	0	0	114.2	V180 L183 L211 M224 S231 L232 L233 Y261	V180-V229 HydrophobicContact CG1-CB 4.24Å; V180-V229 HydrophobicContact CG2-CB 4.06Å; V180-V229 HydrophobicContact CG2-CG2 4.1Å; L183-V229 HydrophobicContact CD2-CG2 4.16Å; L211-V229 HydrophobicContact CD1-CG2 4.08Å; M224-V229 HydrophobicContact CB-CB 4.28Å; M224-V229 HydrophobicContact CB-CG1 3.89Å; M224-V229 HydrophobicContact CE-CG2 4.41Å; M224-V229 WeakPolarHBondContact O-CB 3.27Å; M224-V229 WeakPolarHBondContact O-CG1 3.37Å; M224-V229 PolarHBondContact O-N 3.33Å; V229-S231 PolarHBondContact O-N 3.09Å; V229-L232 PolarHBondContact O-N 3.03Å; V229-L233 HydrophobicContact CG1-CD1 4.32Å; V229-L233 HydrophobicContact CG2-CD1 3.92Å; V229-L233 HydrophobicContact CG2-CD2 4.39Å; V229-L233 HydrophobicContact CG2-CG 3.9Å; V229-L233 WeakPolarHBondContact O-CG 3.37Å; V229-L233 PolarHBondContact O-N 2.77Å; V229-Y261 HydrophobicContact CG1-CE1 4.31Å
230	I	96.2	Very high	95.7	Very high	28 Å²	28	41.6 Å²	41.6	14%	0.144	22%	0.215	C	C	.	.	H	α-helix	trans	-59.6	-51.4	-170.4	-67.1	167.8	0	0	0	111.3	K225 G228 L232 L233 V234 Y261 A264 E268 M270	K225-I230 HydrophobicContact CD-CD1 4.38Å; K225-I230 HydrophobicContact CG-CD1 4Å; G228-I230 PolarHBondContact O-N 3.34Å; I230-L232 VanDerWaalsContact C-N 3.25Å; I230-L232 PolarHBondContact O-N 3.08Å; I230-L233 PolarHBondContact O-N 2.82Å; I230-L233 VanDerWaalsContact O-N 3.13Å; I230-V234 WeakPolarHBondContact O-CG2 3.39Å; I230-V234 PolarHBondContact O-N 3.39Å; I230-Y261 HydrophobicContact CG1-CE1 4.27Å; I230-A264 HydrophobicContact CD1-CB 3.77Å; I230-A264 HydrophobicContact CG1-CB 4.44Å; I230-A264 HydrophobicContact CG2-CB 4.28Å; I230-E268 HydrophobicContact CG2-CG 3.8Å; I230-M270 HydrophobicContact CG2-CE 3.91Å
231	S	95.6	Very high	95.4	Very high	77 Å²	77	44.1 Å²	44.1	54%	0.538	23%	0.227	S	C	.	.	H	α-helix	trans	-61.9	-34.6	-178.5	55.4	0	0	0	0	112.5	G228 V229 R235	G228-S231 PolarHBondContact O-OG 3.23Å; V229-S231 PolarHBondContact O-N 3.09Å; S231-R235 PolarHBondContact O-N 3.35Å
232	L	96.5	Very high	95.2	Very high	26 Å²	26	46.1 Å²	46.1	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-69	-42.9	175.6	-61.6	173.5	0	0	0	111.3	V180 L183 D184 V229 I230 R235 L236	V180-L232 HydrophobicContact CG1-CD1 3.75Å; V180-L232 VanDerWaalsContact O-CD1 3.29Å; V180-L232 WeakPolarHBondContact O-CD1 3.36Å; L183-L232 HydrophobicContact CB-CB 4.22Å; L183-L232 HydrophobicContact CB-CD1 4.07Å; D184-L232 HydrophobicContact CB-CD2 4.27Å; V229-L232 PolarHBondContact O-N 3.03Å; I230-L232 VanDerWaalsContact C-N 3.25Å; I230-L232 PolarHBondContact O-N 3.08Å; L232-R235 VanDerWaalsContact CD2-NH2 3.3Å; L232-R235 PolarHBondContact O-N 2.73Å; L232-L236 WeakPolarHBondContact O-CB 3.38Å; L232-L236 WeakPolarHBondContact O-CG 3.36Å; L232-L236 PolarHBondContact O-N 3.29Å
233	L	96.5	Very high	94.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-63.6	-40.3	175.9	-65.3	175.6	0	0	0	111.8	L183 V229 I230 R235 L236 L237 V248 T251 L252 M270	L183-L233 HydrophobicContact CD2-CD2 4.01Å; V229-L233 HydrophobicContact CG1-CD1 4.32Å; V229-L233 HydrophobicContact CG2-CD1 3.92Å; V229-L233 HydrophobicContact CG2-CD2 4.39Å; V229-L233 HydrophobicContact CG2-CG 3.9Å; V229-L233 WeakPolarHBondContact O-CG 3.37Å; V229-L233 PolarHBondContact O-N 2.77Å; I230-L233 PolarHBondContact O-N 2.82Å; I230-L233 VanDerWaalsContact O-N 3.13Å; L233-R235 VanDerWaalsContact C-N 3.27Å; L233-R235 PolarHBondContact O-N 2.93Å; L233-L236 PolarHBondContact O-N 2.82Å; L233-L237 WeakPolarHBondContact O-CB 3.43Å; L233-L237 WeakPolarHBondContact O-CG 3.41Å; L233-L237 PolarHBondContact O-N 3.35Å; L233-V248 HydrophobicContact CD2-CG1 3.93Å; L233-T251 HydrophobicContact CD1-CG2 4.44Å; L233-L252 HydrophobicContact CB-CD2 4.31Å; L233-L252 HydrophobicContact CD1-CD2 3.65Å; L233-L252 HydrophobicContact CD1-CG 4.14Å; L233-M270 HydrophobicContact CB-CE 4.21Å
234	V	95.9	Very high	94.8	Very high	18 Å²	18	47.9 Å²	47.9	11%	0.109	24%	0.243	C	C	.	.	H	α-helix	trans	-55.5	-45	174.1	177.4	0	0	0	0	110.8	I230 E268 M270	I230-V234 WeakPolarHBondContact O-CG2 3.39Å; I230-V234 PolarHBondContact O-N 3.39Å; V234-E268 HydrophobicContact CG2-CB 3.62Å; V234-E268 HydrophobicContact CG2-CG 4.15Å; V234-M270 HydrophobicContact CB-CE 4.23Å; V234-M270 HydrophobicContact CG2-CE 3.21Å; V234-M270 HydrophobicContact CG2-CG 4.09Å; V234-M270 HydrophobicContact CG2-SD 4.48Å
235	R	94.9	Very high	94.7	Very high	89 Å²	89	47.9 Å²	47.9	34%	0.336	24%	0.243	S	C	.	.	H	α-helix	trans	-69.8	-45.5	-179.5	-173.3	178.9	60.8	-176.8	-3.2	111.7	D184 S231 L232 L233 L237 K238	D184-R235 IonicContact OD1-CZ 3.78Å; D184-R235 VanDerWaalsContact OD1-CZ 3.27Å; D184-R235 IonicContact OD1-NH1 3.57Å; D184-R235 PolarHBondContact OD1-NH1 2.99Å; D184-R235 IonicContact OD1-NH2 2.67Å; D184-R235 PolarHBondContact OD1-NH2 3.31Å; S231-R235 PolarHBondContact O-N 3.35Å; L232-R235 VanDerWaalsContact CD2-NH2 3.3Å; L232-R235 PolarHBondContact O-N 2.73Å; L233-R235 VanDerWaalsContact C-N 3.27Å; L233-R235 PolarHBondContact O-N 2.93Å; R235-L237 VanDerWaalsContact C-N 3.34Å; R235-L237 PolarHBondContact O-N 3.08Å; R235-K238 PolarHBondContact O-N 3.35Å
236	L	95.6	Very high	94.7	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.6	-29.9	-178.1	-70.1	175.4	0	0	0	113.1	L183 L188 L232 L233 K238 S239 M244 L245 V248	L183-L236 HydrophobicContact CB-CD1 3.81Å; L183-L236 HydrophobicContact CD2-CD1 3.95Å; L183-L236 HydrophobicContact CG-CD1 3.74Å; L188-L236 HydrophobicContact CD1-CD2 3.97Å; L188-L236 HydrophobicContact CD2-CD2 4.13Å; L232-L236 WeakPolarHBondContact O-CB 3.38Å; L232-L236 WeakPolarHBondContact O-CG 3.36Å; L232-L236 PolarHBondContact O-N 3.29Å; L233-L236 PolarHBondContact O-N 2.82Å; L236-K238 PolarHBondContact O-N 3.47Å; L236-K238 VanDerWaalsContact O-N 3.12Å; L236-S239 WeakPolarHBondContact O-CB 3.4Å; L236-S239 PolarHBondContact O-N 3.24Å; L236-M244 HydrophobicContact CD2-CG 4.46Å; L236-M244 HydrophobicContact CD2-SD 4.33Å; L236-L245 WeakPolarHBondContact O-CD2 2.7Å; L236-V248 HydrophobicContact CB-CG1 4.09Å; L236-V248 HydrophobicContact CB-CG2 3.92Å; L236-V248 HydrophobicContact CD1-CG2 4Å
237	L	95.5	Very high	94.8	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.6	174.2	-87.7	177.5	0	0	0	114	L233 R235 S239 L245 V248 V249 L252 M270 D273 L274 N277	L233-L237 WeakPolarHBondContact O-CB 3.43Å; L233-L237 WeakPolarHBondContact O-CG 3.41Å; L233-L237 PolarHBondContact O-N 3.35Å; R235-L237 VanDerWaalsContact C-N 3.34Å; R235-L237 PolarHBondContact O-N 3.08Å; L237-S239 VanDerWaalsContact C-N 3.33Å; L237-L245 WeakPolarHBondContact O-CD2 3.16Å; L237-V248 HydrophobicContact CD2-CG1 4.14Å; L237-V248 HydrophobicContact CG-CG1 4.15Å; L237-V249 HydrophobicContact CD2-CG2 3.64Å; L237-L252 HydrophobicContact CD1-CD1 3.55Å; L237-L252 HydrophobicContact CD2-CD1 3.73Å; L237-L252 HydrophobicContact CG-CD1 3.78Å; L237-M270 HydrophobicContact CD1-CB 3.72Å; L237-M270 HydrophobicContact CD1-CG 3.7Å; L237-M270 HydrophobicContact CD1-SD 3.96Å; L237-D273 HydrophobicContact CB-CB 4.26Å; L237-L274 HydrophobicContact CD2-CD2 4.38Å; L237-N277 PolarHBondContact O-ND2 3.42Å
238	K	93.7	Very high	94.8	Very high	121 Å²	121	33.5 Å²	33.5	53%	0.526	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	4.7	178.5	-60	174.3	-175.5	175.7	0	112.7	R235 L236 D273	R235-K238 PolarHBondContact O-N 3.35Å; L236-K238 PolarHBondContact O-N 3.47Å; L236-K238 VanDerWaalsContact O-N 3.12Å; K238-D273 WeakPolarHBondContact CE-OD2 3.33Å
239	S	92.5	Very high	94.9	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.014	16%	0.164	C	C	.	.			trans	-62.3	141.4	-179.4	-175	0	0	0	0	111.6	L188 L236 L237 H241	L188-S239 WeakPolarHBondContact CD1-OG 3.26Å; L236-S239 WeakPolarHBondContact O-CB 3.4Å; L236-S239 PolarHBondContact O-N 3.24Å; L237-S239 VanDerWaalsContact C-N 3.33Å; S239-H241 PolarHBondContact O-N 3.16Å; S239-H241 PolarHBondContact OG-CD2 2.85Å; S239-H241 PolarHBondContact OG-N 3.4Å; S239-H241 VanDerWaalsContact OG-N 3.15Å
240	P	91.2	Very high	94.9	Very high	63 Å²	63	31.9 Å²	31.9	41%	0.409	16%	0.164	S	C	.	.	S	Bend	trans	-72.3	-14.7	169.7	29.7	-34	0	0	0	113	R280	P240-R280 PolarHBondContact O-NH1 2.81Å; P240-R280 PolarHBondContact O-NH2 3.06Å
241	H	91.2	Very high	95	Very high	53 Å²	53	30.6 Å²	30.6	25%	0.245	16%	0.158	C	C	.	.			trans	-90.7	110.2	-171.5	-55.5	-61.5	0	0	0	112.9	M193 I201 S239 N243 M244 L245	M193-H241 WeakPolarHBondContact CE-CE1 3.28Å; M193-H241 WeakPolarHBondContact CE-NE2 3.47Å; I201-H241 WeakPolarHBondContact CD1-NE2 3.47Å; S239-H241 PolarHBondContact O-N 3.16Å; S239-H241 PolarHBondContact OG-CD2 2.85Å; S239-H241 PolarHBondContact OG-N 3.4Å; S239-H241 VanDerWaalsContact OG-N 3.15Å; H241-N243 PolarHBondContact O-N 3.4Å; H241-M244 HydrophobicContact CB-CB 4.11Å; H241-M244 WeakPolarHBondContact O-CB 3.26Å; H241-M244 PolarHBondContact O-N 3.32Å; H241-M244 VanDerWaalsContact O-N 3.09Å; H241-L245 PolarHBondContact O-N 3.08Å; H241-L245 VanDerWaalsContact O-N 3.15Å
242	E	91.1	Very high	95.1	Very high	56 Å²	56	27 Å²	27	26%	0.262	13%	0.132	S	C	.	.	H	α-helix	trans	-62.1	-41	-176.7	-63	-178.3	178.6	0	0	113.1	M244 L245 I246 R280 N282	E242-M244 PolarHBondContact O-N 3.16Å; E242-M244 VanDerWaalsContact O-N 3.15Å; E242-L245 PolarHBondContact O-N 3.04Å; E242-I246 PolarHBondContact O-N 3.28Å; E242-I246 VanDerWaalsContact O-N 3.09Å; E242-R280 IonicContact OE1-CZ 3.36Å; E242-R280 VanDerWaalsContact OE1-CZ 3.24Å; E242-R280 IonicContact OE1-NE 3.23Å; E242-R280 PolarHBondContact OE1-NE 3.44Å; E242-R280 IonicContact OE1-NH2 2.79Å; E242-R280 PolarHBondContact OE1-NH2 3.37Å; E242-N282 PolarHBondContact OE2-ND2 2.97Å
243	N	90.7	Very high	95.1	Very high	115 Å²	115	27.1 Å²	27.1	62%	0.615	13%	0.132	S	C	*	.	H	α-helix	trans	-61.2	-24.8	177.7	-64.3	-20.4	0	0	0	113.1	R205 H241 P247	R205-N243 WeakPolarHBondContact CD-O 3.05Å; R205-N243 WeakPolarHBondContact CG-O 3.42Å; H241-N243 PolarHBondContact O-N 3.4Å; N243-P247 VanDerWaalsContact O-CD 3.24Å; N243-P247 WeakPolarHBondContact O-CD 3.47Å
244	M	93.8	Very high	95.2	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-79.8	-41.8	171.4	176.3	67.2	72.8	0	0	111.4	I201 A204 R205 L236 H241 E242 I246 P247 V248	I201-M244 HydrophobicContact CG2-CE 3.79Å; I201-M244 WeakPolarHBondContact O-CE 3.38Å; A204-M244 HydrophobicContact CB-CE 3.66Å; R205-M244 HydrophobicContact CB-CE 3.78Å; R205-M244 HydrophobicContact CB-SD 4.08Å; L236-M244 HydrophobicContact CD2-CG 4.46Å; L236-M244 HydrophobicContact CD2-SD 4.33Å; H241-M244 HydrophobicContact CB-CB 4.11Å; H241-M244 WeakPolarHBondContact O-CB 3.26Å; H241-M244 PolarHBondContact O-N 3.32Å; H241-M244 VanDerWaalsContact O-N 3.09Å; E242-M244 PolarHBondContact O-N 3.16Å; E242-M244 VanDerWaalsContact O-N 3.15Å; M244-I246 VanDerWaalsContact C-N 3.33Å; M244-I246 PolarHBondContact O-N 3.03Å; M244-P247 VanDerWaalsContact O-CD 3.27Å; M244-P247 WeakPolarHBondContact O-CD 3.27Å; M244-P247 WeakPolarHBondContact O-CG 3.37Å; M244-V248 HydrophobicContact CG-CG2 4.26Å; M244-V248 WeakPolarHBondContact O-CG2 3.18Å; M244-V248 PolarHBondContact O-N 3.22Å; M244-V248 HydrophobicContact SD-CG2 4.15Å
245	L	95.7	Very high	95.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.9	-38.8	-176.6	-69.1	174.4	0	0	0	112.1	L236 L237 H241 E242 V248 V249 L285	L236-L245 WeakPolarHBondContact O-CD2 2.7Å; L237-L245 WeakPolarHBondContact O-CD2 3.16Å; H241-L245 PolarHBondContact O-N 3.08Å; H241-L245 VanDerWaalsContact O-N 3.15Å; E242-L245 PolarHBondContact O-N 3.04Å; L245-V248 PolarHBondContact O-N 3.33Å; L245-V249 WeakPolarHBondContact O-CB 3.29Å; L245-V249 VanDerWaalsContact O-CG2 3.27Å; L245-V249 WeakPolarHBondContact O-CG2 3.47Å; L245-V249 PolarHBondContact O-N 2.92Å; L245-L285 HydrophobicContact CB-CD1 3.68Å; L245-L285 HydrophobicContact CB-CD2 4.18Å; L245-L285 HydrophobicContact CD1-CD2 3.95Å
246	I	96.9	Very high	95.3	Very high	14 Å²	14	24 Å²	24	7%	0.072	12%	0.12	C	C	.	.	H	α-helix	trans	-52.8	-60.1	-178.9	-67.6	165.4	0	0	0	112.1	W212 E242 M244 V248 V249 G250 E284 L285	W212-I246 HydrophobicContact CH2-CG2 4.42Å; W212-I246 HydrophobicContact CZ3-CG2 4.05Å; E242-I246 PolarHBondContact O-N 3.28Å; E242-I246 VanDerWaalsContact O-N 3.09Å; M244-I246 VanDerWaalsContact C-N 3.33Å; M244-I246 PolarHBondContact O-N 3.03Å; I246-V248 VanDerWaalsContact C-N 3.3Å; I246-V248 PolarHBondContact O-N 2.77Å; I246-V249 PolarHBondContact O-N 2.93Å; I246-G250 PolarHBondContact O-N 3.32Å; I246-E284 HydrophobicContact CD1-CB 4.4Å; I246-E284 HydrophobicContact CD1-CG 4.4Å; I246-E284 HydrophobicContact CG2-CG 3.97Å; I246-E284 WeakPolarHBondContact CG2-OE1 3.47Å; I246-L285 HydrophobicContact CG1-CB 4.12Å
247	P	97.3	Very high	95.3	Very high	4 Å²	4	26.7 Å²	26.7	3%	0.026	14%	0.139	C	C	.	.	H	α-helix	trans	-67.9	-28	179.5	25.4	-34.8	0	0	0	113.8	R205 A208 L209 W212 N243 M244 T251	R205-P247 HydrophobicContact CG-CG 4.28Å; A208-P247 HydrophobicContact CB-CB 3.97Å; A208-P247 HydrophobicContact CB-CG 4.02Å; L209-P247 HydrophobicContact CB-CB 4.22Å; L209-P247 HydrophobicContact CD1-CB 4.29Å; W212-P247 HydrophobicContact CE3-CB 3.96Å; N243-P247 VanDerWaalsContact O-CD 3.24Å; N243-P247 WeakPolarHBondContact O-CD 3.47Å; M244-P247 VanDerWaalsContact O-CD 3.27Å; M244-P247 WeakPolarHBondContact O-CD 3.27Å; M244-P247 WeakPolarHBondContact O-CG 3.37Å; P247-T251 WeakPolarHBondContact O-CB 3.24Å; P247-T251 PolarHBondContact O-N 2.6Å; P247-T251 PolarHBondContact O-OG1 3.07Å
248	V	97.6	Very high	95.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.7	-48.6	175.9	168.8	0	0	0	0	110.7	A208 L233 L236 L237 M244 L245 I246 T251 L252	A208-V248 HydrophobicContact CB-CG2 3.92Å; L233-V248 HydrophobicContact CD2-CG1 3.93Å; L236-V248 HydrophobicContact CB-CG1 4.09Å; L236-V248 HydrophobicContact CB-CG2 3.92Å; L236-V248 HydrophobicContact CD1-CG2 4Å; L237-V248 HydrophobicContact CD2-CG1 4.14Å; L237-V248 HydrophobicContact CG-CG1 4.15Å; M244-V248 HydrophobicContact CG-CG2 4.26Å; M244-V248 WeakPolarHBondContact O-CG2 3.18Å; M244-V248 PolarHBondContact O-N 3.22Å; M244-V248 HydrophobicContact SD-CG2 4.15Å; L245-V248 PolarHBondContact O-N 3.33Å; I246-V248 VanDerWaalsContact C-N 3.3Å; I246-V248 PolarHBondContact O-N 2.77Å; V248-T251 WeakPolarHBondContact O-CB 3.13Å; V248-T251 PolarHBondContact O-N 2.98Å; V248-L252 PolarHBondContact O-N 3.39Å; V248-L252 VanDerWaalsContact O-N 3.12Å
249	V	97.8	Very high	95.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-70.3	-39.3	177.6	-178.1	0	0	0	0	110.5	L237 L245 I246 T251 L252 Q253 L274 L285 H288 C289	L237-V249 HydrophobicContact CD2-CG2 3.64Å; L245-V249 WeakPolarHBondContact O-CB 3.29Å; L245-V249 VanDerWaalsContact O-CG2 3.27Å; L245-V249 WeakPolarHBondContact O-CG2 3.47Å; L245-V249 PolarHBondContact O-N 2.92Å; I246-V249 PolarHBondContact O-N 2.93Å; V249-T251 VanDerWaalsContact C-N 3.28Å; V249-T251 PolarHBondContact O-N 3.43Å; V249-L252 CarbonylContact O-C 3.58Å; V249-L252 WeakPolarHBondContact O-CA 3.26Å; V249-L252 WeakPolarHBondContact O-CB 3.47Å; V249-L252 PolarHBondContact O-N 3.15Å; V249-Q253 PolarHBondContact O-N 3.47Å; V249-L274 HydrophobicContact CG1-CD2 3.92Å; V249-L274 HydrophobicContact CG2-CD2 4.36Å; V249-L285 HydrophobicContact CB-CD1 4.4Å; V249-L285 HydrophobicContact CG2-CD1 3.89Å; V249-H288 HydrophobicContact CB-CB 4.15Å; V249-H288 VanDerWaalsContact CG1-C 3.45Å; V249-H288 HydrophobicContact CG1-CB 3.63Å; V249-C289 HydrophobicContact CG1-CB 4.45Å
250	G	97.4	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.6	-41.3	172.6	0	0	0	0	0	112.3	W212 I246 L252 Q253 E254	W212-G250 PolarHBondContact NE1-O 2.71Å; I246-G250 PolarHBondContact O-N 3.32Å; G250-L252 PolarHBondContact O-N 3.16Å; G250-Q253 WeakPolarHBondContact O-CB 3.38Å; G250-Q253 PolarHBondContact O-N 3.16Å; G250-E254 PolarHBondContact O-N 3.35Å; G250-E254 VanDerWaalsContact O-N 3.08Å
251	T	97.8	Very high	95.7	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-44	172.5	-59	0	0	0	0	111.8	W212 M224 L233 P247 V248 V249 E254 C255	W212-T251 VanDerWaalsContact CA-OG1 3.27Å; W212-T251 WeakPolarHBondContact CA-OG1 3.43Å; W212-T251 WeakPolarHBondContact CB-OG1 3.3Å; W212-T251 PolarHBondContact N-OG1 3.19Å; M224-T251 HydrophobicContact CE-CG2 3.49Å; M224-T251 VanDerWaalsContact CE-CG2 3.49Å; L233-T251 HydrophobicContact CD1-CG2 4.44Å; P247-T251 WeakPolarHBondContact O-CB 3.24Å; P247-T251 PolarHBondContact O-N 2.6Å; P247-T251 PolarHBondContact O-OG1 3.07Å; V248-T251 WeakPolarHBondContact O-CB 3.13Å; V248-T251 PolarHBondContact O-N 2.98Å; V249-T251 VanDerWaalsContact C-N 3.28Å; V249-T251 PolarHBondContact O-N 3.43Å; T251-E254 PolarHBondContact O-N 3.33Å; T251-C255 VanDerWaalsContact O-CB 3.3Å; T251-C255 WeakPolarHBondContact O-CB 3.28Å; T251-C255 PolarHBondContact O-N 3.22Å; T251-C255 PolarHBondContact O-SG 3.33Å; T251-C255 VanDerWaalsContact O-SG 3.38Å
252	L	97.6	Very high	96	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-64.5	-41.8	177.4	-71.9	167.7	0	0	0	112.2	L233 L237 V248 V249 G250 E254 C255 A256 I265 M270 T292	L233-L252 HydrophobicContact CB-CD2 4.31Å; L233-L252 HydrophobicContact CD1-CD2 3.65Å; L233-L252 HydrophobicContact CD1-CG 4.14Å; L237-L252 HydrophobicContact CD1-CD1 3.55Å; L237-L252 HydrophobicContact CD2-CD1 3.73Å; L237-L252 HydrophobicContact CG-CD1 3.78Å; V248-L252 PolarHBondContact O-N 3.39Å; V248-L252 VanDerWaalsContact O-N 3.12Å; V249-L252 CarbonylContact O-C 3.58Å; V249-L252 WeakPolarHBondContact O-CA 3.26Å; V249-L252 WeakPolarHBondContact O-CB 3.47Å; V249-L252 PolarHBondContact O-N 3.15Å; G250-L252 PolarHBondContact O-N 3.16Å; L252-E254 VanDerWaalsContact C-N 3.35Å; L252-E254 PolarHBondContact O-N 3.05Å; L252-C255 PolarHBondContact O-N 3.14Å; L252-A256 VanDerWaalsContact O-CB 3.28Å; L252-A256 WeakPolarHBondContact O-CB 3.28Å; L252-A256 PolarHBondContact O-N 3.21Å; L252-I265 HydrophobicContact CD2-CD1 4.25Å; L252-I265 HydrophobicContact CD2-CG1 4.11Å; L252-M270 HydrophobicContact CD1-SD 4.26Å; L252-M270 HydrophobicContact CD2-CE 4.35Å; L252-M270 HydrophobicContact CD2-SD 3.78Å; L252-T292 HydrophobicContact CB-CG2 4.25Å
253	Q	97.5	Very high	96.2	Very high	29 Å²	29	26.3 Å²	26.3	14%	0.136	14%	0.138	C	C	.	.	H	α-helix	trans	-57.3	-47	175.9	-178.1	-164	2	0	0	111.1	V249 G250 A256 H288 S291 T292 K295	V249-Q253 PolarHBondContact O-N 3.47Å; G250-Q253 WeakPolarHBondContact O-CB 3.38Å; G250-Q253 PolarHBondContact O-N 3.16Å; Q253-A256 PolarHBondContact O-N 3.07Å; Q253-H288 PolarHBondContact OE1-ND1 3.38Å; Q253-S291 VanDerWaalsContact CD-CB 3.48Å; Q253-S291 PolarHBondContact NE2-OG 2.67Å; Q253-T292 WeakPolarHBondContact CA-OG1 3.28Å; Q253-T292 WeakPolarHBondContact CB-OG1 3.3Å; Q253-T292 PolarHBondContact N-OG1 3.2Å; Q253-K295 HydrophobicContact CG-CD 4.31Å; Q253-K295 WeakPolarHBondContact O-CD 3.39Å; Q253-K295 PolarHBondContact O-NZ 2.85Å
254	E	97	Very high	96.4	Very high	42 Å²	42	21.3 Å²	21.3	20%	0.196	11%	0.113	C	C	.	.	H	α-helix	trans	-65.9	-42.6	177.4	-71.9	-52.6	141	0	0	111.9	S215 K221 G250 T251 L252 A256 S257	S215-E254 WeakPolarHBondContact OG-CB 3.46Å; S215-E254 WeakPolarHBondContact OG-CG 3.47Å; K221-E254 WeakPolarHBondContact CE-O 3.41Å; K221-E254 PolarHBondContact NZ-O 3.47Å; G250-E254 PolarHBondContact O-N 3.35Å; G250-E254 VanDerWaalsContact O-N 3.08Å; T251-E254 PolarHBondContact O-N 3.33Å; L252-E254 VanDerWaalsContact C-N 3.35Å; L252-E254 PolarHBondContact O-N 3.05Å; E254-A256 VanDerWaalsContact C-N 3.34Å; E254-A256 PolarHBondContact O-N 3.49Å; E254-S257 PolarHBondContact O-OG 3.13Å
255	C	97.1	Very high	96.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-67	-30.9	178.2	-79.1	0	0	0	0	113.5	T251 L252 S257 E258 Y261	T251-C255 VanDerWaalsContact O-CB 3.3Å; T251-C255 WeakPolarHBondContact O-CB 3.28Å; T251-C255 PolarHBondContact O-N 3.22Å; T251-C255 PolarHBondContact O-SG 3.33Å; T251-C255 VanDerWaalsContact O-SG 3.38Å; L252-C255 PolarHBondContact O-N 3.14Å; C255-S257 PolarHBondContact O-N 3.38Å; C255-E258 PolarHBondContact O-N 3.45Å; C255-Y261 HydrophobicContact CB-CD1 3.59Å; C255-Y261 HydrophobicContact CB-CD2 4.03Å; C255-Y261 HydrophobicContact CB-CE1 3.81Å; C255-Y261 HydrophobicContact CB-CE2 4.25Å; C255-Y261 HydrophobicContact CB-CG 3.69Å; C255-Y261 VanDerWaalsContact O-CB 3.24Å; C255-Y261 WeakPolarHBondContact O-CB 3.48Å
256	A	96.6	Very high	96.6	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.8	-177.5	0	0	0	0	0	114.4	L252 Q253 E254 E258 R262 I265 K295	L252-A256 VanDerWaalsContact O-CB 3.28Å; L252-A256 WeakPolarHBondContact O-CB 3.28Å; L252-A256 PolarHBondContact O-N 3.21Å; Q253-A256 PolarHBondContact O-N 3.07Å; E254-A256 VanDerWaalsContact C-N 3.34Å; E254-A256 PolarHBondContact O-N 3.49Å; A256-E258 PolarHBondContact O-N 2.98Å; A256-R262 WeakPolarHBondContact O-CD 3.26Å; A256-R262 WeakPolarHBondContact O-CG 3.29Å; A256-I265 HydrophobicContact CB-CD1 4.06Å; A256-K295 HydrophobicContact CB-CB 3.8Å; A256-K295 HydrophobicContact CB-CD 4.23Å
257	S	94.7	Very high	96.5	Very high	57 Å²	57	27.9 Å²	27.9	40%	0.399	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-24	170.1	74.9	0	0	0	0	112.7	K221 E254 C255 R262	K221-S257 PolarHBondContact NZ-OG 3.2Å; E254-S257 PolarHBondContact O-OG 3.13Å; C255-S257 PolarHBondContact O-N 3.38Å; S257-R262 PolarHBondContact O-NH1 3.16Å
258	E	95	Very high	96.4	Very high	35 Å²	35	32.4 Å²	32.4	16%	0.164	17%	0.168	C	C	.	.	S	Bend	trans	-92.6	128.6	176.9	-56.6	-69	140.9	0	0	110	R218 K221 C255 A256 S260 Y261 R262	R218-E258 WeakPolarHBondContact CD-OE1 3.46Å; R218-E258 VanDerWaalsContact CG-OE1 3.32Å; R218-E258 WeakPolarHBondContact CG-OE1 3.11Å; R218-E258 IonicContact NE-OE1 2.69Å; R218-E258 IonicContact NE-OE2 2.71Å; R218-E258 PolarHBondContact NE-OE2 2.98Å; R218-E258 VanDerWaalsContact NE-OE2 3.14Å; K221-E258 HydrophobicContact CD-CG 3.81Å; C255-E258 PolarHBondContact O-N 3.45Å; A256-E258 PolarHBondContact O-N 2.98Å; E258-S260 PolarHBondContact O-N 3.25Å; E258-S260 VanDerWaalsContact O-N 3.13Å; E258-Y261 HydrophobicContact CB-CD2 4.2Å; E258-Y261 PolarHBondContact O-N 2.93Å; E258-R262 PolarHBondContact O-N 2.91Å; E258-R262 VanDerWaalsContact O-N 3.14Å
259	E	95.1	Very high	96.2	Very high	120 Å²	120	33.7 Å²	33.7	56%	0.561	18%	0.182	S	C	*	.	H	α-helix	trans	-50.6	-41.9	177.7	-174.1	-173.6	169.9	0	0	112.3	Y261 R262 I263	E259-Y261 PolarHBondContact O-N 3Å; E259-Y261 VanDerWaalsContact O-N 3.14Å; E259-R262 WeakPolarHBondContact O-CB 3.44Å; E259-R262 PolarHBondContact O-N 2.7Å; E259-I263 HydrophobicContact CG-CD1 4.16Å; E259-I263 WeakPolarHBondContact O-CG1 3.42Å; E259-I263 PolarHBondContact O-N 3.26Å
260	S	95.2	Very high	96.2	Very high	38 Å²	38	33.8 Å²	33.8	27%	0.266	18%	0.182	S	C	.	.	H	α-helix	trans	-65.6	-19.4	-178.6	88.5	0	0	0	0	114.5	K225 E258	K225-S260 PolarHBondContact NZ-O 3.38Å; K225-S260 PolarHBondContact NZ-OG 3.32Å; K225-S260 VanDerWaalsContact NZ-OG 3.09Å; E258-S260 PolarHBondContact O-N 3.25Å; E258-S260 VanDerWaalsContact O-N 3.13Å
261	Y	96.6	Very high	96.2	Very high	3 Å²	3	33.9 Å²	33.9	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-89.8	-36.2	170.8	-89.6	-84.6	0	0	0	111.2	K221 K225 V229 I230 C255 E258 E259 I263 A264 I265	K221-Y261 HydrophobicContact CB-CE2 3.95Å; K221-Y261 WeakPolarHBondContact O-CE2 3.29Å; K221-Y261 PolarHBondContact O-OH 3.33Å; K225-Y261 HydrophobicContact CB-CE2 4.15Å; K225-Y261 HydrophobicContact CD-CE2 4.42Å; K225-Y261 PolarHBondContact N-OH 3.32Å; V229-Y261 HydrophobicContact CG1-CE1 4.31Å; I230-Y261 HydrophobicContact CG1-CE1 4.27Å; C255-Y261 HydrophobicContact CB-CD1 3.59Å; C255-Y261 HydrophobicContact CB-CD2 4.03Å; C255-Y261 HydrophobicContact CB-CE1 3.81Å; C255-Y261 HydrophobicContact CB-CE2 4.25Å; C255-Y261 HydrophobicContact CB-CG 3.69Å; C255-Y261 VanDerWaalsContact O-CB 3.24Å; C255-Y261 WeakPolarHBondContact O-CB 3.48Å; E258-Y261 HydrophobicContact CB-CD2 4.2Å; E258-Y261 PolarHBondContact O-N 2.93Å; E259-Y261 PolarHBondContact O-N 3Å; E259-Y261 VanDerWaalsContact O-N 3.14Å; Y261-I263 VanDerWaalsContact C-N 3.29Å; Y261-I263 PolarHBondContact O-N 3.47Å; Y261-A264 PolarHBondContact O-N 3.17Å; Y261-A264 VanDerWaalsContact O-N 3.12Å; Y261-I265 VanDerWaalsContact O-CG1 3.28Å; Y261-I265 WeakPolarHBondContact O-CG1 3.49Å; Y261-I265 PolarHBondContact O-N 3.28Å
262	R	96.5	Very high	96.2	Very high	26 Å²	26	35 Å²	35	10%	0.098	19%	0.19	C	C	.	.	H	α-helix	trans	-57	-44.4	171.9	-62.4	-164.2	-63.1	-96.5	11.3	111.5	A256 S257 E258 E259 A264 I265 R266 K295 E298 E299	A256-R262 WeakPolarHBondContact O-CD 3.26Å; A256-R262 WeakPolarHBondContact O-CG 3.29Å; S257-R262 PolarHBondContact O-NH1 3.16Å; E258-R262 PolarHBondContact O-N 2.91Å; E258-R262 VanDerWaalsContact O-N 3.14Å; E259-R262 WeakPolarHBondContact O-CB 3.44Å; E259-R262 PolarHBondContact O-N 2.7Å; R262-A264 VanDerWaalsContact C-N 3.34Å; R262-A264 PolarHBondContact O-N 3.46Å; R262-I265 PolarHBondContact O-N 2.86Å; R262-R266 WeakPolarHBondContact O-CB 3.23Å; R262-R266 PolarHBondContact O-N 2.9Å; R262-K295 VanDerWaalsContact CD-O 3.26Å; R262-K295 WeakPolarHBondContact CD-O 3.43Å; R262-E298 IonicContact CZ-OE2 3.82Å; R262-E298 IonicContact NH1-OE2 3.93Å; R262-E298 IonicContact NH2-OE2 3.38Å; R262-E299 IonicContact CZ-OE1 3.28Å; R262-E299 IonicContact NE-OE1 3.37Å; R262-E299 PolarHBondContact NE-OE1 3.43Å; R262-E299 IonicContact NH2-OE1 2.65Å; R262-E299 PolarHBondContact NH2-OE1 3.01Å; R262-E299 VanDerWaalsContact NH2-OE1 3.1Å
263	I	96.1	Very high	96.2	Very high	66 Å²	66	35.5 Å²	35.5	34%	0.338	19%	0.193	S	C	.	.	H	α-helix	trans	-58.5	-47.3	174.8	-64.4	168.8	0	0	0	110.3	E259 Y261 R266 T267	E259-I263 HydrophobicContact CG-CD1 4.16Å; E259-I263 WeakPolarHBondContact O-CG1 3.42Å; E259-I263 PolarHBondContact O-N 3.26Å; Y261-I263 VanDerWaalsContact C-N 3.29Å; Y261-I263 PolarHBondContact O-N 3.47Å; I263-R266 WeakPolarHBondContact O-CB 3.33Å; I263-R266 PolarHBondContact O-N 3.47Å; I263-T267 HydrophobicContact CG2-CG2 4.16Å; I263-T267 WeakPolarHBondContact O-CG2 3.33Å; I263-T267 PolarHBondContact O-N 3.48Å; I263-T267 PolarHBondContact O-OG1 3.36Å; I263-T267 VanDerWaalsContact O-OG1 3.06Å
264	A	96.1	Very high	96.2	Very high	10 Å²	10	34.1 Å²	34.1	8%	0.083	19%	0.186	C	C	.	.	H	α-helix	trans	-64.4	-44.9	-179.8	0	0	0	0	0	112.8	I230 Y261 R262 R266 T267 E268	I230-A264 HydrophobicContact CD1-CB 3.77Å; I230-A264 HydrophobicContact CG1-CB 4.44Å; I230-A264 HydrophobicContact CG2-CB 4.28Å; Y261-A264 PolarHBondContact O-N 3.17Å; Y261-A264 VanDerWaalsContact O-N 3.12Å; R262-A264 VanDerWaalsContact C-N 3.34Å; R262-A264 PolarHBondContact O-N 3.46Å; A264-R266 PolarHBondContact O-N 3.32Å; A264-T267 PolarHBondContact O-N 3.21Å; A264-T267 PolarHBondContact O-OG1 3.12Å; A264-E268 WeakPolarHBondContact O-CB 3.45Å; A264-E268 WeakPolarHBondContact O-CG 3.34Å; A264-E268 PolarHBondContact O-N 3.19Å
265	I	96.7	Very high	96.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-56.3	-40.5	176	-70.1	166.9	0	0	0	110.3	L252 A256 Y261 R262 M270 I271 L274 T292	L252-I265 HydrophobicContact CD2-CD1 4.25Å; L252-I265 HydrophobicContact CD2-CG1 4.11Å; A256-I265 HydrophobicContact CB-CD1 4.06Å; Y261-I265 VanDerWaalsContact O-CG1 3.28Å; Y261-I265 WeakPolarHBondContact O-CG1 3.49Å; Y261-I265 PolarHBondContact O-N 3.28Å; R262-I265 PolarHBondContact O-N 2.86Å; I265-M270 HydrophobicContact CB-SD 4.24Å; I265-M270 HydrophobicContact CG1-SD 3.82Å; I265-M270 HydrophobicContact CG2-CB 3.98Å; I265-M270 WeakPolarHBondContact O-CB 3.37Å; I265-M270 PolarHBondContact O-N 2.68Å; I265-M270 VanDerWaalsContact O-N 3.15Å; I265-I271 HydrophobicContact CG2-CD1 3.64Å; I265-I271 HydrophobicContact CG2-CG1 4.32Å; I265-L274 HydrophobicContact CG2-CD1 4.31Å; I265-T292 HydrophobicContact CD1-CG2 4.33Å
266	R	95.1	Very high	96.2	Very high	56 Å²	56	37.8 Å²	37.8	21%	0.211	20%	0.202	C	C	.	.	H	α-helix	trans	-68	-54.2	176	179.3	177	63.8	-156.6	-3.8	112.2	R262 I263 A264 E268 G269 E301 L305	R262-R266 WeakPolarHBondContact O-CB 3.23Å; R262-R266 PolarHBondContact O-N 2.9Å; I263-R266 WeakPolarHBondContact O-CB 3.33Å; I263-R266 PolarHBondContact O-N 3.47Å; A264-R266 PolarHBondContact O-N 3.32Å; R266-E268 PolarHBondContact O-N 3.34Å; R266-G269 PolarHBondContact O-N 3.1Å; R266-E301 IonicContact CZ-OE2 3.01Å; R266-E301 IonicContact NH1-OE2 3.14Å; R266-E301 PolarHBondContact NH1-OE2 2.91Å; R266-L305 HydrophobicContact CG-CD1 3.68Å
267	T	95.1	Very high	96.2	Very high	96 Å²	96	38.3 Å²	38.3	59%	0.589	21%	0.205	S	C	*	.	H	α-helix	trans	-71.4	-28.9	-172	54.9	0	0	0	0	113.4	I263 A264 G269	I263-T267 HydrophobicContact CG2-CG2 4.16Å; I263-T267 WeakPolarHBondContact O-CG2 3.33Å; I263-T267 PolarHBondContact O-N 3.48Å; I263-T267 PolarHBondContact O-OG1 3.36Å; I263-T267 VanDerWaalsContact O-OG1 3.06Å; A264-T267 PolarHBondContact O-N 3.21Å; A264-T267 PolarHBondContact O-OG1 3.12Å; T267-G269 VanDerWaalsContact C-N 3.27Å; T267-G269 PolarHBondContact O-N 3.24Å
268	E	95.4	Very high	96.3	Very high	99 Å²	99	35.7 Å²	35.7	46%	0.463	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	5.6	179.9	-61.1	-69	158.9	0	0	113.2	I230 V234 A264 R266 M270	I230-E268 HydrophobicContact CG2-CG 3.8Å; V234-E268 HydrophobicContact CG2-CB 3.62Å; V234-E268 HydrophobicContact CG2-CG 4.15Å; A264-E268 WeakPolarHBondContact O-CB 3.45Å; A264-E268 WeakPolarHBondContact O-CG 3.34Å; A264-E268 PolarHBondContact O-N 3.19Å; R266-E268 PolarHBondContact O-N 3.34Å; E268-M270 VanDerWaalsContact C-N 3.27Å; E268-M270 HydrophobicContact CB-CE 4.33Å; E268-M270 HydrophobicContact CB-CG 4.23Å; E268-M270 PolarHBondContact O-N 3.31Å
269	G	94.6	Very high	96.3	Very high	27 Å²	27	40.3 Å²	40.3	28%	0.278	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	12.4	176.9	0	0	0	0	0	115.1	R266 T267 I271 S272	R266-G269 PolarHBondContact O-N 3.1Å; T267-G269 VanDerWaalsContact C-N 3.27Å; T267-G269 PolarHBondContact O-N 3.24Å; G269-I271 PolarHBondContact O-N 2.69Å; G269-S272 PolarHBondContact O-N 3.45Å; G269-S272 VanDerWaalsContact O-N 3.17Å
270	M	97.5	Very high	96.3	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-63	-24.9	-176.8	-61.9	-177.8	-179.8	0	0	112.9	I230 L233 V234 L237 L252 I265 E268 S272 D273 L274	I230-M270 HydrophobicContact CG2-CE 3.91Å; L233-M270 HydrophobicContact CB-CE 4.21Å; V234-M270 HydrophobicContact CB-CE 4.23Å; V234-M270 HydrophobicContact CG2-CE 3.21Å; V234-M270 HydrophobicContact CG2-CG 4.09Å; V234-M270 HydrophobicContact CG2-SD 4.48Å; L237-M270 HydrophobicContact CD1-CB 3.72Å; L237-M270 HydrophobicContact CD1-CG 3.7Å; L237-M270 HydrophobicContact CD1-SD 3.96Å; L252-M270 HydrophobicContact CD1-SD 4.26Å; L252-M270 HydrophobicContact CD2-CE 4.35Å; L252-M270 HydrophobicContact CD2-SD 3.78Å; I265-M270 HydrophobicContact CB-SD 4.24Å; I265-M270 HydrophobicContact CG1-SD 3.82Å; I265-M270 HydrophobicContact CG2-CB 3.98Å; I265-M270 WeakPolarHBondContact O-CB 3.37Å; I265-M270 PolarHBondContact O-N 2.68Å; I265-M270 VanDerWaalsContact O-N 3.15Å; E268-M270 VanDerWaalsContact C-N 3.27Å; E268-M270 HydrophobicContact CB-CE 4.33Å; E268-M270 HydrophobicContact CB-CG 4.23Å; E268-M270 PolarHBondContact O-N 3.31Å; M270-S272 VanDerWaalsContact C-N 3.26Å; M270-S272 PolarHBondContact O-N 3.23Å; M270-D273 PolarHBondContact O-N 3.35Å; M270-D273 VanDerWaalsContact O-N 3.12Å; M270-L274 WeakPolarHBondContact O-CG 3.48Å; M270-L274 PolarHBondContact O-N 2.89Å
271	I	97.3	Very high	96.3	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-39	176.5	-57.5	-61.5	0	0	0	111.4	I265 G269 D273 L274 V275 T302 L305 V306 Y309	I265-I271 HydrophobicContact CG2-CD1 3.64Å; I265-I271 HydrophobicContact CG2-CG1 4.32Å; G269-I271 PolarHBondContact O-N 2.69Å; I271-D273 VanDerWaalsContact C-N 3.32Å; I271-D273 PolarHBondContact O-N 3.17Å; I271-L274 HydrophobicContact CD1-CD1 4.29Å; I271-L274 PolarHBondContact O-N 3.37Å; I271-V275 WeakPolarHBondContact O-CG2 3.35Å; I271-V275 PolarHBondContact O-N 3.11Å; I271-T302 HydrophobicContact CD1-CG2 3.86Å; I271-T302 HydrophobicContact CG1-CG2 4.47Å; I271-L305 HydrophobicContact CB-CB 4.43Å; I271-L305 HydrophobicContact CG1-CD1 4.4Å; I271-L305 HydrophobicContact CG2-CB 4Å; I271-V306 HydrophobicContact CG2-CG2 3.88Å; I271-Y309 HydrophobicContact CB-CD2 4.43Å; I271-Y309 HydrophobicContact CB-CE2 4.43Å; I271-Y309 HydrophobicContact CG2-CD2 4.08Å
272	S	97.2	Very high	96.2	Very high	25 Å²	25	44 Å²	44	18%	0.175	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-41	177.3	-172.2	0	0	0	0	111.6	G269 M270 V275 K276	G269-S272 PolarHBondContact O-N 3.45Å; G269-S272 VanDerWaalsContact O-N 3.17Å; M270-S272 VanDerWaalsContact C-N 3.26Å; M270-S272 PolarHBondContact O-N 3.23Å; S272-V275 PolarHBondContact O-N 2.87Å; S272-K276 WeakPolarHBondContact O-CG 3.37Å; S272-K276 PolarHBondContact O-N 2.93Å; S272-K276 VanDerWaalsContact O-N 3.09Å
273	D	97.1	Very high	96.2	Very high	12 Å²	12	45.5 Å²	45.5	6%	0.064	23%	0.231	C	C	.	.	H	α-helix	trans	-75	-36.1	-179	-61.8	-41.5	0	0	0	111.8	L237 K238 M270 I271 V275 K276 N277	L237-D273 HydrophobicContact CB-CB 4.26Å; K238-D273 WeakPolarHBondContact CE-OD2 3.33Å; M270-D273 PolarHBondContact O-N 3.35Å; M270-D273 VanDerWaalsContact O-N 3.12Å; I271-D273 VanDerWaalsContact C-N 3.32Å; I271-D273 PolarHBondContact O-N 3.17Å; D273-V275 VanDerWaalsContact C-N 3.33Å; D273-V275 PolarHBondContact O-N 3.45Å; D273-K276 PolarHBondContact O-N 3.11Å; D273-K276 IonicContact OD1-NZ 2.88Å; D273-K276 PolarHBondContact OD1-NZ 2.83Å; D273-N277 WeakPolarHBondContact O-CB 3.2Å; D273-N277 VanDerWaalsContact O-CG 3.29Å; D273-N277 PolarHBondContact O-N 3.02Å; D273-N277 PolarHBondContact O-ND2 3.41Å
274	L	97.7	Very high	96.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-43.4	170.3	-70.8	170	0	0	0	111.7	L237 V249 I265 M270 I271 K276 N277 L278 C289 T292 I293	L237-L274 HydrophobicContact CD2-CD2 4.38Å; V249-L274 HydrophobicContact CG1-CD2 3.92Å; V249-L274 HydrophobicContact CG2-CD2 4.36Å; I265-L274 HydrophobicContact CG2-CD1 4.31Å; M270-L274 WeakPolarHBondContact O-CG 3.48Å; M270-L274 PolarHBondContact O-N 2.89Å; I271-L274 HydrophobicContact CD1-CD1 4.29Å; I271-L274 PolarHBondContact O-N 3.37Å; L274-K276 PolarHBondContact O-N 2.97Å; L274-N277 PolarHBondContact O-N 3.47Å; L274-L278 PolarHBondContact O-N 2.92Å; L274-C289 HydrophobicContact CD2-CB 4.44Å; L274-T292 HydrophobicContact CD1-CG2 3.68Å; L274-T292 HydrophobicContact CD2-CG2 4.34Å; L274-I293 HydrophobicContact CB-CD1 4.43Å; L274-I293 HydrophobicContact CB-CG1 4.5Å; L274-I293 HydrophobicContact CD1-CG1 4.49Å
275	V	97.4	Very high	96.2	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-36.9	177.2	169.1	0	0	0	0	112.1	I271 S272 D273 I293 Y309 G311	I271-V275 WeakPolarHBondContact O-CG2 3.35Å; I271-V275 PolarHBondContact O-N 3.11Å; S272-V275 PolarHBondContact O-N 2.87Å; D273-V275 VanDerWaalsContact C-N 3.33Å; D273-V275 PolarHBondContact O-N 3.45Å; V275-I293 HydrophobicContact CG2-CD1 4.49Å; V275-Y309 VanDerWaalsContact CG1-O 3.29Å; V275-Y309 WeakPolarHBondContact CG1-O 3.38Å; V275-G311 VanDerWaalsContact CG1-CA 3.44Å
276	K	96.9	Very high	96.3	Very high	116 Å²	116	46.5 Å²	46.5	50%	0.504	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-43.2	172.5	-69.4	169.8	-162.8	159.3	0	111.3	S272 D273 L274 L278 K279	S272-K276 WeakPolarHBondContact O-CG 3.37Å; S272-K276 PolarHBondContact O-N 2.93Å; S272-K276 VanDerWaalsContact O-N 3.09Å; D273-K276 PolarHBondContact O-N 3.11Å; D273-K276 IonicContact OD1-NZ 2.88Å; D273-K276 PolarHBondContact OD1-NZ 2.83Å; L274-K276 PolarHBondContact O-N 2.97Å; K276-L278 VanDerWaalsContact C-N 3.33Å; K276-L278 PolarHBondContact O-N 2.88Å; K276-K279 WeakPolarHBondContact O-CB 3.33Å; K276-K279 PolarHBondContact O-N 3.34Å; K276-K279 VanDerWaalsContact O-N 3.13Å
277	N	97	Very high	96.4	Very high	11 Å²	11	45 Å²	45	6%	0.059	23%	0.229	C	C	.	.	H	α-helix	trans	-68.8	-28.5	-178.5	-71	-26.9	0	0	0	113	L237 D273 L274 K279 R280 L285 C289	L237-N277 PolarHBondContact O-ND2 3.42Å; D273-N277 WeakPolarHBondContact O-CB 3.2Å; D273-N277 VanDerWaalsContact O-CG 3.29Å; D273-N277 PolarHBondContact O-N 3.02Å; D273-N277 PolarHBondContact O-ND2 3.41Å; L274-N277 PolarHBondContact O-N 3.47Å; N277-K279 PolarHBondContact O-N 3.46Å; N277-R280 PolarHBondContact O-N 3.09Å; N277-L285 HydrophobicContact CB-CD2 4.38Å; N277-C289 VanDerWaalsContact CB-SG 3.6Å
278	L	96.6	Very high	96.5	Very high	2 Å²	2	41 Å²	41	1%	0.01	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26.3	169.9	-79.3	177.3	0	0	0	113.7	L274 K276 R280 Q286 C289 A290 I293 P314 L315 L318	L274-L278 PolarHBondContact O-N 2.92Å; K276-L278 VanDerWaalsContact C-N 3.33Å; K276-L278 PolarHBondContact O-N 2.88Å; L278-R280 VanDerWaalsContact C-N 3.34Å; L278-Q286 WeakPolarHBondContact CD2-O 3.31Å; L278-Q286 PolarHBondContact O-NE2 3.26Å; L278-C289 HydrophobicContact CD2-CB 3.59Å; L278-C289 HydrophobicContact CG-CB 3.87Å; L278-A290 HydrophobicContact CD2-CB 4.14Å; L278-I293 HydrophobicContact CD1-CD1 3.55Å; L278-I293 HydrophobicContact CG-CD1 4.34Å; L278-P314 HydrophobicContact CB-CB 4.22Å; L278-L315 HydrophobicContact CD1-CD2 3.83Å; L278-L315 HydrophobicContact CD1-CG 4.03Å; L278-L315 HydrophobicContact CD2-CD2 4.43Å; L278-L318 HydrophobicContact CD2-CD1 4.01Å
279	K	95.6	Very high	96.6	Very high	133 Å²	133	36.2 Å²	36.2	58%	0.578	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-7.9	-178	-61.6	179.4	179.8	-176.8	0	113.5	K276 N277 P314	K276-K279 WeakPolarHBondContact O-CB 3.33Å; K276-K279 PolarHBondContact O-N 3.34Å; K276-K279 VanDerWaalsContact O-N 3.13Å; N277-K279 PolarHBondContact O-N 3.46Å; K279-P314 HydrophobicContact CD-CG 4.27Å; K279-P314 VanDerWaalsContact CE-CG 3.42Å; K279-P314 HydrophobicContact CG-CB 4.2Å; K279-P314 HydrophobicContact CG-CG 3.83Å
280	R	95.2	Very high	96.8	Very high	73 Å²	73	35 Å²	35	28%	0.275	17%	0.168	S	C	.	.	S	Bend	trans	-78.9	146.4	177.5	-58.9	-172.3	71.5	130.7	2.5	110	P240 E242 N277 L278 N282 L285 Q286	P240-R280 PolarHBondContact O-NH1 2.81Å; P240-R280 PolarHBondContact O-NH2 3.06Å; E242-R280 IonicContact OE1-CZ 3.36Å; E242-R280 VanDerWaalsContact OE1-CZ 3.24Å; E242-R280 IonicContact OE1-NE 3.23Å; E242-R280 PolarHBondContact OE1-NE 3.44Å; E242-R280 IonicContact OE1-NH2 2.79Å; E242-R280 PolarHBondContact OE1-NH2 3.37Å; N277-R280 PolarHBondContact O-N 3.09Å; L278-R280 VanDerWaalsContact C-N 3.34Å; R280-N282 VanDerWaalsContact C-N 3.28Å; R280-N282 PolarHBondContact O-N 2.88Å; R280-L285 HydrophobicContact CB-CD2 4.37Å; R280-Q286 WeakPolarHBondContact O-CG 3.17Å; R280-Q286 PolarHBondContact O-NE2 2.76Å
281	D	93.8	Very high	96.8	Very high	134 Å²	134	35.5 Å²	35.5	72%	0.717	17%	0.171	S	C	*	.	S	Bend	trans	-85.7	67	-177.8	-165.6	28.7	0	0	0	112.2	K321	D281-K321 IonicContact OD1-NZ 3.73Å; D281-K321 PolarHBondContact OD1-NZ 3.36Å; D281-K321 VanDerWaalsContact OD1-NZ 3.15Å
282	N	95.3	Very high	96.9	Very high	32 Å²	32	35.4 Å²	35.4	17%	0.171	17%	0.171	C	C	.	.			trans	-141.5	108.1	175.5	-177	-55.5	0	0	0	109.4	E242 R280 E284 L285 Q286	E242-N282 PolarHBondContact OE2-ND2 2.97Å; R280-N282 VanDerWaalsContact C-N 3.28Å; R280-N282 PolarHBondContact O-N 2.88Å; N282-E284 VanDerWaalsContact C-N 3.34Å; N282-E284 PolarHBondContact O-N 3.12Å; N282-E284 PolarHBondContact OD1-N 2.68Å; N282-L285 HydrophobicContact CB-CB 3.99Å; N282-L285 PolarHBondContact O-N 3.37Å; N282-L285 PolarHBondContact OD1-N 2.93Å; N282-Q286 WeakPolarHBondContact O-CB 3.3Å; N282-Q286 VanDerWaalsContact O-CG 3.22Å; N282-Q286 WeakPolarHBondContact O-CG 3.4Å; N282-Q286 PolarHBondContact O-N 3.13Å
283	D	96	Very high	96.9	Very high	56 Å²	56	34.2 Å²	34.2	30%	0.299	16%	0.163	S	C	.	.	H	α-helix	trans	-57.9	-41.7	-173.7	-78.8	22.3	0	0	0	113.4	Q286 M287 K321 N324 L327	D283-Q286 PolarHBondContact O-N 3.01Å; D283-M287 VanDerWaalsContact O-CB 3.29Å; D283-M287 WeakPolarHBondContact O-CB 3.4Å; D283-M287 PolarHBondContact O-N 2.98Å; D283-K321 IonicContact OD1-NZ 3.71Å; D283-K321 PolarHBondContact OD1-NZ 3.48Å; D283-N324 PolarHBondContact OD2-ND2 3.14Å; D283-L327 HydrophobicContact CB-CD2 4.39Å
284	E	96	Very high	97	Very high	90 Å²	90	36.4 Å²	36.4	42%	0.421	17%	0.172	S	C	.	.	H	α-helix	trans	-66.9	-45.4	-179.5	-173.4	178.4	179.8	0	0	110.6	I246 N282 M287 H288	I246-E284 HydrophobicContact CD1-CB 4.4Å; I246-E284 HydrophobicContact CD1-CG 4.4Å; I246-E284 HydrophobicContact CG2-CG 3.97Å; I246-E284 WeakPolarHBondContact CG2-OE1 3.47Å; N282-E284 VanDerWaalsContact C-N 3.34Å; N282-E284 PolarHBondContact O-N 3.12Å; N282-E284 PolarHBondContact OD1-N 2.68Å; E284-M287 HydrophobicContact CG-CE 4.43Å; E284-M287 WeakPolarHBondContact O-CB 3.42Å; E284-M287 PolarHBondContact O-N 3.46Å; E284-H288 PolarHBondContact O-CD2 3.15Å; E284-H288 PolarHBondContact O-N 3.49Å; E284-H288 VanDerWaalsContact O-N 3.07Å
285	L	97.2	Very high	97	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-46.5	174.7	178.2	59.5	0	0	0	111.5	L245 I246 V249 N277 R280 N282 M287 H288 C289	L245-L285 HydrophobicContact CB-CD1 3.68Å; L245-L285 HydrophobicContact CB-CD2 4.18Å; L245-L285 HydrophobicContact CD1-CD2 3.95Å; I246-L285 HydrophobicContact CG1-CB 4.12Å; V249-L285 HydrophobicContact CB-CD1 4.4Å; V249-L285 HydrophobicContact CG2-CD1 3.89Å; N277-L285 HydrophobicContact CB-CD2 4.38Å; R280-L285 HydrophobicContact CB-CD2 4.37Å; N282-L285 HydrophobicContact CB-CB 3.99Å; N282-L285 PolarHBondContact O-N 3.37Å; N282-L285 PolarHBondContact OD1-N 2.93Å; L285-M287 VanDerWaalsContact C-N 3.28Å; L285-M287 PolarHBondContact O-N 3.43Å; L285-H288 PolarHBondContact O-N 2.8Å; L285-C289 WeakPolarHBondContact O-CB 3.5Å; L285-C289 PolarHBondContact O-N 2.9Å; L285-C289 PolarHBondContact O-SG 3.42Å; L285-C289 VanDerWaalsContact O-SG 3.35Å
286	Q	97.6	Very high	97	Very high	9 Å²	9	39.2 Å²	39.2	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-57.5	-43.5	177.4	-74.3	173.3	-20.2	0	0	111	L278 R280 N282 D283 C289 A290 L318 L327	L278-Q286 WeakPolarHBondContact CD2-O 3.31Å; L278-Q286 PolarHBondContact O-NE2 3.26Å; R280-Q286 WeakPolarHBondContact O-CG 3.17Å; R280-Q286 PolarHBondContact O-NE2 2.76Å; N282-Q286 WeakPolarHBondContact O-CB 3.3Å; N282-Q286 VanDerWaalsContact O-CG 3.22Å; N282-Q286 WeakPolarHBondContact O-CG 3.4Å; N282-Q286 PolarHBondContact O-N 3.13Å; D283-Q286 PolarHBondContact O-N 3.01Å; Q286-C289 PolarHBondContact O-N 2.94Å; Q286-A290 WeakPolarHBondContact O-CB 3.43Å; Q286-A290 PolarHBondContact O-N 2.72Å; Q286-L318 HydrophobicContact CB-CD1 4.25Å; Q286-L318 HydrophobicContact CG-CD1 4.36Å; Q286-L318 HydrophobicContact CG-CD2 4.28Å; Q286-L318 VanDerWaalsContact OE1-CD2 3.28Å; Q286-L327 HydrophobicContact CB-CD1 3.81Å
287	M	97.6	Very high	96.9	Very high	25 Å²	25	33.7 Å²	33.7	12%	0.123	16%	0.16	C	C	.	.	H	α-helix	trans	-61.8	-48.5	178.8	176.6	-172.5	72	0	0	111.8	D283 E284 L285 A290 S291 E326 L327 A330	D283-M287 VanDerWaalsContact O-CB 3.29Å; D283-M287 WeakPolarHBondContact O-CB 3.4Å; D283-M287 PolarHBondContact O-N 2.98Å; E284-M287 HydrophobicContact CG-CE 4.43Å; E284-M287 WeakPolarHBondContact O-CB 3.42Å; E284-M287 PolarHBondContact O-N 3.46Å; L285-M287 VanDerWaalsContact C-N 3.28Å; L285-M287 PolarHBondContact O-N 3.43Å; M287-A290 PolarHBondContact O-N 2.78Å; M287-S291 VanDerWaalsContact O-CB 3.3Å; M287-S291 WeakPolarHBondContact O-CB 3.44Å; M287-S291 PolarHBondContact O-N 3.31Å; M287-S291 PolarHBondContact O-OG 3.06Å; M287-E326 HydrophobicContact SD-CB 3.54Å; M287-E326 VanDerWaalsContact SD-CB 3.54Å; M287-L327 HydrophobicContact CB-CB 4.29Å; M287-L327 HydrophobicContact CB-CD1 3.91Å; M287-A330 HydrophobicContact CG-CB 4.15Å
288	H	97.7	Very high	96.8	Very high	10 Å²	10	38.1 Å²	38.1	5%	0.046	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-37	178.2	-66.6	-56.8	0	0	0	112	W212 V249 Q253 E284 L285 T292	W212-H288 AromaticContact CH2-CE1 3.47Å; W212-H288 VanDerWaalsContact CH2-CE1 3.47Å; W212-H288 WeakPolarHBondContact CH2-CE1 3.5Å; W212-H288 AromaticContact CH2-NE2 3.29Å; W212-H288 VanDerWaalsContact CH2-NE2 3.29Å; W212-H288 WeakPolarHBondContact CH2-NE2 3.43Å; W212-H288 AromaticContact CZ2-CE1 3.31Å; W212-H288 WeakPolarHBondContact CZ2-CE1 3.22Å; W212-H288 AromaticContact CZ2-NE2 3.67Å; V249-H288 HydrophobicContact CB-CB 4.15Å; V249-H288 VanDerWaalsContact CG1-C 3.45Å; V249-H288 HydrophobicContact CG1-CB 3.63Å; Q253-H288 PolarHBondContact OE1-ND1 3.38Å; E284-H288 PolarHBondContact O-CD2 3.15Å; E284-H288 PolarHBondContact O-N 3.49Å; E284-H288 VanDerWaalsContact O-N 3.07Å; L285-H288 PolarHBondContact O-N 2.8Å; H288-T292 WeakPolarHBondContact O-CB 3.4Å; H288-T292 PolarHBondContact O-N 3.46Å; H288-T292 PolarHBondContact O-OG1 3.15Å
289	C	98.1	Very high	96.7	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-49.1	174.6	-74.8	0	0	0	0	111.4	V249 L274 N277 L278 L285 Q286 S291 T292 I293	V249-C289 HydrophobicContact CG1-CB 4.45Å; L274-C289 HydrophobicContact CD2-CB 4.44Å; N277-C289 VanDerWaalsContact CB-SG 3.6Å; L278-C289 HydrophobicContact CD2-CB 3.59Å; L278-C289 HydrophobicContact CG-CB 3.87Å; L285-C289 WeakPolarHBondContact O-CB 3.5Å; L285-C289 PolarHBondContact O-N 2.9Å; L285-C289 PolarHBondContact O-SG 3.42Å; L285-C289 VanDerWaalsContact O-SG 3.35Å; Q286-C289 PolarHBondContact O-N 2.94Å; C289-S291 VanDerWaalsContact C-N 3.35Å; C289-S291 PolarHBondContact O-N 3.45Å; C289-T292 PolarHBondContact O-N 3.08Å; C289-I293 WeakPolarHBondContact O-CG1 3.49Å; C289-I293 PolarHBondContact O-N 3.31Å
290	A	98.4	Very high	96.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.7	-43.1	177.9	0	0	0	0	0	111.3	L278 Q286 M287 T292 I293 F294 L315 A330 V331	L278-A290 HydrophobicContact CD2-CB 4.14Å; Q286-A290 WeakPolarHBondContact O-CB 3.43Å; Q286-A290 PolarHBondContact O-N 2.72Å; M287-A290 PolarHBondContact O-N 2.78Å; A290-T292 VanDerWaalsContact C-N 3.33Å; A290-T292 PolarHBondContact O-N 3.3Å; A290-I293 PolarHBondContact O-N 3.26Å; A290-F294 WeakPolarHBondContact O-CB 3.38Å; A290-F294 PolarHBondContact O-N 2.91Å; A290-L315 HydrophobicContact CB-CD2 4.2Å; A290-A330 HydrophobicContact CB-CB 3.94Å; A290-V331 HydrophobicContact CB-CG2 3.93Å
291	S	98	Very high	96.8	Very high	13 Å²	13	37.6 Å²	37.6	9%	0.091	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-36.5	176.7	-64.4	0	0	0	0	113.2	Q253 M287 C289 F294 K295 A330	Q253-S291 VanDerWaalsContact CD-CB 3.48Å; Q253-S291 PolarHBondContact NE2-OG 2.67Å; M287-S291 VanDerWaalsContact O-CB 3.3Å; M287-S291 WeakPolarHBondContact O-CB 3.44Å; M287-S291 PolarHBondContact O-N 3.31Å; M287-S291 PolarHBondContact O-OG 3.06Å; C289-S291 VanDerWaalsContact C-N 3.35Å; C289-S291 PolarHBondContact O-N 3.45Å; S291-F294 WeakPolarHBondContact O-CB 3.34Å; S291-F294 PolarHBondContact O-N 3.48Å; S291-K295 PolarHBondContact O-N 3.11Å; S291-K295 VanDerWaalsContact O-N 3.09Å; S291-A330 WeakPolarHBondContact OG-CB 3.37Å
292	T	98.1	Very high	96.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.6	-45.1	174.5	-56	0	0	0	0	110.2	L252 Q253 I265 L274 H288 C289 A290 F294 K295 C296	L252-T292 HydrophobicContact CB-CG2 4.25Å; Q253-T292 WeakPolarHBondContact CA-OG1 3.28Å; Q253-T292 WeakPolarHBondContact CB-OG1 3.3Å; Q253-T292 PolarHBondContact N-OG1 3.2Å; I265-T292 HydrophobicContact CD1-CG2 4.33Å; L274-T292 HydrophobicContact CD1-CG2 3.68Å; L274-T292 HydrophobicContact CD2-CG2 4.34Å; H288-T292 WeakPolarHBondContact O-CB 3.4Å; H288-T292 PolarHBondContact O-N 3.46Å; H288-T292 PolarHBondContact O-OG1 3.15Å; C289-T292 PolarHBondContact O-N 3.08Å; A290-T292 VanDerWaalsContact C-N 3.33Å; A290-T292 PolarHBondContact O-N 3.3Å; T292-F294 VanDerWaalsContact C-N 3.35Å; T292-F294 PolarHBondContact O-N 3.22Å; T292-K295 PolarHBondContact O-N 3Å; T292-C296 WeakPolarHBondContact O-CB 3.07Å; T292-C296 PolarHBondContact O-N 2.82Å; T292-C296 PolarHBondContact O-SG 3.03Å
293	I	98.2	Very high	97	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.6	-43.4	175.4	-69.3	164.7	0	0	0	110.9	L274 V275 L278 C289 A290 K295 C296 A297 V306 A334	L274-I293 HydrophobicContact CB-CD1 4.43Å; L274-I293 HydrophobicContact CB-CG1 4.5Å; L274-I293 HydrophobicContact CD1-CG1 4.49Å; V275-I293 HydrophobicContact CG2-CD1 4.49Å; L278-I293 HydrophobicContact CD1-CD1 3.55Å; L278-I293 HydrophobicContact CG-CD1 4.34Å; C289-I293 WeakPolarHBondContact O-CG1 3.49Å; C289-I293 PolarHBondContact O-N 3.31Å; A290-I293 PolarHBondContact O-N 3.26Å; I293-K295 PolarHBondContact O-N 3.23Å; I293-C296 PolarHBondContact O-N 2.99Å; I293-A297 WeakPolarHBondContact O-CB 3.38Å; I293-A297 PolarHBondContact O-N 3.34Å; I293-V306 HydrophobicContact CG2-CG2 3.82Å; I293-A334 HydrophobicContact CB-CB 4.42Å; I293-A334 HydrophobicContact CG2-CB 4.06Å
294	F	98.1	Very high	97.1	Very high	57 Å²	57	31.2 Å²	31.2	25%	0.25	15%	0.152	C	C	.	.	H	α-helix	trans	-54.1	-50.2	176	174.4	-149.9	0	0	0	111.7	A290 S291 T292 G333 A334 K337	A290-F294 WeakPolarHBondContact O-CB 3.38Å; A290-F294 PolarHBondContact O-N 2.91Å; S291-F294 WeakPolarHBondContact O-CB 3.34Å; S291-F294 PolarHBondContact O-N 3.48Å; T292-F294 VanDerWaalsContact C-N 3.35Å; T292-F294 PolarHBondContact O-N 3.22Å; F294-G333 WeakPolarHBondContact CD2-O 3.47Å; F294-G333 WeakPolarHBondContact CE2-O 3.41Å; F294-A334 HydrophobicContact CB-CB 4.23Å; F294-K337 HydrophobicContact CD2-CB 4.28Å; F294-K337 HydrophobicContact CD2-CG 3.39Å; F294-K337 HydrophobicContact CE2-CD 4.2Å; F294-K337 HydrophobicContact CE2-CG 3.48Å; F294-K337 VanDerWaalsContact CE2-CG 3.48Å
295	K	97.4	Very high	97.2	Very high	62 Å²	62	28.9 Å²	28.9	27%	0.27	14%	0.142	S	C	.	.	H	α-helix	trans	-66.7	-35.3	177.5	-71.3	176.1	173.8	-179.9	0	112.9	Q253 A256 R262 S291 T292 I293	Q253-K295 HydrophobicContact CG-CD 4.31Å; Q253-K295 WeakPolarHBondContact O-CD 3.39Å; Q253-K295 PolarHBondContact O-NZ 2.85Å; A256-K295 HydrophobicContact CB-CB 3.8Å; A256-K295 HydrophobicContact CB-CD 4.23Å; R262-K295 VanDerWaalsContact CD-O 3.26Å; R262-K295 WeakPolarHBondContact CD-O 3.43Å; S291-K295 PolarHBondContact O-N 3.11Å; S291-K295 VanDerWaalsContact O-N 3.09Å; T292-K295 PolarHBondContact O-N 3Å; I293-K295 PolarHBondContact O-N 3.23Å
296	C	97.4	Very high	97.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-81.8	-25.3	-178.8	-66.2	0	0	0	0	114.2	T292 I293 E298 E299 T302	T292-C296 WeakPolarHBondContact O-CB 3.07Å; T292-C296 PolarHBondContact O-N 2.82Å; T292-C296 PolarHBondContact O-SG 3.03Å; I293-C296 PolarHBondContact O-N 2.99Å; C296-E298 PolarHBondContact O-N 3.05Å; C296-E298 VanDerWaalsContact O-N 3.14Å; C296-E299 PolarHBondContact O-N 3.02Å; C296-T302 HydrophobicContact CB-CG2 3.79Å; C296-T302 VanDerWaalsContact O-CB 3.24Å; C296-T302 WeakPolarHBondContact O-CB 3.34Å; C296-T302 WeakPolarHBondContact O-CG2 3.48Å; C296-T302 PolarHBondContact O-OG1 2.91Å
297	A	96.7	Very high	97.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	12.3	-178.2	0	0	0	0	0	113.8	I293 R303 K337	I293-A297 WeakPolarHBondContact O-CB 3.38Å; I293-A297 PolarHBondContact O-N 3.34Å; A297-R303 HydrophobicContact CB-CG 4.21Å; A297-R303 VanDerWaalsContact O-CZ 3.23Å; A297-R303 PolarHBondContact O-NE 3.21Å; A297-R303 PolarHBondContact O-NH2 3.39Å; A297-K337 HydrophobicContact CB-CB 3.62Å
298	E	93	Very high	97.2	Very high	105 Å²	105	35.6 Å²	35.6	49%	0.491	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.6	162.2	-171.7	164.6	-149.1	0	0	111.5	R262 C296 R303	R262-E298 IonicContact CZ-OE2 3.82Å; R262-E298 IonicContact NH1-OE2 3.93Å; R262-E298 IonicContact NH2-OE2 3.38Å; C296-E298 PolarHBondContact O-N 3.05Å; C296-E298 VanDerWaalsContact O-N 3.14Å; E298-R303 VanDerWaalsContact C-NH2 3.31Å; E298-R303 PolarHBondContact O-NH2 2.93Å
299	E	94.4	Very high	97.2	Very high	42 Å²	42	39.3 Å²	39.3	20%	0.196	19%	0.19	C	C	.	.	S	Bend	trans	-85.7	137	178.6	-51.4	-56.7	155.9	0	0	111.6	R262 C296 E301 T302 R303	R262-E299 IonicContact CZ-OE1 3.28Å; R262-E299 IonicContact NE-OE1 3.37Å; R262-E299 PolarHBondContact NE-OE1 3.43Å; R262-E299 IonicContact NH2-OE1 2.65Å; R262-E299 PolarHBondContact NH2-OE1 3.01Å; R262-E299 VanDerWaalsContact NH2-OE1 3.1Å; C296-E299 PolarHBondContact O-N 3.02Å; E299-E301 VanDerWaalsContact C-N 3.34Å; E299-E301 PolarHBondContact O-N 3.21Å; E299-T302 PolarHBondContact O-N 3.06Å; E299-R303 PolarHBondContact O-N 3.34Å
300	P	96.4	Very high	97.1	Very high	64 Å²	64	44.2 Å²	44.2	42%	0.416	22%	0.217	S	C	.	.	H	α-helix	trans	-60.7	-39.1	-179	23.5	-31.2	0	0	0	112.9	T302 R303 D304	P300-T302 VanDerWaalsContact C-N 3.31Å; P300-T302 PolarHBondContact O-N 3.24Å; P300-R303 WeakPolarHBondContact O-CB 3.31Å; P300-R303 PolarHBondContact O-N 3.19Å; P300-R303 VanDerWaalsContact O-N 3.14Å; P300-D304 PolarHBondContact O-N 2.98Å
301	E	96.7	Very high	97.1	Very high	91 Å²	91	44.2 Å²	44.2	43%	0.425	22%	0.217	S	C	.	.	H	α-helix	trans	-66.4	-34.6	-178.1	-56	76.8	-167.3	0	0	111.8	R266 E299 R303 D304 L305	R266-E301 IonicContact CZ-OE2 3.01Å; R266-E301 IonicContact NH1-OE2 3.14Å; R266-E301 PolarHBondContact NH1-OE2 2.91Å; E299-E301 VanDerWaalsContact C-N 3.34Å; E299-E301 PolarHBondContact O-N 3.21Å; E301-R303 VanDerWaalsContact C-N 3.32Å; E301-R303 PolarHBondContact O-N 3.37Å; E301-D304 PolarHBondContact O-N 3.44Å; E301-L305 WeakPolarHBondContact O-CG 3.42Å; E301-L305 PolarHBondContact O-N 2.84Å
302	T	96.8	Very high	97.1	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-40.6	175.8	-60.5	0	0	0	0	110.8	I271 C296 E299 P300 D304 L305 V306	I271-T302 HydrophobicContact CD1-CG2 3.86Å; I271-T302 HydrophobicContact CG1-CG2 4.47Å; C296-T302 HydrophobicContact CB-CG2 3.79Å; C296-T302 VanDerWaalsContact O-CB 3.24Å; C296-T302 WeakPolarHBondContact O-CB 3.34Å; C296-T302 WeakPolarHBondContact O-CG2 3.48Å; C296-T302 PolarHBondContact O-OG1 2.91Å; E299-T302 PolarHBondContact O-N 3.06Å; P300-T302 VanDerWaalsContact C-N 3.31Å; P300-T302 PolarHBondContact O-N 3.24Å; T302-D304 VanDerWaalsContact C-N 3.25Å; T302-D304 PolarHBondContact O-N 3.44Å; T302-L305 PolarHBondContact O-N 3.23Å; T302-V306 HydrophobicContact CG2-CG2 4.34Å; T302-V306 VanDerWaalsContact O-CG2 3.3Å; T302-V306 WeakPolarHBondContact O-CG2 3.18Å; T302-V306 PolarHBondContact O-N 3.42Å
303	R	97.9	Very high	97	Very high	28 Å²	28	49.5 Å²	49.5	11%	0.106	24%	0.24	C	C	.	.	H	α-helix	trans	-59.7	-39.8	177	-59.9	174	-175.3	129.9	13	111.2	A297 E298 E299 P300 E301 R307 K337 N344	A297-R303 HydrophobicContact CB-CG 4.21Å; A297-R303 VanDerWaalsContact O-CZ 3.23Å; A297-R303 PolarHBondContact O-NE 3.21Å; A297-R303 PolarHBondContact O-NH2 3.39Å; E298-R303 VanDerWaalsContact C-NH2 3.31Å; E298-R303 PolarHBondContact O-NH2 2.93Å; E299-R303 PolarHBondContact O-N 3.34Å; P300-R303 WeakPolarHBondContact O-CB 3.31Å; P300-R303 PolarHBondContact O-N 3.19Å; P300-R303 VanDerWaalsContact O-N 3.14Å; E301-R303 VanDerWaalsContact C-N 3.32Å; E301-R303 PolarHBondContact O-N 3.37Å; R303-R307 PolarHBondContact O-N 2.96Å; R303-K337 WeakPolarHBondContact CD-O 3.38Å; R303-K337 PolarHBondContact NE-O 2.8Å; R303-N344 PolarHBondContact O-ND2 3.22Å
304	D	97.3	Very high	97	Very high	59 Å²	59	50.1 Å²	50.1	32%	0.316	24%	0.244	S	C	.	.	H	α-helix	trans	-70.8	-39.1	177.4	-74.7	-36.7	0	0	0	112.6	P300 E301 T302 R307 T308	P300-D304 PolarHBondContact O-N 2.98Å; E301-D304 PolarHBondContact O-N 3.44Å; T302-D304 VanDerWaalsContact C-N 3.25Å; T302-D304 PolarHBondContact O-N 3.44Å; D304-R307 PolarHBondContact O-N 3.39Å; D304-R307 IonicContact OD1-CZ 3.73Å; D304-R307 IonicContact OD1-NE 3.66Å; D304-R307 IonicContact OD1-NH2 3.51Å; D304-R307 PolarHBondContact OD1-NH2 3.27Å; D304-T308 WeakPolarHBondContact O-CB 3.5Å; D304-T308 PolarHBondContact O-N 3.5Å; D304-T308 PolarHBondContact O-OG1 3.09Å
305	L	97.6	Very high	97	Very high	41 Å²	41	47.4 Å²	47.4	22%	0.215	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-42.4	175.3	-71.3	173	0	0	0	112	R266 I271 E301 T302 R307 T308 Y309	R266-L305 HydrophobicContact CG-CD1 3.68Å; I271-L305 HydrophobicContact CB-CB 4.43Å; I271-L305 HydrophobicContact CG1-CD1 4.4Å; I271-L305 HydrophobicContact CG2-CB 4Å; E301-L305 WeakPolarHBondContact O-CG 3.42Å; E301-L305 PolarHBondContact O-N 2.84Å; T302-L305 PolarHBondContact O-N 3.23Å; L305-R307 VanDerWaalsContact C-N 3.26Å; L305-R307 PolarHBondContact O-N 3.47Å; L305-T308 PolarHBondContact O-N 3.26Å; L305-T308 VanDerWaalsContact O-N 3.15Å; L305-Y309 HydrophobicContact CB-CD2 4.3Å; L305-Y309 HydrophobicContact CB-CE2 4.1Å; L305-Y309 HydrophobicContact CD2-CE2 3.91Å; L305-Y309 WeakPolarHBondContact O-CD2 3.43Å; L305-Y309 PolarHBondContact O-N 3.03Å
306	V	97.9	Very high	97	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-42.5	175.4	174.2	0	0	0	0	110.4	I271 I293 T302 G311 L312 L315	I271-V306 HydrophobicContact CG2-CG2 3.88Å; I293-V306 HydrophobicContact CG2-CG2 3.82Å; T302-V306 HydrophobicContact CG2-CG2 4.34Å; T302-V306 VanDerWaalsContact O-CG2 3.3Å; T302-V306 WeakPolarHBondContact O-CG2 3.18Å; T302-V306 PolarHBondContact O-N 3.42Å; V306-G311 WeakPolarHBondContact O-CA 3.29Å; V306-G311 PolarHBondContact O-N 3.01Å; V306-L312 HydrophobicContact CG1-CD2 3.8Å; V306-L315 HydrophobicContact CG1-CD1 4.34Å
307	R	97.5	Very high	97	Very high	85 Å²	85	47.6 Å²	47.6	32%	0.321	24%	0.244	S	C	.	.	H	α-helix	trans	-65.1	-47	173.3	176.9	176.4	53.8	102.7	2.3	112.2	R303 D304 L305 Y309 N310 L312 N344	R303-R307 PolarHBondContact O-N 2.96Å; D304-R307 PolarHBondContact O-N 3.39Å; D304-R307 IonicContact OD1-CZ 3.73Å; D304-R307 IonicContact OD1-NE 3.66Å; D304-R307 IonicContact OD1-NH2 3.51Å; D304-R307 PolarHBondContact OD1-NH2 3.27Å; L305-R307 VanDerWaalsContact C-N 3.26Å; L305-R307 PolarHBondContact O-N 3.47Å; R307-Y309 VanDerWaalsContact C-N 3.26Å; R307-Y309 PolarHBondContact O-N 3.01Å; R307-N310 PolarHBondContact O-N 3.46Å; R307-L312 HydrophobicContact CB-CD1 3.99Å; R307-L312 HydrophobicContact CB-CG 4.39Å; R307-L312 HydrophobicContact CG-CD1 4.1Å; R307-N344 VanDerWaalsContact CB-OD1 3.28Å; R307-N344 WeakPolarHBondContact CB-OD1 3.44Å; R307-N344 WeakPolarHBondContact CD-OD1 3.25Å; R307-N344 PolarHBondContact NE-OD1 3.34Å
308	T	97.3	Very high	97.1	Very high	89 Å²	89	48.1 Å²	48.1	55%	0.546	25%	0.247	S	C	.	.	H	α-helix	trans	-59.9	-35.7	-177.7	-58.3	0	0	0	0	112.2	D304 L305 N310	D304-T308 WeakPolarHBondContact O-CB 3.5Å; D304-T308 PolarHBondContact O-N 3.5Å; D304-T308 PolarHBondContact O-OG1 3.09Å; L305-T308 PolarHBondContact O-N 3.26Å; L305-T308 VanDerWaalsContact O-N 3.15Å; T308-N310 VanDerWaalsContact C-N 3.31Å; T308-N310 PolarHBondContact O-N 3.45Å
309	Y	97	Very high	97.3	Very high	89 Å²	89	43.2 Å²	43.2	35%	0.349	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	12.8	176.9	-60.7	-53.9	0	0	0	114	I271 V275 L305 R307 G311	I271-Y309 HydrophobicContact CB-CD2 4.43Å; I271-Y309 HydrophobicContact CB-CE2 4.43Å; I271-Y309 HydrophobicContact CG2-CD2 4.08Å; V275-Y309 VanDerWaalsContact CG1-O 3.29Å; V275-Y309 WeakPolarHBondContact CG1-O 3.38Å; L305-Y309 HydrophobicContact CB-CD2 4.3Å; L305-Y309 HydrophobicContact CB-CE2 4.1Å; L305-Y309 HydrophobicContact CD2-CE2 3.91Å; L305-Y309 WeakPolarHBondContact O-CD2 3.43Å; L305-Y309 PolarHBondContact O-N 3.03Å; R307-Y309 VanDerWaalsContact C-N 3.26Å; R307-Y309 PolarHBondContact O-N 3.01Å; Y309-G311 VanDerWaalsContact C-N 3.3Å; Y309-G311 PolarHBondContact O-N 3.26Å
310	N	97.1	Very high	97.3	Very high	103 Å²	103	45.4 Å²	45.4	55%	0.551	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	40.2	-178.2	-59.4	-37	0	0	0	113.2	R307 T308 P314	R307-N310 PolarHBondContact O-N 3.46Å; T308-N310 VanDerWaalsContact C-N 3.31Å; T308-N310 PolarHBondContact O-N 3.45Å; N310-P314 WeakPolarHBondContact O-CD 3.32Å
311	G	97.3	Very high	97.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.234	C	C	.	.			trans	-81.8	-17.2	177.8	0	0	0	0	0	114.7	V275 V306 Y309 P314 L315	V275-G311 VanDerWaalsContact CG1-CA 3.44Å; V306-G311 WeakPolarHBondContact O-CA 3.29Å; V306-G311 PolarHBondContact O-N 3.01Å; Y309-G311 VanDerWaalsContact C-N 3.3Å; Y309-G311 PolarHBondContact O-N 3.26Å; G311-P314 WeakPolarHBondContact O-CD 3.5Å; G311-L315 VanDerWaalsContact O-CG 3.3Å; G311-L315 WeakPolarHBondContact O-CG 3.28Å; G311-L315 PolarHBondContact O-N 2.94Å
312	L	98.1	Very high	96.9	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-68	-40.9	-179.6	-54.9	-177.7	0	0	0	112.2	V306 R307 L315 V316 C338 N344 Q347 F348 L351	V306-L312 HydrophobicContact CG1-CD2 3.8Å; R307-L312 HydrophobicContact CB-CD1 3.99Å; R307-L312 HydrophobicContact CB-CG 4.39Å; R307-L312 HydrophobicContact CG-CD1 4.1Å; L312-L315 PolarHBondContact O-N 2.94Å; L312-V316 VanDerWaalsContact O-CG2 3.31Å; L312-V316 WeakPolarHBondContact O-CG2 3.4Å; L312-V316 PolarHBondContact O-N 3.36Å; L312-C338 HydrophobicContact CD2-CB 4.08Å; L312-N344 HydrophobicContact CD1-CB 4.1Å; L312-Q347 HydrophobicContact CD1-CB 3.88Å; L312-Q347 HydrophobicContact CD1-CG 3.93Å; L312-F348 HydrophobicContact CB-CE1 4Å; L312-F348 HydrophobicContact CB-CZ 4.43Å; L312-F348 HydrophobicContact CD2-CE1 4.09Å; L312-F348 HydrophobicContact CD2-CE2 4.26Å; L312-F348 HydrophobicContact CD2-CZ 3.64Å; L312-F348 HydrophobicContact CG-CE1 4.46Å; L312-F348 HydrophobicContact CG-CZ 4.41Å; L312-L351 HydrophobicContact CB-CD1 4.39Å
313	E	97.6	Very high	96.7	Very high	120 Å²	120	49.6 Å²	49.6	56%	0.561	27%	0.269	S	S	*	.	H	α-helix	trans	-65.3	-47.4	179.9	175.1	-177.8	-167.7	0	0	112.7	L315 V316 A317 L351	E313-L315 VanDerWaalsContact C-N 3.32Å; E313-L315 PolarHBondContact O-N 2.9Å; E313-V316 PolarHBondContact O-N 3.18Å; E313-A317 PolarHBondContact O-N 3.45Å; E313-L351 HydrophobicContact CB-CD1 4.26Å; E313-L351 HydrophobicContact CB-CD2 4.31Å; E313-L351 HydrophobicContact CG-CD2 4.34Å
314	P	97.7	Very high	96.6	Very high	12 Å²	12	50.1 Å²	50.1	8%	0.078	27%	0.274	C	S	.	.	H	α-helix	trans	-56.1	-41.9	170.7	-28.6	35.8	0	0	0	113.6	L278 K279 N310 G311 V316 A317 L318	L278-P314 HydrophobicContact CB-CB 4.22Å; K279-P314 HydrophobicContact CD-CG 4.27Å; K279-P314 VanDerWaalsContact CE-CG 3.42Å; K279-P314 HydrophobicContact CG-CB 4.2Å; K279-P314 HydrophobicContact CG-CG 3.83Å; N310-P314 WeakPolarHBondContact O-CD 3.32Å; G311-P314 WeakPolarHBondContact O-CD 3.5Å; P314-V316 VanDerWaalsContact C-N 3.34Å; P314-V316 PolarHBondContact O-N 3.23Å; P314-A317 PolarHBondContact O-N 3.12Å; P314-L318 VanDerWaalsContact O-CG 3.28Å; P314-L318 WeakPolarHBondContact O-CG 3.33Å; P314-L318 PolarHBondContact O-N 3.32Å; P314-L318 VanDerWaalsContact O-N 3.16Å
315	L	98.1	Very high	96.5	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-43.6	177	-72.8	170.9	0	0	0	111.6	L278 A290 V306 G311 L312 E313 L318 V331 A334 I335	L278-L315 HydrophobicContact CD1-CD2 3.83Å; L278-L315 HydrophobicContact CD1-CG 4.03Å; L278-L315 HydrophobicContact CD2-CD2 4.43Å; A290-L315 HydrophobicContact CB-CD2 4.2Å; V306-L315 HydrophobicContact CG1-CD1 4.34Å; G311-L315 VanDerWaalsContact O-CG 3.3Å; G311-L315 WeakPolarHBondContact O-CG 3.28Å; G311-L315 PolarHBondContact O-N 2.94Å; L312-L315 PolarHBondContact O-N 2.94Å; E313-L315 VanDerWaalsContact C-N 3.32Å; E313-L315 PolarHBondContact O-N 2.9Å; L315-L318 PolarHBondContact O-N 3.27Å; L315-V331 WeakPolarHBondContact O-CG1 3.43Å; L315-A334 HydrophobicContact CD1-CB 4.1Å; L315-A334 HydrophobicContact CD2-CB 3.91Å; L315-I335 HydrophobicContact CB-CD1 4.46Å; L315-I335 HydrophobicContact CB-CG1 4.11Å
316	V	98.1	Very high	96.5	Very high	7 Å²	7	55.5 Å²	55.5	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-42.2	177.6	174.8	0	0	0	0	111.1	L312 E313 P314 L318 L319 F348 L351 T353 Q356	L312-V316 VanDerWaalsContact O-CG2 3.31Å; L312-V316 WeakPolarHBondContact O-CG2 3.4Å; L312-V316 PolarHBondContact O-N 3.36Å; E313-V316 PolarHBondContact O-N 3.18Å; P314-V316 VanDerWaalsContact C-N 3.34Å; P314-V316 PolarHBondContact O-N 3.23Å; V316-L318 PolarHBondContact O-N 3.44Å; V316-L319 VanDerWaalsContact O-CB 3.28Å; V316-L319 WeakPolarHBondContact O-CB 3.04Å; V316-L319 WeakPolarHBondContact O-CG 3.48Å; V316-L319 PolarHBondContact O-N 2.91Å; V316-F348 HydrophobicContact CG2-CD1 3.78Å; V316-F348 HydrophobicContact CG2-CE1 3.87Å; V316-L351 HydrophobicContact CG1-CB 4.38Å; V316-L351 HydrophobicContact CG2-CB 4.42Å; V316-L351 HydrophobicContact CG2-CD1 4.02Å; V316-T353 HydrophobicContact CG2-CG2 3.95Å; V316-T353 WeakPolarHBondContact CG2-OG1 3.33Å; V316-Q356 VanDerWaalsContact CG1-NE2 3.31Å
317	A	97.5	Very high	96.4	Very high	59 Å²	59	55.6 Å²	55.6	49%	0.488	30%	0.296	S	S	.	.	H	α-helix	trans	-58.9	-34.5	178.3	0	0	0	0	0	112.7	E313 P314 L319 S320	E313-A317 PolarHBondContact O-N 3.45Å; P314-A317 PolarHBondContact O-N 3.12Å; A317-L319 PolarHBondContact O-N 3.45Å; A317-S320 PolarHBondContact O-N 3.24Å; A317-S320 PolarHBondContact O-OG 3.1Å
318	L	97.4	Very high	96.4	Very high	11 Å²	11	51.5 Å²	51.5	6%	0.058	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-70.8	-14	178.6	-67	172.2	0	0	0	114.2	L278 Q286 P314 L315 V316 S320 K321 V331	L278-L318 HydrophobicContact CD2-CD1 4.01Å; Q286-L318 HydrophobicContact CB-CD1 4.25Å; Q286-L318 HydrophobicContact CG-CD1 4.36Å; Q286-L318 HydrophobicContact CG-CD2 4.28Å; Q286-L318 VanDerWaalsContact OE1-CD2 3.28Å; P314-L318 VanDerWaalsContact O-CG 3.28Å; P314-L318 WeakPolarHBondContact O-CG 3.33Å; P314-L318 PolarHBondContact O-N 3.32Å; P314-L318 VanDerWaalsContact O-N 3.16Å; L315-L318 PolarHBondContact O-N 3.27Å; V316-L318 PolarHBondContact O-N 3.44Å; L318-S320 PolarHBondContact O-N 3.35Å; L318-S320 VanDerWaalsContact O-N 3.16Å; L318-K321 HydrophobicContact CD2-CD 4.21Å; L318-K321 PolarHBondContact O-N 3.09Å; L318-K321 VanDerWaalsContact O-N 3.08Å; L318-V331 HydrophobicContact CB-CG1 4.14Å; L318-V331 HydrophobicContact CB-CG2 3.79Å; L318-V331 HydrophobicContact CD1-CG2 3.97Å
319	L	96.9	Very high	96.4	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.016	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-62	-20.4	173.1	-65.3	177.1	0	0	0	112.7	V316 A317 K321 Q322 L328 V331 T332 I335 T353 Q356 L357 L360	V316-L319 VanDerWaalsContact O-CB 3.28Å; V316-L319 WeakPolarHBondContact O-CB 3.04Å; V316-L319 WeakPolarHBondContact O-CG 3.48Å; V316-L319 PolarHBondContact O-N 2.91Å; A317-L319 PolarHBondContact O-N 3.45Å; L319-K321 VanDerWaalsContact C-N 3.27Å; L319-K321 PolarHBondContact O-N 2.85Å; L319-Q322 WeakPolarHBondContact O-CG 3.5Å; L319-L328 HydrophobicContact CD2-CD1 4.09Å; L319-V331 HydrophobicContact CD2-CG1 3.85Å; L319-V331 HydrophobicContact CG-CG1 4.35Å; L319-T332 HydrophobicContact CD2-CG2 3.82Å; L319-I335 HydrophobicContact CD1-CD1 3.87Å; L319-I335 HydrophobicContact CD2-CD1 3.83Å; L319-I335 HydrophobicContact CG-CD1 3.96Å; L319-T353 HydrophobicContact CD1-CG2 4.32Å; L319-Q356 HydrophobicContact CD1-CB 4.02Å; L319-L357 HydrophobicContact CD1-CD2 4.16Å; L319-L357 HydrophobicContact CD2-CD2 4.31Å; L319-L360 HydrophobicContact CD2-CD1 3.92Å
320	S	95.2	Very high	96.5	Very high	87 Å²	87	43.9 Å²	43.9	61%	0.608	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-67.5	-23	174.6	63.5	0	0	0	0	113.7	A317 L318 Q322	A317-S320 PolarHBondContact O-N 3.24Å; A317-S320 PolarHBondContact O-OG 3.1Å; L318-S320 PolarHBondContact O-N 3.35Å; L318-S320 VanDerWaalsContact O-N 3.16Å; S320-Q322 VanDerWaalsContact C-N 3.25Å; S320-Q322 PolarHBondContact O-N 2.98Å
321	K	93.2	Very high	96.6	Very high	46 Å²	46	39 Å²	39	20%	0.2	22%	0.219	C	C	.	.			trans	-82.6	56	-178	-66.8	-169.3	173.2	-173.7	0	112.7	D281 D283 L318 L319 S323 N324 L327	D281-K321 IonicContact OD1-NZ 3.73Å; D281-K321 PolarHBondContact OD1-NZ 3.36Å; D281-K321 VanDerWaalsContact OD1-NZ 3.15Å; D283-K321 IonicContact OD1-NZ 3.71Å; D283-K321 PolarHBondContact OD1-NZ 3.48Å; L318-K321 HydrophobicContact CD2-CD 4.21Å; L318-K321 PolarHBondContact O-N 3.09Å; L318-K321 VanDerWaalsContact O-N 3.08Å; L319-K321 VanDerWaalsContact C-N 3.27Å; L319-K321 PolarHBondContact O-N 2.85Å; K321-S323 PolarHBondContact O-N 3.22Å; K321-N324 PolarHBondContact O-N 2.88Å; K321-L327 HydrophobicContact CB-CD2 4.11Å; K321-L327 HydrophobicContact CD-CD2 3.79Å
322	Q	91	Very high	96.6	Very high	88 Å²	88	39 Å²	39	41%	0.411	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-14.1	-172.6	-58.8	-172.6	29.4	0	0	115.6	L319 S320 N324 K325 L360	L319-Q322 WeakPolarHBondContact O-CG 3.5Å; S320-Q322 VanDerWaalsContact C-N 3.25Å; S320-Q322 PolarHBondContact O-N 2.98Å; Q322-N324 VanDerWaalsContact C-N 3.34Å; Q322-K325 WeakPolarHBondContact O-CE 3.32Å; Q322-K325 PolarHBondContact O-NZ 3.49Å; Q322-L360 VanDerWaalsContact CD-CD2 3.43Å; Q322-L360 HydrophobicContact CG-CD2 3.75Å
323	S	93.7	Very high	96.6	Very high	110 Å²	110	38.8 Å²	38.8	77%	0.769	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-32.3	176.4	51.7	0	0	0	0	112.2	K321 K325	K321-S323 PolarHBondContact O-N 3.22Å; S323-K325 PolarHBondContact O-N 2.93Å
324	N	94.7	Very high	96.7	Very high	39 Å²	39	33.1 Å²	33.1	21%	0.209	19%	0.191	C	C	.	.			trans	-93.4	95.8	-179.5	-171.8	-23.2	0	0	0	110.3	D283 K321 Q322 E326 L327 L328	D283-N324 PolarHBondContact OD2-ND2 3.14Å; K321-N324 PolarHBondContact O-N 2.88Å; Q322-N324 VanDerWaalsContact C-N 3.34Å; N324-E326 PolarHBondContact O-N 2.86Å; N324-E326 PolarHBondContact OD1-N 2.88Å; N324-L327 HydrophobicContact CB-CB 3.96Å; N324-L327 HydrophobicContact CB-CD2 4.5Å; N324-L327 VanDerWaalsContact CG-CB 3.45Å; N324-L327 WeakPolarHBondContact OD1-CB 3.3Å; N324-L327 PolarHBondContact OD1-N 3.32Å; N324-L327 VanDerWaalsContact OD1-N 3.09Å; N324-L328 WeakPolarHBondContact O-CB 3.11Å; N324-L328 PolarHBondContact O-N 3.46Å
325	K	96.2	Very high	96.7	Very high	78 Å²	78	32.5 Å²	32.5	34%	0.339	19%	0.187	S	C	.	.	H	α-helix	trans	-67.8	-35.2	-173.7	-56.2	-52.1	-175.5	-174.6	0	113.2	Q322 S323 L328 A329 P365	Q322-K325 WeakPolarHBondContact O-CE 3.32Å; Q322-K325 PolarHBondContact O-NZ 3.49Å; S323-K325 PolarHBondContact O-N 2.93Å; K325-L328 PolarHBondContact O-N 2.85Å; K325-A329 WeakPolarHBondContact O-CB 3.5Å; K325-A329 PolarHBondContact O-N 3.42Å; K325-P365 HydrophobicContact CB-CG 4.17Å; K325-P365 HydrophobicContact CD-CG 4.19Å; K325-P365 HydrophobicContact CG-CG 4.04Å
326	E	96.1	Very high	96.7	Very high	136 Å²	136	34.4 Å²	34.4	64%	0.636	19%	0.194	S	C	*	.	H	α-helix	trans	-69.1	-45	178.6	-61.7	-178.5	-178.6	0	0	111.1	M287 N324 L328 A329 A330	M287-E326 HydrophobicContact SD-CB 3.54Å; M287-E326 VanDerWaalsContact SD-CB 3.54Å; N324-E326 PolarHBondContact O-N 2.86Å; N324-E326 PolarHBondContact OD1-N 2.88Å; E326-L328 VanDerWaalsContact C-N 3.32Å; E326-L328 PolarHBondContact O-N 2.81Å; E326-A329 PolarHBondContact O-N 3.22Å; E326-A330 PolarHBondContact O-N 3.33Å
327	L	97.3	Very high	96.7	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-59	-45.5	171.9	174.6	59.9	0	0	0	111	D283 Q286 M287 K321 N324 A329 A330 V331	D283-L327 HydrophobicContact CB-CD2 4.39Å; Q286-L327 HydrophobicContact CB-CD1 3.81Å; M287-L327 HydrophobicContact CB-CB 4.29Å; M287-L327 HydrophobicContact CB-CD1 3.91Å; K321-L327 HydrophobicContact CB-CD2 4.11Å; K321-L327 HydrophobicContact CD-CD2 3.79Å; N324-L327 HydrophobicContact CB-CB 3.96Å; N324-L327 HydrophobicContact CB-CD2 4.5Å; N324-L327 VanDerWaalsContact CG-CB 3.45Å; N324-L327 WeakPolarHBondContact OD1-CB 3.3Å; N324-L327 PolarHBondContact OD1-N 3.32Å; N324-L327 VanDerWaalsContact OD1-N 3.09Å; L327-A329 VanDerWaalsContact C-N 3.34Å; L327-A329 PolarHBondContact O-N 2.95Å; L327-A330 WeakPolarHBondContact O-CB 3.19Å; L327-A330 PolarHBondContact O-N 3.05Å; L327-V331 HydrophobicContact CD1-CG2 3.76Å; L327-V331 HydrophobicContact CG-CG2 4.23Å; L327-V331 WeakPolarHBondContact O-CB 3.31Å; L327-V331 VanDerWaalsContact O-CG2 3.26Å; L327-V331 WeakPolarHBondContact O-CG2 3.3Å; L327-V331 PolarHBondContact O-N 3.48Å
328	L	97.3	Very high	96.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-40.6	-179.7	-169	64.3	0	0	0	111.9	L319 N324 K325 E326 V331 T332 L360 V368	L319-L328 HydrophobicContact CD2-CD1 4.09Å; N324-L328 WeakPolarHBondContact O-CB 3.11Å; N324-L328 PolarHBondContact O-N 3.46Å; K325-L328 PolarHBondContact O-N 2.85Å; E326-L328 VanDerWaalsContact C-N 3.32Å; E326-L328 PolarHBondContact O-N 2.81Å; L328-V331 PolarHBondContact O-N 2.81Å; L328-T332 HydrophobicContact CD1-CG2 4.23Å; L328-T332 HydrophobicContact CG-CG2 4.33Å; L328-T332 WeakPolarHBondContact O-CB 3.43Å; L328-T332 VanDerWaalsContact O-CG2 3.23Å; L328-T332 WeakPolarHBondContact O-CG2 3.2Å; L328-T332 PolarHBondContact O-N 3.24Å; L328-T332 PolarHBondContact O-OG1 3.18Å; L328-L360 HydrophobicContact CD1-CD1 3.89Å; L328-L360 HydrophobicContact CD2-CD1 4.44Å; L328-L360 HydrophobicContact CD2-CD2 4.1Å; L328-V368 HydrophobicContact CB-CG2 4.41Å; L328-V368 HydrophobicContact CD2-CG1 3.76Å; L328-V368 HydrophobicContact CD2-CG2 4.41Å; L328-V368 HydrophobicContact CG-CG1 3.86Å; L328-V368 HydrophobicContact CG-CG2 4.44Å
329	A	97.8	Very high	96.8	Very high	12 Å²	12	33.3 Å²	33.3	10%	0.099	18%	0.178	C	C	.	.	H	α-helix	trans	-61.5	-44.5	174.6	0	0	0	0	0	111.4	K325 E326 L327 T332 G333 V368 N371	K325-A329 WeakPolarHBondContact O-CB 3.5Å; K325-A329 PolarHBondContact O-N 3.42Å; E326-A329 PolarHBondContact O-N 3.22Å; L327-A329 VanDerWaalsContact C-N 3.34Å; L327-A329 PolarHBondContact O-N 2.95Å; A329-T332 PolarHBondContact O-OG1 3.39Å; A329-T332 VanDerWaalsContact O-OG1 3.11Å; A329-G333 PolarHBondContact O-N 3.34Å; A329-V368 HydrophobicContact CB-CG2 3.93Å; A329-N371 PolarHBondContact O-ND2 3.12Å
330	A	98.1	Very high	96.9	Very high	6 Å²	6	36 Å²	36	5%	0.05	19%	0.192	C	C	.	.	H	α-helix	trans	-63.1	-46	177.2	0	0	0	0	0	112.8	M287 A290 S291 E326 L327 G333 A334	M287-A330 HydrophobicContact CG-CB 4.15Å; A290-A330 HydrophobicContact CB-CB 3.94Å; S291-A330 WeakPolarHBondContact OG-CB 3.37Å; E326-A330 PolarHBondContact O-N 3.33Å; L327-A330 WeakPolarHBondContact O-CB 3.19Å; L327-A330 PolarHBondContact O-N 3.05Å; A330-G333 PolarHBondContact O-N 3.3Å; A330-A334 PolarHBondContact O-N 2.97Å
331	V	98.4	Very high	97	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66	-47.9	-179.4	170.1	0	0	0	0	111.1	A290 L315 L318 L319 L327 L328 G333 A334 I335	A290-V331 HydrophobicContact CB-CG2 3.93Å; L315-V331 WeakPolarHBondContact O-CG1 3.43Å; L318-V331 HydrophobicContact CB-CG1 4.14Å; L318-V331 HydrophobicContact CB-CG2 3.79Å; L318-V331 HydrophobicContact CD1-CG2 3.97Å; L319-V331 HydrophobicContact CD2-CG1 3.85Å; L319-V331 HydrophobicContact CG-CG1 4.35Å; L327-V331 HydrophobicContact CD1-CG2 3.76Å; L327-V331 HydrophobicContact CG-CG2 4.23Å; L327-V331 WeakPolarHBondContact O-CB 3.31Å; L327-V331 VanDerWaalsContact O-CG2 3.26Å; L327-V331 WeakPolarHBondContact O-CG2 3.3Å; L327-V331 PolarHBondContact O-N 3.48Å; L328-V331 PolarHBondContact O-N 2.81Å; V331-G333 VanDerWaalsContact C-N 3.31Å; V331-G333 PolarHBondContact O-N 3.29Å; V331-A334 WeakPolarHBondContact O-CB 3.31Å; V331-A334 PolarHBondContact O-N 3.24Å; V331-I335 HydrophobicContact CG1-CD1 3.97Å; V331-I335 WeakPolarHBondContact O-CG1 3.43Å; V331-I335 PolarHBondContact O-N 3Å
332	T	98.4	Very high	97.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-37	178.5	53.6	0	0	0	0	111.5	L319 L328 A329 I335 W336 L357 L360 V368 N371 V372	L319-T332 HydrophobicContact CD2-CG2 3.82Å; L328-T332 HydrophobicContact CD1-CG2 4.23Å; L328-T332 HydrophobicContact CG-CG2 4.33Å; L328-T332 WeakPolarHBondContact O-CB 3.43Å; L328-T332 VanDerWaalsContact O-CG2 3.23Å; L328-T332 WeakPolarHBondContact O-CG2 3.2Å; L328-T332 PolarHBondContact O-N 3.24Å; L328-T332 PolarHBondContact O-OG1 3.18Å; A329-T332 PolarHBondContact O-OG1 3.39Å; A329-T332 VanDerWaalsContact O-OG1 3.11Å; T332-I335 PolarHBondContact O-N 2.88Å; T332-W336 WeakPolarHBondContact O-CB 3.48Å; T332-W336 PolarHBondContact O-N 3.38Å; T332-L357 HydrophobicContact CG2-CD2 4.38Å; T332-L360 HydrophobicContact CG2-CD1 4.28Å; T332-V368 HydrophobicContact CG2-CG1 4.37Å; T332-N371 WeakPolarHBondContact OG1-CB 3.35Å; T332-V372 HydrophobicContact CG2-CG2 3.56Å
333	G	98.2	Very high	97.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-44.6	172.9	0	0	0	0	0	112.4	F294 A329 A330 V331 W336 K337	F294-G333 WeakPolarHBondContact CD2-O 3.47Å; F294-G333 WeakPolarHBondContact CE2-O 3.41Å; A329-G333 PolarHBondContact O-N 3.34Å; A330-G333 PolarHBondContact O-N 3.3Å; V331-G333 VanDerWaalsContact C-N 3.31Å; V331-G333 PolarHBondContact O-N 3.29Å; G333-W336 PolarHBondContact O-N 2.68Å; G333-K337 PolarHBondContact O-N 3.21Å
334	A	98.4	Very high	97.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.3	-45.6	175	0	0	0	0	0	111.8	I293 F294 L315 A330 V331 W336 K337 C338	I293-A334 HydrophobicContact CB-CB 4.42Å; I293-A334 HydrophobicContact CG2-CB 4.06Å; F294-A334 HydrophobicContact CB-CB 4.23Å; L315-A334 HydrophobicContact CD1-CB 4.1Å; L315-A334 HydrophobicContact CD2-CB 3.91Å; A330-A334 PolarHBondContact O-N 2.97Å; V331-A334 WeakPolarHBondContact O-CB 3.31Å; V331-A334 PolarHBondContact O-N 3.24Å; A334-W336 PolarHBondContact O-N 3.13Å; A334-K337 PolarHBondContact O-N 3.47Å; A334-C338 VanDerWaalsContact O-CB 3.31Å; A334-C338 WeakPolarHBondContact O-CB 3.49Å; A334-C338 PolarHBondContact O-N 3.29Å; A334-C338 PolarHBondContact O-SG 3.05Å; A334-C338 VanDerWaalsContact O-SG 3.32Å
335	I	98.6	Very high	97.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.3	-44.8	176.4	-68.9	170	0	0	0	110.7	L315 L319 V331 T332 C338 A339 F348 T353 L357 A375 M379	L315-I335 HydrophobicContact CB-CD1 4.46Å; L315-I335 HydrophobicContact CB-CG1 4.11Å; L319-I335 HydrophobicContact CD1-CD1 3.87Å; L319-I335 HydrophobicContact CD2-CD1 3.83Å; L319-I335 HydrophobicContact CG-CD1 3.96Å; V331-I335 HydrophobicContact CG1-CD1 3.97Å; V331-I335 WeakPolarHBondContact O-CG1 3.43Å; V331-I335 PolarHBondContact O-N 3Å; T332-I335 PolarHBondContact O-N 2.88Å; I335-C338 PolarHBondContact O-N 3.14Å; I335-A339 VanDerWaalsContact O-CB 3.31Å; I335-A339 WeakPolarHBondContact O-CB 3.41Å; I335-A339 PolarHBondContact O-N 2.64Å; I335-F348 HydrophobicContact CB-CZ 4.33Å; I335-F348 HydrophobicContact CG1-CE1 4.21Å; I335-F348 HydrophobicContact CG1-CZ 4.27Å; I335-F348 HydrophobicContact CG2-CE1 4.14Å; I335-F348 HydrophobicContact CG2-CE2 4.31Å; I335-F348 HydrophobicContact CG2-CZ 3.94Å; I335-T353 HydrophobicContact CG2-CG2 4.26Å; I335-L357 HydrophobicContact CG2-CD1 4.29Å; I335-A375 HydrophobicContact CG2-CB 4.18Å; I335-M379 HydrophobicContact CG2-CE 3.8Å
336	W	98.6	Very high	97.9	Very high	39 Å²	39	32.9 Å²	32.9	15%	0.148	16%	0.155	C	C	.	.	H	α-helix	trans	-57.2	-53.3	177.3	175.7	21	0	0	0	112	T332 G333 A334 C338 A339 V370 N371 G374 A375 N412	T332-W336 WeakPolarHBondContact O-CB 3.48Å; T332-W336 PolarHBondContact O-N 3.38Å; G333-W336 PolarHBondContact O-N 2.68Å; A334-W336 PolarHBondContact O-N 3.13Å; W336-C338 VanDerWaalsContact C-N 3.29Å; W336-C338 PolarHBondContact O-N 3.37Å; W336-A339 WeakPolarHBondContact O-CB 3.09Å; W336-A339 PolarHBondContact O-N 3.43Å; W336-A339 VanDerWaalsContact O-N 3.11Å; W336-V370 HydrophobicContact CZ3-CG1 4.26Å; W336-N371 HydrophobicContact CE3-CB 4.44Å; W336-G374 VanDerWaalsContact CD1-O 3.24Å; W336-G374 VanDerWaalsContact NE1-C 3.31Å; W336-G374 PolarHBondContact NE1-O 3.32Å; W336-A375 HydrophobicContact CB-CB 3.89Å; W336-N412 WeakPolarHBondContact CH2-ND2 3.47Å; W336-N412 WeakPolarHBondContact CZ2-ND2 3.39Å
337	K	98.4	Very high	97.9	Very high	52 Å²	52	29.3 Å²	29.3	23%	0.226	14%	0.139	C	C	.	.	H	α-helix	trans	-66.6	-32.5	-179.3	-66.3	-63.7	-178.4	175	0	112.2	F294 A297 R303 G333 A334 I340	F294-K337 HydrophobicContact CD2-CB 4.28Å; F294-K337 HydrophobicContact CD2-CG 3.39Å; F294-K337 HydrophobicContact CE2-CD 4.2Å; F294-K337 HydrophobicContact CE2-CG 3.48Å; F294-K337 VanDerWaalsContact CE2-CG 3.48Å; A297-K337 HydrophobicContact CB-CB 3.62Å; R303-K337 WeakPolarHBondContact CD-O 3.38Å; R303-K337 PolarHBondContact NE-O 2.8Å; G333-K337 PolarHBondContact O-N 3.21Å; A334-K337 PolarHBondContact O-N 3.47Å; K337-I340 HydrophobicContact CD-CD1 4.11Å
338	C	98.4	Very high	97.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.7	-34.3	172.1	-75.2	0	0	0	0	112.9	L312 A334 I335 W336 I340 S341 N344 F348	L312-C338 HydrophobicContact CD2-CB 4.08Å; A334-C338 VanDerWaalsContact O-CB 3.31Å; A334-C338 WeakPolarHBondContact O-CB 3.49Å; A334-C338 PolarHBondContact O-N 3.29Å; A334-C338 PolarHBondContact O-SG 3.05Å; A334-C338 VanDerWaalsContact O-SG 3.32Å; I335-C338 PolarHBondContact O-N 3.14Å; W336-C338 VanDerWaalsContact C-N 3.29Å; W336-C338 PolarHBondContact O-N 3.37Å; C338-I340 PolarHBondContact O-N 3.47Å; C338-S341 PolarHBondContact O-N 3.3Å; C338-N344 VanDerWaalsContact O-CB 3.24Å; C338-N344 WeakPolarHBondContact O-CB 3.35Å; C338-N344 PolarHBondContact O-ND2 3.01Å; C338-F348 HydrophobicContact CB-CE2 3.91Å; C338-F348 HydrophobicContact CB-CZ 3.91Å
339	A	98.2	Very high	97.9	Very high	2 Å²	2	33 Å²	33	2%	0.017	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-8.3	-178.3	0	0	0	0	0	114.4	I335 W336 S341 V345 F348 E378 M379	I335-A339 VanDerWaalsContact O-CB 3.31Å; I335-A339 WeakPolarHBondContact O-CB 3.41Å; I335-A339 PolarHBondContact O-N 2.64Å; W336-A339 WeakPolarHBondContact O-CB 3.09Å; W336-A339 PolarHBondContact O-N 3.43Å; W336-A339 VanDerWaalsContact O-N 3.11Å; A339-S341 PolarHBondContact O-N 3.33Å; A339-V345 HydrophobicContact CB-CG2 4.29Å; A339-V345 WeakPolarHBondContact O-CG2 3.49Å; A339-F348 HydrophobicContact CB-CD2 4.46Å; A339-F348 HydrophobicContact CB-CE2 4.31Å; A339-E378 HydrophobicContact CB-CB 4.04Å; A339-M379 HydrophobicContact CB-CE 3.92Å; A339-M379 HydrophobicContact CB-CG 4.05Å
340	I	97.9	Very high	97.8	Very high	61 Å²	61	41.6 Å²	41.6	31%	0.313	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-28.3	171.3	-61.6	167.5	0	0	0	110.9	K337 C338 E378	K337-I340 HydrophobicContact CD-CD1 4.11Å; C338-I340 PolarHBondContact O-N 3.47Å; I340-E378 HydrophobicContact CG1-CG 4.09Å
341	S	97.7	Very high	97.8	Very high	22 Å²	22	43.6 Å²	43.6	15%	0.154	20%	0.195	C	C	.	.	S	Bend	trans	-81.3	124.8	175.2	174.6	0	0	0	0	111.2	C338 A339 E343 N344 V345	C338-S341 PolarHBondContact O-N 3.3Å; A339-S341 PolarHBondContact O-N 3.33Å; S341-E343 PolarHBondContact O-N 3.46Å; S341-N344 WeakPolarHBondContact O-CB 3.37Å; S341-N344 PolarHBondContact O-N 3.19Å; S341-N344 VanDerWaalsContact O-N 3.09Å; S341-V345 WeakPolarHBondContact O-CG2 3.38Å; S341-V345 PolarHBondContact O-N 3.43Å
342	K	96.8	Very high	97.7	Very high	179 Å²	179	44.8 Å²	44.8	78%	0.778	21%	0.207	S	C	*	.	H	α-helix	trans	-56.8	-37.2	177.6	-66.3	-175.6	179.8	-178.6	0	112.8	V345 K346	K342-V345 PolarHBondContact O-N 3.1Å; K342-K346 PolarHBondContact O-N 3.42Å
343	E	97.2	Very high	97.7	Very high	84 Å²	84	44.8 Å²	44.8	39%	0.393	21%	0.207	S	C	.	.	H	α-helix	trans	-70.7	-34.1	179.2	-62.6	-52.3	125.7	0	0	112.2	S341 K346 Q347	S341-E343 PolarHBondContact O-N 3.46Å; E343-K346 IonicContact OE1-NZ 2.67Å; E343-K346 PolarHBondContact OE1-NZ 3.17Å; E343-K346 IonicContact OE2-NZ 3.67Å; E343-K346 PolarHBondContact OE2-NZ 3.31Å; E343-Q347 PolarHBondContact O-N 3.45Å
344	N	98.2	Very high	97.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.3	-38.4	173.5	-68.4	1.6	0	0	0	111.2	R303 R307 L312 C338 S341 K346 Q347 F348	R303-N344 PolarHBondContact O-ND2 3.22Å; R307-N344 VanDerWaalsContact CB-OD1 3.28Å; R307-N344 WeakPolarHBondContact CB-OD1 3.44Å; R307-N344 WeakPolarHBondContact CD-OD1 3.25Å; R307-N344 PolarHBondContact NE-OD1 3.34Å; L312-N344 HydrophobicContact CD1-CB 4.1Å; C338-N344 VanDerWaalsContact O-CB 3.24Å; C338-N344 WeakPolarHBondContact O-CB 3.35Å; C338-N344 PolarHBondContact O-ND2 3.01Å; S341-N344 WeakPolarHBondContact O-CB 3.37Å; S341-N344 PolarHBondContact O-N 3.19Å; S341-N344 VanDerWaalsContact O-N 3.09Å; N344-K346 VanDerWaalsContact C-N 3.34Å; N344-K346 PolarHBondContact O-N 2.98Å; N344-Q347 PolarHBondContact O-N 3.45Å; N344-Q347 VanDerWaalsContact O-N 3.08Å; N344-F348 HydrophobicContact CB-CD2 4.4Å; N344-F348 HydrophobicContact CB-CE2 4.19Å; N344-F348 WeakPolarHBondContact O-CD2 3.11Å; N344-F348 WeakPolarHBondContact O-CG 3.07Å; N344-F348 PolarHBondContact O-N 3.46Å
345	V	98.1	Very high	97.6	Very high	12 Å²	12	49.4 Å²	49.4	7%	0.073	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-44.7	175.2	173.3	0	0	0	0	111.4	A339 S341 K342 Q347 F348 Q349 M379 N385	A339-V345 HydrophobicContact CB-CG2 4.29Å; A339-V345 WeakPolarHBondContact O-CG2 3.49Å; S341-V345 WeakPolarHBondContact O-CG2 3.38Å; S341-V345 PolarHBondContact O-N 3.43Å; K342-V345 PolarHBondContact O-N 3.1Å; V345-Q347 VanDerWaalsContact C-N 3.26Å; V345-Q347 PolarHBondContact O-N 2.72Å; V345-F348 PolarHBondContact O-N 3.13Å; V345-Q349 WeakPolarHBondContact O-CB 3.49Å; V345-Q349 PolarHBondContact O-N 2.94Å; V345-M379 HydrophobicContact CG1-CB 4.44Å; V345-M379 HydrophobicContact CG1-CG 4.39Å; V345-M379 HydrophobicContact CG2-CG 4.32Å; V345-N385 WeakPolarHBondContact CG1-ND2 3.29Å
346	K	97.1	Very high	97.6	Very high	85 Å²	85	52.9 Å²	52.9	37%	0.37	25%	0.245	S	C	.	.	H	α-helix	trans	-59.1	-37.7	174.4	-68.2	173.2	-175.7	164.5	0	112.3	K342 E343 N344 Q349 R350	K342-K346 PolarHBondContact O-N 3.42Å; E343-K346 IonicContact OE1-NZ 2.67Å; E343-K346 PolarHBondContact OE1-NZ 3.17Å; E343-K346 IonicContact OE2-NZ 3.67Å; E343-K346 PolarHBondContact OE2-NZ 3.31Å; N344-K346 VanDerWaalsContact C-N 3.34Å; N344-K346 PolarHBondContact O-N 2.98Å; K346-Q349 WeakPolarHBondContact O-CB 3.47Å; K346-R350 WeakPolarHBondContact O-CG 3.43Å; K346-R350 PolarHBondContact O-N 3.03Å
347	Q	97.1	Very high	97.5	Very high	61 Å²	61	51 Å²	51	29%	0.285	24%	0.238	S	C	.	.	H	α-helix	trans	-72.7	-41.1	178.1	-169.9	60.7	22.1	0	0	112	L312 E343 N344 V345 Q349 R350 L351	L312-Q347 HydrophobicContact CD1-CB 3.88Å; L312-Q347 HydrophobicContact CD1-CG 3.93Å; E343-Q347 PolarHBondContact O-N 3.45Å; N344-Q347 PolarHBondContact O-N 3.45Å; N344-Q347 VanDerWaalsContact O-N 3.08Å; V345-Q347 VanDerWaalsContact C-N 3.26Å; V345-Q347 PolarHBondContact O-N 2.72Å; Q347-Q349 VanDerWaalsContact C-N 3.28Å; Q347-Q349 PolarHBondContact O-N 2.98Å; Q347-R350 PolarHBondContact O-N 3.06Å; Q347-L351 HydrophobicContact CG-CD1 4.39Å; Q347-L351 WeakPolarHBondContact O-CG 3.15Å; Q347-L351 PolarHBondContact O-N 3.34Å; Q347-L351 VanDerWaalsContact O-N 3.14Å
348	F	98.1	Very high	97.5	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.3	-36.3	173.4	-73	-52.4	0	0	0	112.5	L312 V316 I335 C338 A339 N344 V345 R350 L351 G352 T353 M379	L312-F348 HydrophobicContact CB-CE1 4Å; L312-F348 HydrophobicContact CB-CZ 4.43Å; L312-F348 HydrophobicContact CD2-CE1 4.09Å; L312-F348 HydrophobicContact CD2-CE2 4.26Å; L312-F348 HydrophobicContact CD2-CZ 3.64Å; L312-F348 HydrophobicContact CG-CE1 4.46Å; L312-F348 HydrophobicContact CG-CZ 4.41Å; V316-F348 HydrophobicContact CG2-CD1 3.78Å; V316-F348 HydrophobicContact CG2-CE1 3.87Å; I335-F348 HydrophobicContact CB-CZ 4.33Å; I335-F348 HydrophobicContact CG1-CE1 4.21Å; I335-F348 HydrophobicContact CG1-CZ 4.27Å; I335-F348 HydrophobicContact CG2-CE1 4.14Å; I335-F348 HydrophobicContact CG2-CE2 4.31Å; I335-F348 HydrophobicContact CG2-CZ 3.94Å; C338-F348 HydrophobicContact CB-CE2 3.91Å; C338-F348 HydrophobicContact CB-CZ 3.91Å; A339-F348 HydrophobicContact CB-CD2 4.46Å; A339-F348 HydrophobicContact CB-CE2 4.31Å; N344-F348 HydrophobicContact CB-CD2 4.4Å; N344-F348 HydrophobicContact CB-CE2 4.19Å; N344-F348 WeakPolarHBondContact O-CD2 3.11Å; N344-F348 WeakPolarHBondContact O-CG 3.07Å; N344-F348 PolarHBondContact O-N 3.46Å; V345-F348 PolarHBondContact O-N 3.13Å; F348-R350 PolarHBondContact O-N 3.18Å; F348-L351 PolarHBondContact O-N 3.03Å; F348-G352 PolarHBondContact O-N 3.13Å; F348-T353 HydrophobicContact CB-CG2 4.4Å; F348-T353 HydrophobicContact CD1-CG2 4Å; F348-T353 WeakPolarHBondContact CD1-OG1 3.35Å; F348-T353 HydrophobicContact CG-CG2 4.42Å; F348-T353 WeakPolarHBondContact O-CB 3.44Å; F348-T353 PolarHBondContact O-N 3.34Å; F348-T353 VanDerWaalsContact O-N 3.11Å; F348-T353 PolarHBondContact O-OG1 3.03Å; F348-M379 HydrophobicContact CB-CE 3.8Å; F348-M379 HydrophobicContact CD1-CE 4.47Å; F348-M379 HydrophobicContact CD2-CE 3.61Å; F348-M379 HydrophobicContact CE2-CE 4.23Å; F348-M379 HydrophobicContact CG-CE 3.74Å
349	Q	96.1	Very high	97.4	Very high	78 Å²	78	51.3 Å²	51.3	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-45.1	172.9	-174.5	-179.7	18.8	0	0	111.6	V345 K346 Q347 L351 G352 S384	V345-Q349 WeakPolarHBondContact O-CB 3.49Å; V345-Q349 PolarHBondContact O-N 2.94Å; K346-Q349 WeakPolarHBondContact O-CB 3.47Å; Q347-Q349 VanDerWaalsContact C-N 3.28Å; Q347-Q349 PolarHBondContact O-N 2.98Å; Q349-L351 PolarHBondContact O-N 3.31Å; Q349-G352 PolarHBondContact O-N 3.19Å; Q349-S384 PolarHBondContact NE2-OG 3.38Å
350	R	96.5	Very high	97.4	Very high	193 Å²	193	51.3 Å²	51.3	73%	0.728	25%	0.254	S	S	*	.	H	α-helix	trans	-64.6	-28.6	176.7	-66.5	171.7	-173.3	163.1	-3.8	113.2	K346 Q347 F348 G352	K346-R350 WeakPolarHBondContact O-CG 3.43Å; K346-R350 PolarHBondContact O-N 3.03Å; Q347-R350 PolarHBondContact O-N 3.06Å; F348-R350 PolarHBondContact O-N 3.18Å; R350-G352 VanDerWaalsContact C-N 3.32Å
351	L	96.9	Very high	97.3	Very high	47 Å²	47	48.5 Å²	48.5	25%	0.246	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	2.5	179.8	-66.5	171.8	0	0	0	113.3	L312 E313 V316 Q347 F348 Q349 T353	L312-L351 HydrophobicContact CB-CD1 4.39Å; E313-L351 HydrophobicContact CB-CD1 4.26Å; E313-L351 HydrophobicContact CB-CD2 4.31Å; E313-L351 HydrophobicContact CG-CD2 4.34Å; V316-L351 HydrophobicContact CG1-CB 4.38Å; V316-L351 HydrophobicContact CG2-CB 4.42Å; V316-L351 HydrophobicContact CG2-CD1 4.02Å; Q347-L351 HydrophobicContact CG-CD1 4.39Å; Q347-L351 WeakPolarHBondContact O-CG 3.15Å; Q347-L351 PolarHBondContact O-N 3.34Å; Q347-L351 VanDerWaalsContact O-N 3.14Å; F348-L351 PolarHBondContact O-N 3.03Å; Q349-L351 PolarHBondContact O-N 3.31Å; L351-T353 PolarHBondContact O-N 3.3Å
352	G	96.7	Very high	97	Very high	25 Å²	25	51.5 Å²	51.5	26%	0.258	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	35.9	-177	0	0	0	0	0	112.7	F348 Q349 R350 I354 E355 Q356	F348-G352 PolarHBondContact O-N 3.13Å; Q349-G352 PolarHBondContact O-N 3.19Å; R350-G352 VanDerWaalsContact C-N 3.32Å; G352-I354 VanDerWaalsContact C-N 3.34Å; G352-E355 WeakPolarHBondContact CA-OE2 3.39Å; G352-Q356 PolarHBondContact O-NE2 2.81Å
353	T	97.8	Very high	96.6	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71	-30.9	-175.3	-54.2	0	0	0	0	112	V316 L319 I335 F348 L351 Q356 L357 M379	V316-T353 HydrophobicContact CG2-CG2 3.95Å; V316-T353 WeakPolarHBondContact CG2-OG1 3.33Å; L319-T353 HydrophobicContact CD1-CG2 4.32Å; I335-T353 HydrophobicContact CG2-CG2 4.26Å; F348-T353 HydrophobicContact CB-CG2 4.4Å; F348-T353 HydrophobicContact CD1-CG2 4Å; F348-T353 WeakPolarHBondContact CD1-OG1 3.35Å; F348-T353 HydrophobicContact CG-CG2 4.42Å; F348-T353 WeakPolarHBondContact O-CB 3.44Å; F348-T353 PolarHBondContact O-N 3.34Å; F348-T353 VanDerWaalsContact O-N 3.11Å; F348-T353 PolarHBondContact O-OG1 3.03Å; L351-T353 PolarHBondContact O-N 3.3Å; T353-Q356 PolarHBondContact O-N 3.18Å; T353-L357 HydrophobicContact CG2-CD1 3.94Å; T353-L357 HydrophobicContact CG2-CG 4.09Å; T353-L357 WeakPolarHBondContact O-CB 3.4Å; T353-L357 VanDerWaalsContact O-CG 3.3Å; T353-L357 WeakPolarHBondContact O-CG 3.4Å; T353-L357 PolarHBondContact O-N 3.14Å; T353-M379 HydrophobicContact CG2-CE 4.08Å
354	I	98	Very high	96.4	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-65	-46.5	-175.4	-67.5	173.1	0	0	0	110.8	G352 Q356 L357 V358 L376 M379 N385 T388 I389	G352-I354 VanDerWaalsContact C-N 3.34Å; I354-Q356 VanDerWaalsContact C-N 3.3Å; I354-Q356 PolarHBondContact O-N 3.15Å; I354-L357 PolarHBondContact O-N 2.93Å; I354-V358 HydrophobicContact CG2-CG2 4.35Å; I354-V358 WeakPolarHBondContact O-CB 3.26Å; I354-V358 WeakPolarHBondContact O-CG2 3.45Å; I354-V358 PolarHBondContact O-N 3.01Å; I354-L376 HydrophobicContact CG2-CD2 4.19Å; I354-M379 HydrophobicContact CG1-SD 3.83Å; I354-N385 HydrophobicContact CD1-CB 3.56Å; I354-N385 VanDerWaalsContact CD1-OD1 3.29Å; I354-N385 WeakPolarHBondContact CD1-OD1 3.49Å; I354-T388 HydrophobicContact CB-CG2 4.06Å; I354-T388 HydrophobicContact CD1-CG2 4.21Å; I354-T388 HydrophobicContact CG2-CG2 3.89Å; I354-I389 HydrophobicContact CG2-CB 4.44Å; I354-I389 HydrophobicContact CG2-CG1 3.51Å
355	E	97.4	Very high	96.3	Very high	96 Å²	96	51.8 Å²	51.8	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-61.3	-41.3	179.8	-64.8	83.7	170.2	0	0	111.1	G352 V358 G359 T388 A392	G352-E355 WeakPolarHBondContact CA-OE2 3.39Å; E355-V358 PolarHBondContact O-N 3.28Å; E355-G359 PolarHBondContact O-N 3.34Å; E355-T388 WeakPolarHBondContact OE1-CG2 3.47Å; E355-A392 HydrophobicContact CG-CB 4.3Å
356	Q	97.5	Very high	96.2	Very high	73 Å²	73	54.8 Å²	54.8	34%	0.341	28%	0.276	S	S	.	.	H	α-helix	trans	-65	-45.1	175.4	-68.2	178.9	75.7	0	0	111.7	V316 L319 G352 T353 I354 V358 G359 L360	V316-Q356 VanDerWaalsContact CG1-NE2 3.31Å; L319-Q356 HydrophobicContact CD1-CB 4.02Å; G352-Q356 PolarHBondContact O-NE2 2.81Å; T353-Q356 PolarHBondContact O-N 3.18Å; I354-Q356 VanDerWaalsContact C-N 3.3Å; I354-Q356 PolarHBondContact O-N 3.15Å; Q356-V358 VanDerWaalsContact C-N 3.35Å; Q356-V358 PolarHBondContact O-N 3.06Å; Q356-G359 PolarHBondContact O-N 3.5Å; Q356-L360 WeakPolarHBondContact O-CG 3.26Å; Q356-L360 PolarHBondContact O-N 3.34Å
357	L	98.2	Very high	96.1	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-38.4	176.8	-71.5	178.2	0	0	0	112.2	L319 T332 I335 T353 I354 G359 L360 V372 A375 L376 M379	L319-L357 HydrophobicContact CD1-CD2 4.16Å; L319-L357 HydrophobicContact CD2-CD2 4.31Å; T332-L357 HydrophobicContact CG2-CD2 4.38Å; I335-L357 HydrophobicContact CG2-CD1 4.29Å; T353-L357 HydrophobicContact CG2-CD1 3.94Å; T353-L357 HydrophobicContact CG2-CG 4.09Å; T353-L357 WeakPolarHBondContact O-CB 3.4Å; T353-L357 VanDerWaalsContact O-CG 3.3Å; T353-L357 WeakPolarHBondContact O-CG 3.4Å; T353-L357 PolarHBondContact O-N 3.14Å; I354-L357 PolarHBondContact O-N 2.93Å; L357-G359 VanDerWaalsContact C-N 3.3Å; L357-G359 PolarHBondContact O-N 2.91Å; L357-L360 WeakPolarHBondContact O-CB 3.23Å; L357-L360 PolarHBondContact O-N 3.11Å; L357-L360 VanDerWaalsContact O-N 3.07Å; L357-V372 HydrophobicContact CB-CG1 4.19Å; L357-V372 HydrophobicContact CD2-CG1 4.34Å; L357-V372 HydrophobicContact CD2-CG2 4.27Å; L357-V372 VanDerWaalsContact O-CG1 3.26Å; L357-V372 WeakPolarHBondContact O-CG1 3.15Å; L357-A375 HydrophobicContact CD1-CB 3.88Å; L357-L376 HydrophobicContact CB-CD1 4.48Å; L357-L376 HydrophobicContact CB-CD2 3.86Å; L357-L376 HydrophobicContact CB-CG 4.16Å; L357-L376 HydrophobicContact CD1-CD2 4.15Å; L357-L376 HydrophobicContact CD1-CG 4.42Å; L357-M379 HydrophobicContact CD1-CE 4.01Å; L357-M379 HydrophobicContact CD1-SD 4.09Å
358	V	97.8	Very high	96.1	Very high	9 Å²	9	55 Å²	55	6%	0.055	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-39.1	174.6	167.8	0	0	0	0	111	I354 E355 Q356 L360 L361 L376 A392	I354-V358 HydrophobicContact CG2-CG2 4.35Å; I354-V358 WeakPolarHBondContact O-CB 3.26Å; I354-V358 WeakPolarHBondContact O-CG2 3.45Å; I354-V358 PolarHBondContact O-N 3.01Å; E355-V358 PolarHBondContact O-N 3.28Å; Q356-V358 VanDerWaalsContact C-N 3.35Å; Q356-V358 PolarHBondContact O-N 3.06Å; V358-L360 PolarHBondContact O-N 3.31Å; V358-L361 HydrophobicContact CB-CD1 4.46Å; V358-L361 HydrophobicContact CG1-CD1 4.41Å; V358-L361 HydrophobicContact CG2-CD1 4.37Å; V358-L361 WeakPolarHBondContact O-CB 3.21Å; V358-L361 PolarHBondContact O-N 2.92Å; V358-L361 VanDerWaalsContact O-N 3.14Å; V358-L376 HydrophobicContact CG2-CD1 4.33Å; V358-L376 HydrophobicContact CG2-CD2 4.35Å; V358-A392 HydrophobicContact CB-CB 4.11Å; V358-A392 HydrophobicContact CG1-CB 3.97Å; V358-A392 WeakPolarHBondContact CG1-O 3.49Å; V358-A392 HydrophobicContact CG2-CB 4.11Å
359	G	96.5	Very high	96.1	Very high	49 Å²	49	55.3 Å²	55.3	51%	0.505	28%	0.28	S	S	.	.	H	α-helix	trans	-60.2	-23.9	173	0	0	0	0	0	114.3	E355 Q356 L357	E355-G359 PolarHBondContact O-N 3.34Å; Q356-G359 PolarHBondContact O-N 3.5Å; L357-G359 VanDerWaalsContact C-N 3.3Å; L357-G359 PolarHBondContact O-N 2.91Å
360	L	96.9	Very high	96.2	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	0.1	178.5	-61.6	176.8	0	0	0	114.2	L319 Q322 L328 T332 Q356 L357 V358 N362 Q364 L369 V372	L319-L360 HydrophobicContact CD2-CD1 3.92Å; Q322-L360 VanDerWaalsContact CD-CD2 3.43Å; Q322-L360 HydrophobicContact CG-CD2 3.75Å; L328-L360 HydrophobicContact CD1-CD1 3.89Å; L328-L360 HydrophobicContact CD2-CD1 4.44Å; L328-L360 HydrophobicContact CD2-CD2 4.1Å; T332-L360 HydrophobicContact CG2-CD1 4.28Å; Q356-L360 WeakPolarHBondContact O-CG 3.26Å; Q356-L360 PolarHBondContact O-N 3.34Å; L357-L360 WeakPolarHBondContact O-CB 3.23Å; L357-L360 PolarHBondContact O-N 3.11Å; L357-L360 VanDerWaalsContact O-N 3.07Å; V358-L360 PolarHBondContact O-N 3.31Å; L360-N362 PolarHBondContact O-N 3.23Å; L360-Q364 HydrophobicContact CB-CG 4.46Å; L360-Q364 WeakPolarHBondContact O-CG 3.36Å; L360-L369 WeakPolarHBondContact O-CD2 3.44Å; L360-V372 HydrophobicContact CB-CG1 4.44Å; L360-V372 HydrophobicContact CB-CG2 4.08Å; L360-V372 HydrophobicContact CD1-CG2 4.33Å
361	L	96.6	Very high	96.3	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-13.9	-179.9	-70.5	173	0	0	0	113.7	V358 L369 V372 V373 L376 L398 L401	V358-L361 HydrophobicContact CB-CD1 4.46Å; V358-L361 HydrophobicContact CG1-CD1 4.41Å; V358-L361 HydrophobicContact CG2-CD1 4.37Å; V358-L361 WeakPolarHBondContact O-CB 3.21Å; V358-L361 PolarHBondContact O-N 2.92Å; V358-L361 VanDerWaalsContact O-N 3.14Å; L361-L369 WeakPolarHBondContact O-CD2 3.28Å; L361-V372 HydrophobicContact CD2-CG1 3.73Å; L361-V372 HydrophobicContact CG-CG1 4.26Å; L361-V373 HydrophobicContact CD2-CG2 3.59Å; L361-L376 HydrophobicContact CD1-CD1 3.88Å; L361-L376 HydrophobicContact CD2-CD1 3.94Å; L361-L376 HydrophobicContact CG-CD1 4.15Å; L361-L398 HydrophobicContact CD1-CD2 4.3Å; L361-L398 HydrophobicContact CD1-CG 4.24Å; L361-L398 HydrophobicContact CD2-CD2 4.24Å; L361-L401 HydrophobicContact CD2-CD1 4Å
362	N	91.5	Very high	96.4	Very high	84 Å²	84	41.2 Å²	41.2	45%	0.449	22%	0.222	S	C	.	.	S	Bend	trans	-112.2	145.1	-178.7	-62.4	-48.8	0	0	0	110.7	L360 Q364	L360-N362 PolarHBondContact O-N 3.23Å; N362-Q364 VanDerWaalsContact C-N 3.26Å; N362-Q364 PolarHBondContact O-N 3.3Å; N362-Q364 VanDerWaalsContact O-N 3.17Å
363	E	88	Confident	96.5	Very high	191 Å²	191	40 Å²	40	89%	0.893	21%	0.21	S	C	*	.	S	Bend	trans	57.9	29.3	171.1	-55.3	-179.1	175.8	0	0	115.5
364	Q	93.9	Very high	96.5	Very high	23 Å²	23	40 Å²	40	11%	0.107	21%	0.21	C	C	.	.			trans	-111.8	153.8	174.7	-59	-55.6	-36	0	0	112.5	L360 N362 V368 L369	L360-Q364 HydrophobicContact CB-CG 4.46Å; L360-Q364 WeakPolarHBondContact O-CG 3.36Å; N362-Q364 VanDerWaalsContact C-N 3.26Å; N362-Q364 PolarHBondContact O-N 3.3Å; N362-Q364 VanDerWaalsContact O-N 3.17Å; Q364-V368 HydrophobicContact CB-CB 4.15Å; Q364-V368 HydrophobicContact CB-CG1 4.12Å; Q364-V368 HydrophobicContact CG-CG1 4.31Å; Q364-L369 HydrophobicContact CB-CD2 3.96Å; Q364-L369 HydrophobicContact CB-CG 4.07Å; Q364-L369 WeakPolarHBondContact O-CD1 3.45Å
365	P	95.9	Very high	96.5	Very high	55 Å²	55	40 Å²	40	36%	0.357	21%	0.209	S	C	.	.			trans	-58.8	152.7	170.4	-22.3	33.9	0	0	0	112.2	K325 E367 V368 L369	K325-P365 HydrophobicContact CB-CG 4.17Å; K325-P365 HydrophobicContact CD-CG 4.19Å; K325-P365 HydrophobicContact CG-CG 4.04Å; P365-E367 VanDerWaalsContact C-N 3.27Å; P365-E367 PolarHBondContact O-N 3.14Å; P365-V368 PolarHBondContact O-N 3.28Å; P365-V368 VanDerWaalsContact O-N 3.09Å; P365-L369 PolarHBondContact O-N 3.19Å; P365-L369 VanDerWaalsContact O-N 3.08Å
366	E	95.5	Very high	96.6	Very high	76 Å²	76	35.4 Å²	35.4	36%	0.355	19%	0.188	S	C	.	.	H	α-helix	trans	-57.5	-38	-177.2	-65.6	-167.8	156.3	0	0	112.8	V368 L369 V370 N406	E366-V368 VanDerWaalsContact C-N 3.3Å; E366-V368 PolarHBondContact O-N 2.94Å; E366-L369 PolarHBondContact O-N 2.93Å; E366-L369 VanDerWaalsContact O-N 3.11Å; E366-V370 VanDerWaalsContact O-CG2 3.26Å; E366-V370 WeakPolarHBondContact O-CG2 3.43Å; E366-V370 PolarHBondContact O-N 3.02Å; E366-N406 VanDerWaalsContact OE2-CB 3.26Å; E366-N406 WeakPolarHBondContact OE2-CB 3.5Å; E366-N406 PolarHBondContact OE2-ND2 3.34Å
367	E	95.1	Very high	96.6	Very high	148 Å²	148	32 Å²	32	69%	0.692	17%	0.172	S	C	*	.	H	α-helix	trans	-57.8	-41.3	177.9	-64.8	177.2	-166.6	0	0	112.7	P365 N371	P365-E367 VanDerWaalsContact C-N 3.27Å; P365-E367 PolarHBondContact O-N 3.14Å; E367-N371 PolarHBondContact O-ND2 3.04Å
368	V	97.6	Very high	96.6	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-68.9	-46.1	175.2	178.7	0	0	0	0	109.7	L328 A329 T332 Q364 P365 E366 V370 N371 V372	L328-V368 HydrophobicContact CB-CG2 4.41Å; L328-V368 HydrophobicContact CD2-CG1 3.76Å; L328-V368 HydrophobicContact CD2-CG2 4.41Å; L328-V368 HydrophobicContact CG-CG1 3.86Å; L328-V368 HydrophobicContact CG-CG2 4.44Å; A329-V368 HydrophobicContact CB-CG2 3.93Å; T332-V368 HydrophobicContact CG2-CG1 4.37Å; Q364-V368 HydrophobicContact CB-CB 4.15Å; Q364-V368 HydrophobicContact CB-CG1 4.12Å; Q364-V368 HydrophobicContact CG-CG1 4.31Å; P365-V368 PolarHBondContact O-N 3.28Å; P365-V368 VanDerWaalsContact O-N 3.09Å; E366-V368 VanDerWaalsContact C-N 3.3Å; E366-V368 PolarHBondContact O-N 2.94Å; V368-V370 VanDerWaalsContact C-N 3.35Å; V368-V370 PolarHBondContact O-N 2.8Å; V368-N371 PolarHBondContact O-N 2.99Å; V368-V372 HydrophobicContact CG1-CG2 3.93Å; V368-V372 VanDerWaalsContact O-CG2 3.29Å; V368-V372 WeakPolarHBondContact O-CG2 3.42Å; V368-V372 PolarHBondContact O-N 3.4Å
369	L	97.9	Very high	96.6	Very high	8 Å²	8	32.2 Å²	32.2	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-61.5	-40.8	-178.5	-67.2	175.6	0	0	0	112.3	L360 L361 Q364 P365 E366 N371 V372 V373 L401 L409	L360-L369 WeakPolarHBondContact O-CD2 3.44Å; L361-L369 WeakPolarHBondContact O-CD2 3.28Å; Q364-L369 HydrophobicContact CB-CD2 3.96Å; Q364-L369 HydrophobicContact CB-CG 4.07Å; Q364-L369 WeakPolarHBondContact O-CD1 3.45Å; P365-L369 PolarHBondContact O-N 3.19Å; P365-L369 VanDerWaalsContact O-N 3.08Å; E366-L369 PolarHBondContact O-N 2.93Å; E366-L369 VanDerWaalsContact O-N 3.11Å; L369-N371 VanDerWaalsContact C-N 3.27Å; L369-N371 PolarHBondContact O-N 3.49Å; L369-V372 PolarHBondContact O-N 2.85Å; L369-V373 VanDerWaalsContact O-CB 3.31Å; L369-V373 WeakPolarHBondContact O-CB 3.38Å; L369-V373 WeakPolarHBondContact O-CG2 3.24Å; L369-V373 PolarHBondContact O-N 3.29Å; L369-L401 HydrophobicContact CD1-CD2 4.05Å; L369-L409 HydrophobicContact CB-CD1 3.86Å; L369-L409 HydrophobicContact CB-CD2 4.32Å; L369-L409 HydrophobicContact CD1-CD2 4.49Å
370	V	98.2	Very high	96.7	Very high	7 Å²	7	29.9 Å²	29.9	4%	0.042	15%	0.148	C	C	.	.	H	α-helix	trans	-54.7	-47.6	175.6	170.6	0	0	0	0	110	W336 E366 V368 G374 E408 L409 N412	W336-V370 HydrophobicContact CZ3-CG1 4.26Å; E366-V370 VanDerWaalsContact O-CG2 3.26Å; E366-V370 WeakPolarHBondContact O-CG2 3.43Å; E366-V370 PolarHBondContact O-N 3.02Å; V368-V370 VanDerWaalsContact C-N 3.35Å; V368-V370 PolarHBondContact O-N 2.8Å; V370-G374 PolarHBondContact O-N 3.38Å; V370-E408 HydrophobicContact CG1-CB 4.07Å; V370-E408 HydrophobicContact CG2-CB 4.2Å; V370-L409 HydrophobicContact CG2-CB 3.76Å; V370-L409 HydrophobicContact CG2-CD1 4.43Å; V370-N412 PolarHBondContact O-ND2 3.4Å
371	N	98.3	Very high	96.7	Very high	15 Å²	15	34.4 Å²	34.4	8%	0.08	17%	0.168	C	C	.	.	H	α-helix	trans	-70.9	-44.7	-178.8	-70.8	-22.6	0	0	0	112.6	A329 T332 W336 E367 V368 L369 G374 A375	A329-N371 PolarHBondContact O-ND2 3.12Å; T332-N371 WeakPolarHBondContact OG1-CB 3.35Å; W336-N371 HydrophobicContact CE3-CB 4.44Å; E367-N371 PolarHBondContact O-ND2 3.04Å; V368-N371 PolarHBondContact O-N 2.99Å; L369-N371 VanDerWaalsContact C-N 3.27Å; L369-N371 PolarHBondContact O-N 3.49Å; N371-G374 PolarHBondContact O-N 3.45Å; N371-A375 PolarHBondContact O-N 3.24Å
372	V	98.5	Very high	96.7	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.3	-51.3	177.9	170.1	0	0	0	0	110.6	T332 L357 L360 L361 V368 L369 G374 A375 L376	T332-V372 HydrophobicContact CG2-CG2 3.56Å; L357-V372 HydrophobicContact CB-CG1 4.19Å; L357-V372 HydrophobicContact CD2-CG1 4.34Å; L357-V372 HydrophobicContact CD2-CG2 4.27Å; L357-V372 VanDerWaalsContact O-CG1 3.26Å; L357-V372 WeakPolarHBondContact O-CG1 3.15Å; L360-V372 HydrophobicContact CB-CG1 4.44Å; L360-V372 HydrophobicContact CB-CG2 4.08Å; L360-V372 HydrophobicContact CD1-CG2 4.33Å; L361-V372 HydrophobicContact CD2-CG1 3.73Å; L361-V372 HydrophobicContact CG-CG1 4.26Å; V368-V372 HydrophobicContact CG1-CG2 3.93Å; V368-V372 VanDerWaalsContact O-CG2 3.29Å; V368-V372 WeakPolarHBondContact O-CG2 3.42Å; V368-V372 PolarHBondContact O-N 3.4Å; L369-V372 PolarHBondContact O-N 2.85Å; V372-G374 VanDerWaalsContact C-N 3.31Å; V372-G374 PolarHBondContact O-N 3.13Å; V372-A375 WeakPolarHBondContact O-CB 3.36Å; V372-A375 PolarHBondContact O-N 3.22Å; V372-L376 HydrophobicContact CG1-CD1 4.18Å; V372-L376 WeakPolarHBondContact O-CG 3.38Å; V372-L376 PolarHBondContact O-N 3.42Å
373	V	98.5	Very high	96.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-37	180	179.6	0	0	0	0	110.8	L361 L369 A375 L376 S377 L398 L401 L409 N412 T413 A416	L361-V373 HydrophobicContact CD2-CG2 3.59Å; L369-V373 VanDerWaalsContact O-CB 3.31Å; L369-V373 WeakPolarHBondContact O-CB 3.38Å; L369-V373 WeakPolarHBondContact O-CG2 3.24Å; L369-V373 PolarHBondContact O-N 3.29Å; V373-A375 PolarHBondContact O-N 3.13Å; V373-L376 PolarHBondContact O-N 3.38Å; V373-S377 WeakPolarHBondContact O-CB 3.37Å; V373-S377 PolarHBondContact O-N 2.97Å; V373-L398 HydrophobicContact CG1-CD2 4Å; V373-L398 HydrophobicContact CG2-CD2 4.14Å; V373-L401 HydrophobicContact CG2-CD1 3.72Å; V373-L409 HydrophobicContact CB-CD1 4.42Å; V373-L409 HydrophobicContact CG2-CD1 4.03Å; V373-N412 HydrophobicContact CB-CB 4.27Å; V373-N412 VanDerWaalsContact CG1-C 3.45Å; V373-N412 HydrophobicContact CG1-CB 3.91Å; V373-T413 VanDerWaalsContact CG1-CA 3.4Å; V373-A416 HydrophobicContact CG1-CB 4.03Å
374	G	98.3	Very high	97.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-55.2	-50	171.1	0	0	0	0	0	112	W336 V370 N371 V372 S377 E378 N412	W336-G374 VanDerWaalsContact CD1-O 3.24Å; W336-G374 VanDerWaalsContact NE1-C 3.31Å; W336-G374 PolarHBondContact NE1-O 3.32Å; V370-G374 PolarHBondContact O-N 3.38Å; N371-G374 PolarHBondContact O-N 3.45Å; V372-G374 VanDerWaalsContact C-N 3.31Å; V372-G374 PolarHBondContact O-N 3.13Å; G374-S377 PolarHBondContact O-N 3.36Å; G374-S377 PolarHBondContact O-OG 2.85Å; G374-E378 PolarHBondContact O-N 3.11Å; G374-N412 WeakPolarHBondContact CA-ND2 3.37Å
375	A	98.5	Very high	97.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-48.2	177.3	0	0	0	0	0	112	I335 W336 L357 N371 V372 V373 S377 E378 M379	I335-A375 HydrophobicContact CG2-CB 4.18Å; W336-A375 HydrophobicContact CB-CB 3.89Å; L357-A375 HydrophobicContact CD1-CB 3.88Å; N371-A375 PolarHBondContact O-N 3.24Å; V372-A375 WeakPolarHBondContact O-CB 3.36Å; V372-A375 PolarHBondContact O-N 3.22Å; V373-A375 PolarHBondContact O-N 3.13Å; A375-S377 VanDerWaalsContact C-N 3.28Å; A375-S377 PolarHBondContact O-N 3.21Å; A375-E378 PolarHBondContact O-N 2.81Å; A375-M379 WeakPolarHBondContact O-CG 3.43Å; A375-M379 PolarHBondContact O-N 3.37Å
376	L	98.6	Very high	97.5	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-38.4	177.2	-70.1	174.7	0	0	0	111.7	I354 L357 V358 L361 V372 V373 E378 M379 A380 I389	I354-L376 HydrophobicContact CG2-CD2 4.19Å; L357-L376 HydrophobicContact CB-CD1 4.48Å; L357-L376 HydrophobicContact CB-CD2 3.86Å; L357-L376 HydrophobicContact CB-CG 4.16Å; L357-L376 HydrophobicContact CD1-CD2 4.15Å; L357-L376 HydrophobicContact CD1-CG 4.42Å; V358-L376 HydrophobicContact CG2-CD1 4.33Å; V358-L376 HydrophobicContact CG2-CD2 4.35Å; L361-L376 HydrophobicContact CD1-CD1 3.88Å; L361-L376 HydrophobicContact CD2-CD1 3.94Å; L361-L376 HydrophobicContact CG-CD1 4.15Å; V372-L376 HydrophobicContact CG1-CD1 4.18Å; V372-L376 WeakPolarHBondContact O-CG 3.38Å; V372-L376 PolarHBondContact O-N 3.42Å; V373-L376 PolarHBondContact O-N 3.38Å; L376-E378 VanDerWaalsContact C-N 3.32Å; L376-E378 PolarHBondContact O-N 2.95Å; L376-M379 PolarHBondContact O-N 2.95Å; L376-A380 WeakPolarHBondContact O-CB 3.23Å; L376-A380 PolarHBondContact O-N 3.17Å; L376-I389 HydrophobicContact CD2-CD1 4.32Å; L376-I389 HydrophobicContact CD2-CG1 4.25Å
377	S	97.9	Very high	97.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64	-35.8	177.5	83.1	0	0	0	0	113	V373 G374 A375	V373-S377 WeakPolarHBondContact O-CB 3.37Å; V373-S377 PolarHBondContact O-N 2.97Å; G374-S377 PolarHBondContact O-N 3.36Å; G374-S377 PolarHBondContact O-OG 2.85Å; A375-S377 VanDerWaalsContact C-N 3.28Å; A375-S377 PolarHBondContact O-N 3.21Å
378	E	98.1	Very high	97.7	Very high	13 Å²	13	19.5 Å²	19.5	6%	0.061	11%	0.109	C	C	.	.	H	α-helix	trans	-74.8	-42.1	177	-70.6	-63.1	132	0	0	111	A339 I340 G374 A375 L376 K381 K415	A339-E378 HydrophobicContact CB-CB 4.04Å; I340-E378 HydrophobicContact CG1-CG 4.09Å; G374-E378 PolarHBondContact O-N 3.11Å; A375-E378 PolarHBondContact O-N 2.81Å; L376-E378 VanDerWaalsContact C-N 3.32Å; L376-E378 PolarHBondContact O-N 2.95Å; E378-K381 WeakPolarHBondContact O-CB 3.19Å; E378-K381 WeakPolarHBondContact O-CG 3.39Å; E378-K381 PolarHBondContact O-N 3.17Å; E378-K381 WeakPolarHBondContact OE1-CE 3.48Å; E378-K381 IonicContact OE1-NZ 2.93Å; E378-K381 PolarHBondContact OE1-NZ 3.15Å; E378-K381 WeakPolarHBondContact OE2-CE 3.29Å; E378-K381 IonicContact OE2-NZ 3.01Å; E378-K381 PolarHBondContact OE2-NZ 3.3Å; E378-K415 IonicContact OE1-NZ 2.68Å; E378-K415 PolarHBondContact OE1-NZ 3.07Å
379	M	98.3	Very high	97.8	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-66.3	-37.4	176.1	-66.6	179.7	-174.1	0	0	112.4	I335 A339 V345 F348 T353 I354 L357 A375 L376 K381 D382 N385	I335-M379 HydrophobicContact CG2-CE 3.8Å; A339-M379 HydrophobicContact CB-CE 3.92Å; A339-M379 HydrophobicContact CB-CG 4.05Å; V345-M379 HydrophobicContact CG1-CB 4.44Å; V345-M379 HydrophobicContact CG1-CG 4.39Å; V345-M379 HydrophobicContact CG2-CG 4.32Å; F348-M379 HydrophobicContact CB-CE 3.8Å; F348-M379 HydrophobicContact CD1-CE 4.47Å; F348-M379 HydrophobicContact CD2-CE 3.61Å; F348-M379 HydrophobicContact CE2-CE 4.23Å; F348-M379 HydrophobicContact CG-CE 3.74Å; T353-M379 HydrophobicContact CG2-CE 4.08Å; I354-M379 HydrophobicContact CG1-SD 3.83Å; L357-M379 HydrophobicContact CD1-CE 4.01Å; L357-M379 HydrophobicContact CD1-SD 4.09Å; A375-M379 WeakPolarHBondContact O-CG 3.43Å; A375-M379 PolarHBondContact O-N 3.37Å; L376-M379 PolarHBondContact O-N 2.95Å; M379-K381 PolarHBondContact O-N 3.32Å; M379-K381 VanDerWaalsContact O-N 3.13Å; M379-D382 PolarHBondContact O-N 2.92Å; M379-D382 VanDerWaalsContact O-N 3.12Å; M379-N385 VanDerWaalsContact O-CB 3.27Å; M379-N385 WeakPolarHBondContact O-CB 3.49Å; M379-N385 PolarHBondContact O-ND2 2.96Å
380	A	97.9	Very high	97.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-7.4	178.2	0	0	0	0	0	113.7	L376 D382 R386 I389 K419	L376-A380 WeakPolarHBondContact O-CB 3.23Å; L376-A380 PolarHBondContact O-N 3.17Å; A380-D382 PolarHBondContact O-N 3.41Å; A380-R386 HydrophobicContact CB-CG 4.39Å; A380-R386 VanDerWaalsContact O-CG 3.32Å; A380-R386 WeakPolarHBondContact O-CG 3.33Å; A380-R386 PolarHBondContact O-NE 3.46Å; A380-I389 HydrophobicContact CB-CD1 3.77Å; A380-K419 HydrophobicContact CB-CB 3.8Å
381	K	96.9	Very high	97.7	Very high	98 Å²	98	29 Å²	29	43%	0.426	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-32.1	168.7	-67.4	176.4	-179.9	173.3	0	111.3	E378 M379 R386 K419	E378-K381 WeakPolarHBondContact O-CB 3.19Å; E378-K381 WeakPolarHBondContact O-CG 3.39Å; E378-K381 PolarHBondContact O-N 3.17Å; E378-K381 WeakPolarHBondContact OE1-CE 3.48Å; E378-K381 IonicContact OE1-NZ 2.93Å; E378-K381 PolarHBondContact OE1-NZ 3.15Å; E378-K381 WeakPolarHBondContact OE2-CE 3.29Å; E378-K381 IonicContact OE2-NZ 3.01Å; E378-K381 PolarHBondContact OE2-NZ 3.3Å; M379-K381 PolarHBondContact O-N 3.32Å; M379-K381 VanDerWaalsContact O-N 3.13Å; K381-R386 PolarHBondContact O-NH2 3.18Å; K381-R386 VanDerWaalsContact O-NH2 3.16Å; K381-K419 HydrophobicContact CG-CD 4.32Å
382	D	96.4	Very high	97.7	Very high	55 Å²	55	30 Å²	30	29%	0.294	16%	0.159	S	C	.	.	S	Bend	trans	-79.5	127.7	173.1	-167.7	-71	0	0	0	110.8	M379 A380 S384 N385 R386	M379-D382 PolarHBondContact O-N 2.92Å; M379-D382 VanDerWaalsContact O-N 3.12Å; A380-D382 PolarHBondContact O-N 3.41Å; D382-S384 VanDerWaalsContact C-N 3.3Å; D382-S384 PolarHBondContact O-N 2.84Å; D382-S384 WeakPolarHBondContact OD1-CB 3.41Å; D382-S384 PolarHBondContact OD1-N 2.86Å; D382-S384 PolarHBondContact OD1-OG 3.15Å; D382-N385 HydrophobicContact CB-CB 4.33Å; D382-N385 PolarHBondContact O-N 3.37Å; D382-R386 PolarHBondContact O-N 3.27Å
383	P	95.9	Very high	97.6	Very high	82 Å²	82	31.8 Å²	31.8	53%	0.532	18%	0.177	S	C	.	.	H	α-helix	trans	-56.7	-37.5	179.7	-27	35.6	0	0	0	114.5	N385 R386	P383-N385 VanDerWaalsContact C-N 3.27Å; P383-N385 PolarHBondContact O-N 2.86Å; P383-R386 WeakPolarHBondContact O-CB 3.49Å; P383-R386 PolarHBondContact O-N 3.31Å
384	S	96.4	Very high	97.6	Very high	46 Å²	46	31.8 Å²	31.8	32%	0.322	18%	0.177	S	C	.	.	H	α-helix	trans	-67.1	-30.7	-178	68.2	0	0	0	0	112.6	Q349 D382 T388	Q349-S384 PolarHBondContact NE2-OG 3.38Å; D382-S384 VanDerWaalsContact C-N 3.3Å; D382-S384 PolarHBondContact O-N 2.84Å; D382-S384 WeakPolarHBondContact OD1-CB 3.41Å; D382-S384 PolarHBondContact OD1-N 2.86Å; D382-S384 PolarHBondContact OD1-OG 3.15Å; S384-T388 PolarHBondContact O-N 3.29Å; S384-T388 PolarHBondContact O-OG1 2.85Å
385	N	97.6	Very high	97.6	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-74.3	-29.3	177.2	-69.8	-19.3	0	0	0	112.2	V345 I354 M379 D382 P383 T388 I389	V345-N385 WeakPolarHBondContact CG1-ND2 3.29Å; I354-N385 HydrophobicContact CD1-CB 3.56Å; I354-N385 VanDerWaalsContact CD1-OD1 3.29Å; I354-N385 WeakPolarHBondContact CD1-OD1 3.49Å; M379-N385 VanDerWaalsContact O-CB 3.27Å; M379-N385 WeakPolarHBondContact O-CB 3.49Å; M379-N385 PolarHBondContact O-ND2 2.96Å; D382-N385 HydrophobicContact CB-CB 4.33Å; D382-N385 PolarHBondContact O-N 3.37Å; P383-N385 VanDerWaalsContact C-N 3.27Å; P383-N385 PolarHBondContact O-N 2.86Å; N385-T388 WeakPolarHBondContact O-CB 3.29Å; N385-T388 PolarHBondContact O-N 3.26Å; N385-T388 VanDerWaalsContact O-N 3.16Å; N385-I389 VanDerWaalsContact O-CG1 3.3Å; N385-I389 WeakPolarHBondContact O-CG1 3.4Å; N385-I389 PolarHBondContact O-N 2.84Å
386	R	97.7	Very high	97.5	Very high	23 Å²	23	34.9 Å²	34.9	9%	0.087	20%	0.197	C	C	.	.	H	α-helix	trans	-62	-45.8	175.1	-59.5	168.8	-163.6	-178.6	-6.5	110.8	A380 K381 D382 P383 T388 I389 R390 K419 E422 E423	A380-R386 HydrophobicContact CB-CG 4.39Å; A380-R386 VanDerWaalsContact O-CG 3.32Å; A380-R386 WeakPolarHBondContact O-CG 3.33Å; A380-R386 PolarHBondContact O-NE 3.46Å; K381-R386 PolarHBondContact O-NH2 3.18Å; K381-R386 VanDerWaalsContact O-NH2 3.16Å; D382-R386 PolarHBondContact O-N 3.27Å; P383-R386 WeakPolarHBondContact O-CB 3.49Å; P383-R386 PolarHBondContact O-N 3.31Å; R386-T388 PolarHBondContact O-N 3.38Å; R386-I389 PolarHBondContact O-N 2.88Å; R386-R390 PolarHBondContact O-N 3.16Å; R386-K419 WeakPolarHBondContact CD-O 3.47Å; R386-K419 PolarHBondContact NE-O 3.2Å; R386-E422 IonicContact CZ-OE2 3.29Å; R386-E422 IonicContact NH1-OE2 3.1Å; R386-E422 PolarHBondContact NH1-OE2 2.72Å; R386-E422 IonicContact NH2-OE1 2.64Å; R386-E422 IonicContact NH2-OE2 3.88Å; R386-E422 PolarHBondContact NH2-OE2 2.84Å; R386-E423 WeakPolarHBondContact CB-OE2 3.11Å
387	S	97.3	Very high	97.5	Very high	28 Å²	28	35.4 Å²	35.4	20%	0.196	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-34.3	175.1	-44.9	0	0	0	0	112	K391 E423	S387-K391 WeakPolarHBondContact O-CB 3.15Å; S387-K391 VanDerWaalsContact O-CG 3.23Å; S387-K391 WeakPolarHBondContact O-CG 3.34Å; S387-K391 PolarHBondContact O-N 3.46Å; S387-E423 PolarHBondContact N-OE2 3.4Å; S387-E423 PolarHBondContact OG-OE1 3.04Å; S387-E423 PolarHBondContact OG-OE2 3.01Å
388	T	97.7	Very high	97.5	Very high	30 Å²	30	35.5 Å²	35.5	18%	0.184	20%	0.201	C	C	.	.	H	α-helix	trans	-68.4	-45.8	175.9	-52.8	0	0	0	0	111.5	I354 E355 S384 N385 R386 R390 K391 A392	I354-T388 HydrophobicContact CB-CG2 4.06Å; I354-T388 HydrophobicContact CD1-CG2 4.21Å; I354-T388 HydrophobicContact CG2-CG2 3.89Å; E355-T388 WeakPolarHBondContact OE1-CG2 3.47Å; S384-T388 PolarHBondContact O-N 3.29Å; S384-T388 PolarHBondContact O-OG1 2.85Å; N385-T388 WeakPolarHBondContact O-CB 3.29Å; N385-T388 PolarHBondContact O-N 3.26Å; N385-T388 VanDerWaalsContact O-N 3.16Å; R386-T388 PolarHBondContact O-N 3.38Å; T388-R390 VanDerWaalsContact C-N 3.31Å; T388-R390 PolarHBondContact O-N 3.37Å; T388-K391 PolarHBondContact O-N 2.92Å; T388-A392 WeakPolarHBondContact O-CB 3.31Å; T388-A392 PolarHBondContact O-N 3.19Å
389	I	98.2	Very high	97.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.5	-43.4	174.1	-67.3	165.7	0	0	0	110.8	I354 L376 A380 N385 R386 A392 G393 G394 L398	I354-I389 HydrophobicContact CG2-CB 4.44Å; I354-I389 HydrophobicContact CG2-CG1 3.51Å; L376-I389 HydrophobicContact CD2-CD1 4.32Å; L376-I389 HydrophobicContact CD2-CG1 4.25Å; A380-I389 HydrophobicContact CB-CD1 3.77Å; N385-I389 VanDerWaalsContact O-CG1 3.3Å; N385-I389 WeakPolarHBondContact O-CG1 3.4Å; N385-I389 PolarHBondContact O-N 2.84Å; R386-I389 PolarHBondContact O-N 2.88Å; I389-A392 PolarHBondContact O-N 2.94Å; I389-G393 PolarHBondContact O-N 3.37Å; I389-G394 PolarHBondContact O-N 3.14Å; I389-L398 HydrophobicContact CG2-CD1 4.27Å
390	R	97.8	Very high	97.5	Very high	39 Å²	39	37.8 Å²	37.8	15%	0.147	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-52.1	175.7	-179.8	172.7	69.6	-92.9	11.2	111.5	R386 T388 A392 G393 I395 E423 D425 S426 I429	R386-R390 PolarHBondContact O-N 3.16Å; T388-R390 VanDerWaalsContact C-N 3.31Å; T388-R390 PolarHBondContact O-N 3.37Å; R390-A392 VanDerWaalsContact C-N 3.26Å; R390-A392 PolarHBondContact O-N 2.9Å; R390-G393 PolarHBondContact O-N 3.21Å; R390-I395 HydrophobicContact CB-CD1 3.87Å; R390-I395 HydrophobicContact CG-CD1 3.94Å; R390-E423 IonicContact CZ-OE1 2.65Å; R390-E423 IonicContact CZ-OE2 3.15Å; R390-E423 IonicContact NH1-OE1 3.27Å; R390-E423 PolarHBondContact NH1-OE1 3.46Å; R390-E423 IonicContact NH1-OE2 2.85Å; R390-E423 PolarHBondContact NH1-OE2 3.27Å; R390-E423 IonicContact NH2-OE1 2.8Å; R390-E423 PolarHBondContact NH2-OE1 3.05Å; R390-E423 IonicContact NH2-OE2 3.24Å; R390-D425 IonicContact CZ-OD2 2.7Å; R390-D425 IonicContact NE-OD2 3.24Å; R390-D425 IonicContact NH2-OD2 3.96Å; R390-D425 PolarHBondContact NH2-OD2 2.87Å; R390-S426 PolarHBondContact NH1-OG 3.28Å; R390-I429 HydrophobicContact CG-CD1 3.7Å
391	K	97.4	Very high	97.5	Very high	176 Å²	176	37.9 Å²	37.9	77%	0.765	22%	0.219	S	C	*	.	H	α-helix	trans	-62.6	-32.4	-178.5	-74.3	173.7	-177.8	180	0	112.7	S387 T388 G393	S387-K391 WeakPolarHBondContact O-CB 3.15Å; S387-K391 VanDerWaalsContact O-CG 3.23Å; S387-K391 WeakPolarHBondContact O-CG 3.34Å; S387-K391 PolarHBondContact O-N 3.46Å; T388-K391 PolarHBondContact O-N 2.92Å; K391-G393 PolarHBondContact O-N 2.99Å
392	A	97.2	Very high	97.5	Very high	38 Å²	38	33.5 Å²	33.5	31%	0.314	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-2.6	174.5	0	0	0	0	0	113.8	E355 V358 T388 I389 R390	E355-A392 HydrophobicContact CG-CB 4.3Å; V358-A392 HydrophobicContact CB-CB 4.11Å; V358-A392 HydrophobicContact CG1-CB 3.97Å; V358-A392 WeakPolarHBondContact CG1-O 3.49Å; V358-A392 HydrophobicContact CG2-CB 4.11Å; T388-A392 WeakPolarHBondContact O-CB 3.31Å; T388-A392 PolarHBondContact O-N 3.19Å; I389-A392 PolarHBondContact O-N 2.94Å; R390-A392 VanDerWaalsContact C-N 3.26Å; R390-A392 PolarHBondContact O-N 2.9Å
393	G	97.1	Very high	97.5	Very high	36 Å²	36	35.4 Å²	35.4	37%	0.371	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	21.6	-178.1	0	0	0	0	0	114	I389 R390 K391 P396	I389-G393 PolarHBondContact O-N 3.37Å; R390-G393 PolarHBondContact O-N 3.21Å; K391-G393 PolarHBondContact O-N 2.99Å; G393-P396 WeakPolarHBondContact O-CD 3.31Å
394	G	97.8	Very high	97.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-72.9	-25.8	-176.7	0	0	0	0	0	114.6	I389 S397 L398	I389-G394 PolarHBondContact O-N 3.14Å; G394-S397 PolarHBondContact O-N 3.46Å; G394-L398 VanDerWaalsContact O-CG 3.31Å; G394-L398 WeakPolarHBondContact O-CG 3.3Å; G394-L398 PolarHBondContact O-N 2.84Å
395	I	98.1	Very high	97.4	Very high	4 Å²	4	41 Å²	41	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-61.9	-50.2	-177.1	-62.8	177	0	0	0	112.1	R390 S397 L398 V399 S426 I429 I430 L433	R390-I395 HydrophobicContact CB-CD1 3.87Å; R390-I395 HydrophobicContact CG-CD1 3.94Å; I395-S397 VanDerWaalsContact C-N 3.31Å; I395-S397 PolarHBondContact O-N 3.05Å; I395-L398 PolarHBondContact O-N 3.36Å; I395-V399 HydrophobicContact CG2-CG2 4.24Å; I395-V399 WeakPolarHBondContact O-CG2 3.11Å; I395-V399 PolarHBondContact O-N 2.94Å; I395-S426 VanDerWaalsContact CD1-CB 3.4Å; I395-S426 WeakPolarHBondContact CD1-OG 3.48Å; I395-I429 HydrophobicContact CB-CG2 4.19Å; I395-I429 HydrophobicContact CD1-CD1 4.35Å; I395-I429 HydrophobicContact CG2-CB 4.22Å; I395-I429 HydrophobicContact CG2-CG2 3.7Å; I395-I430 HydrophobicContact CG2-CD1 4.44Å; I395-I430 HydrophobicContact CG2-CG1 3.58Å; I395-L433 HydrophobicContact CG2-CD1 4.45Å
396	P	98.1	Very high	97.4	Very high	61 Å²	61	43 Å²	43	40%	0.396	24%	0.24	S	C	.	.	H	α-helix	trans	-50.7	-47	173.2	-28	31.8	0	0	0	114.2	G393 V399 S400 L433	G393-P396 WeakPolarHBondContact O-CD 3.31Å; P396-V399 PolarHBondContact O-N 3.4Å; P396-S400 PolarHBondContact O-N 3.42Å; P396-L433 HydrophobicContact CB-CD1 4.12Å; P396-L433 HydrophobicContact CG-CD1 4.07Å
397	S	97.8	Very high	97.3	Very high	13 Å²	13	45 Å²	45	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-45.6	178.7	-52.2	0	0	0	0	111.3	G394 I395 V399 S400 L401	G394-S397 PolarHBondContact O-N 3.46Å; I395-S397 VanDerWaalsContact C-N 3.31Å; I395-S397 PolarHBondContact O-N 3.05Å; S397-V399 PolarHBondContact O-N 3.14Å; S397-S400 PolarHBondContact O-N 2.84Å; S397-S400 PolarHBondContact O-OG 2.68Å; S397-L401 WeakPolarHBondContact O-CG 3.42Å; S397-L401 PolarHBondContact O-N 3.03Å; S397-L401 VanDerWaalsContact O-N 3.1Å
398	L	98.2	Very high	97.3	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-42.4	177	-70.4	172.9	0	0	0	112.5	L361 V373 I389 G394 I395 S400 L401 L402 T413 A416 V417	L361-L398 HydrophobicContact CD1-CD2 4.3Å; L361-L398 HydrophobicContact CD1-CG 4.24Å; L361-L398 HydrophobicContact CD2-CD2 4.24Å; V373-L398 HydrophobicContact CG1-CD2 4Å; V373-L398 HydrophobicContact CG2-CD2 4.14Å; I389-L398 HydrophobicContact CG2-CD1 4.27Å; G394-L398 VanDerWaalsContact O-CG 3.31Å; G394-L398 WeakPolarHBondContact O-CG 3.3Å; G394-L398 PolarHBondContact O-N 2.84Å; I395-L398 PolarHBondContact O-N 3.36Å; L398-S400 VanDerWaalsContact C-N 3.33Å; L398-S400 PolarHBondContact O-N 3.39Å; L398-L401 PolarHBondContact O-N 3.24Å; L398-L402 PolarHBondContact O-N 3.39Å; L398-T413 WeakPolarHBondContact O-CG2 3.46Å; L398-A416 HydrophobicContact CD1-CB 4.25Å; L398-A416 HydrophobicContact CD2-CB 4.13Å; L398-V417 HydrophobicContact CB-CG2 3.87Å
399	V	98.1	Very high	97.3	Very high	6 Å²	6	48.7 Å²	48.7	4%	0.036	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-40.7	176.5	174	0	0	0	0	110.7	I395 P396 S397 L401 L402 I430 L433 L438	I395-V399 HydrophobicContact CG2-CG2 4.24Å; I395-V399 WeakPolarHBondContact O-CG2 3.11Å; I395-V399 PolarHBondContact O-N 2.94Å; P396-V399 PolarHBondContact O-N 3.4Å; S397-V399 PolarHBondContact O-N 3.14Å; V399-L401 VanDerWaalsContact C-N 3.28Å; V399-L401 PolarHBondContact O-N 3.12Å; V399-L402 WeakPolarHBondContact O-CB 3.49Å; V399-L402 PolarHBondContact O-N 3.32Å; V399-I430 HydrophobicContact CG2-CG1 4.32Å; V399-L433 HydrophobicContact CB-CB 4.43Å; V399-L433 HydrophobicContact CB-CD1 4.29Å; V399-L433 HydrophobicContact CG1-CB 3.93Å; V399-L433 HydrophobicContact CG2-CB 4.46Å; V399-L433 HydrophobicContact CG2-CD1 4.15Å; V399-L438 HydrophobicContact CG1-CD1 4.04Å
400	S	97.4	Very high	97.3	Very high	55 Å²	55	48.8 Å²	48.8	39%	0.385	26%	0.263	S	S	.	.	H	α-helix	trans	-61.3	-36	176.5	82.2	0	0	0	0	112.7	P396 S397 L398 L402 T403	P396-S400 PolarHBondContact O-N 3.42Å; S397-S400 PolarHBondContact O-N 2.84Å; S397-S400 PolarHBondContact O-OG 2.68Å; L398-S400 VanDerWaalsContact C-N 3.33Å; L398-S400 PolarHBondContact O-N 3.39Å; S400-L402 PolarHBondContact O-N 3.49Å; S400-T403 PolarHBondContact O-N 3.16Å; S400-T403 PolarHBondContact O-OG1 3.31Å
401	L	97.6	Very high	97.3	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-69.6	-18.6	-180	-68.2	175.3	0	0	0	113.3	L361 L369 V373 S397 L398 V399 T403 R404 L409 T413	L361-L401 HydrophobicContact CD2-CD1 4Å; L369-L401 HydrophobicContact CD1-CD2 4.05Å; V373-L401 HydrophobicContact CG2-CD1 3.72Å; S397-L401 WeakPolarHBondContact O-CG 3.42Å; S397-L401 PolarHBondContact O-N 3.03Å; S397-L401 VanDerWaalsContact O-N 3.1Å; L398-L401 PolarHBondContact O-N 3.24Å; V399-L401 VanDerWaalsContact C-N 3.28Å; V399-L401 PolarHBondContact O-N 3.12Å; L401-T403 PolarHBondContact O-N 3.5Å; L401-T403 VanDerWaalsContact O-N 3.14Å; L401-R404 HydrophobicContact CD2-CG 4.2Å; L401-R404 WeakPolarHBondContact O-CB 3.32Å; L401-R404 WeakPolarHBondContact O-CG 3.46Å; L401-R404 PolarHBondContact O-N 3.38Å; L401-R404 VanDerWaalsContact O-N 3.15Å; L401-L409 HydrophobicContact CD2-CD2 4.46Å; L401-T413 HydrophobicContact CB-CG2 3.72Å
402	L	97.5	Very high	97.3	Very high	6 Å²	6	40 Å²	40	3%	0.031	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-14.2	173.4	-63.4	174.4	0	0	0	113.1	L398 V399 S400 L410 T413 V417 L438 L439 L442	L398-L402 PolarHBondContact O-N 3.39Å; V399-L402 WeakPolarHBondContact O-CB 3.49Å; V399-L402 PolarHBondContact O-N 3.32Å; S400-L402 PolarHBondContact O-N 3.49Å; L402-L410 WeakPolarHBondContact O-CD2 3.45Å; L402-T413 HydrophobicContact CD2-CG2 3.59Å; L402-T413 HydrophobicContact CG-CG2 3.97Å; L402-V417 HydrophobicContact CD1-CG1 4.48Å; L402-V417 HydrophobicContact CD1-CG2 4.22Å; L402-V417 HydrophobicContact CD2-CG2 4.32Å; L402-V417 HydrophobicContact CG-CG2 4.37Å; L402-L438 HydrophobicContact CB-CB 4.11Å; L402-L438 HydrophobicContact CB-CD1 4.09Å; L402-L438 HydrophobicContact CD1-CB 4.08Å; L402-L438 HydrophobicContact CD1-CD1 4.46Å; L402-L439 HydrophobicContact CD1-CD2 4.07Å; L402-L439 HydrophobicContact CD1-CG 4.29Å; L402-L439 HydrophobicContact CD2-CD2 4.19Å; L402-L442 HydrophobicContact CB-CD1 4.38Å; L402-L442 HydrophobicContact CD2-CD1 3.85Å
403	T	96.2	Very high	97.4	Very high	94 Å²	94	38.1 Å²	38.1	58%	0.577	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-6.4	177.7	66.7	0	0	0	0	113.8	S400 L401 L438	S400-T403 PolarHBondContact O-N 3.16Å; S400-T403 PolarHBondContact O-OG1 3.31Å; L401-T403 PolarHBondContact O-N 3.5Å; L401-T403 VanDerWaalsContact O-N 3.14Å; T403-L438 HydrophobicContact CG2-CD1 3.94Å; T403-L438 HydrophobicContact CG2-CD2 4.13Å
404	R	95.7	Very high	97.4	Very high	133 Å²	133	36.4 Å²	36.4	50%	0.502	20%	0.196	S	C	.	.			trans	-74	165	179.9	-61.2	-65.2	-177.1	174.1	-0.8	111.5	L401 L409 L410	L401-R404 HydrophobicContact CD2-CG 4.2Å; L401-R404 WeakPolarHBondContact O-CB 3.32Å; L401-R404 WeakPolarHBondContact O-CG 3.46Å; L401-R404 PolarHBondContact O-N 3.38Å; L401-R404 VanDerWaalsContact O-N 3.15Å; R404-L409 HydrophobicContact CB-CD2 4.06Å; R404-L409 HydrophobicContact CG-CD2 4.04Å; R404-L410 WeakPolarHBondContact O-CD1 3.46Å; R404-L410 WeakPolarHBondContact O-CD2 3.48Å; R404-L410 WeakPolarHBondContact O-CG 3.45Å
405	T	95.5	Very high	97.4	Very high	113 Å²	113	38.1 Å²	38.1	69%	0.693	20%	0.203	S	C	*	.			trans	-103.6	-15.9	-176.8	50.6	0	0	0	0	113.8	Q407	T405-Q407 PolarHBondContact O-N 3.37Å; T405-Q407 PolarHBondContact O-NE2 3.06Å
406	N	96.4	Very high	97.4	Very high	42 Å²	42	38 Å²	38	23%	0.225	20%	0.202	C	C	.	.			trans	-66	121.7	178.9	-176.6	-56.2	0	0	0	111	E366 E408 L409 L410	E366-N406 VanDerWaalsContact OE2-CB 3.26Å; E366-N406 WeakPolarHBondContact OE2-CB 3.5Å; E366-N406 PolarHBondContact OE2-ND2 3.34Å; N406-E408 PolarHBondContact OD1-N 2.9Å; N406-E408 VanDerWaalsContact OD1-N 3.08Å; N406-L409 HydrophobicContact CB-CB 3.89Å; N406-L409 PolarHBondContact O-N 3.33Å; N406-L409 PolarHBondContact OD1-N 2.83Å; N406-L410 WeakPolarHBondContact O-CB 3.18Å; N406-L410 VanDerWaalsContact O-CG 3.31Å; N406-L410 WeakPolarHBondContact O-CG 3.28Å; N406-L410 PolarHBondContact O-N 3.49Å
407	Q	97.1	Very high	97.5	Very high	65 Å²	65	35.2 Å²	35.2	30%	0.304	18%	0.184	S	C	.	.	H	α-helix	trans	-70.2	-37.1	-170.6	-58.5	-59.1	-48.5	0	0	113.1	T405 T411 N445	T405-Q407 PolarHBondContact O-N 3.37Å; T405-Q407 PolarHBondContact O-NE2 3.06Å; Q407-T411 WeakPolarHBondContact O-CB 3.11Å; Q407-T411 PolarHBondContact O-N 3.1Å; Q407-T411 PolarHBondContact O-OG1 3.29Å; Q407-N445 PolarHBondContact OE1-ND2 3.06Å; Q407-N445 PolarHBondContact OE1-OD1 3.06Å
408	E	96.6	Very high	97.5	Very high	136 Å²	136	34.9 Å²	34.9	64%	0.636	18%	0.183	S	C	*	.	H	α-helix	trans	-69.6	-41.4	177.2	-62.2	-167.8	171.2	0	0	110.8	V370 N406 T411 N412	V370-E408 HydrophobicContact CG1-CB 4.07Å; V370-E408 HydrophobicContact CG2-CB 4.2Å; N406-E408 PolarHBondContact OD1-N 2.9Å; N406-E408 VanDerWaalsContact OD1-N 3.08Å; E408-T411 WeakPolarHBondContact O-CB 3.24Å; E408-T411 PolarHBondContact O-N 3.44Å; E408-N412 PolarHBondContact O-N 3.14Å
409	L	97.8	Very high	97.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-47.6	175.5	-179.9	56.9	0	0	0	110.8	L369 V370 V373 L401 R404 N406 T411 N412 T413	L369-L409 HydrophobicContact CB-CD1 3.86Å; L369-L409 HydrophobicContact CB-CD2 4.32Å; L369-L409 HydrophobicContact CD1-CD2 4.49Å; V370-L409 HydrophobicContact CG2-CB 3.76Å; V370-L409 HydrophobicContact CG2-CD1 4.43Å; V373-L409 HydrophobicContact CB-CD1 4.42Å; V373-L409 HydrophobicContact CG2-CD1 4.03Å; L401-L409 HydrophobicContact CD2-CD2 4.46Å; R404-L409 HydrophobicContact CB-CD2 4.06Å; R404-L409 HydrophobicContact CG-CD2 4.04Å; N406-L409 HydrophobicContact CB-CB 3.89Å; N406-L409 PolarHBondContact O-N 3.33Å; N406-L409 PolarHBondContact OD1-N 2.83Å; L409-T411 VanDerWaalsContact C-N 3.32Å; L409-T411 PolarHBondContact O-N 3.35Å; L409-N412 PolarHBondContact O-N 3.09Å; L409-T413 VanDerWaalsContact O-CB 3.26Å; L409-T413 WeakPolarHBondContact O-CB 2.99Å; L409-T413 PolarHBondContact O-N 2.86Å; L409-T413 PolarHBondContact O-OG1 3.45Å
410	L	97.8	Very high	97.4	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-42.6	177.1	-77.3	178.5	0	0	0	111.7	L402 R404 N406 N412 T413 T414 L442 V450	L402-L410 WeakPolarHBondContact O-CD2 3.45Å; R404-L410 WeakPolarHBondContact O-CD1 3.46Å; R404-L410 WeakPolarHBondContact O-CD2 3.48Å; R404-L410 WeakPolarHBondContact O-CG 3.45Å; N406-L410 WeakPolarHBondContact O-CB 3.18Å; N406-L410 VanDerWaalsContact O-CG 3.31Å; N406-L410 WeakPolarHBondContact O-CG 3.28Å; N406-L410 PolarHBondContact O-N 3.49Å; L410-N412 PolarHBondContact O-N 2.96Å; L410-T413 PolarHBondContact O-N 3.22Å; L410-T414 WeakPolarHBondContact O-CB 3.21Å; L410-T414 PolarHBondContact O-N 3.42Å; L410-T414 PolarHBondContact O-OG1 3Å; L410-L442 HydrophobicContact CD1-CD2 3.95Å; L410-L442 HydrophobicContact CD2-CD1 4.32Å; L410-L442 HydrophobicContact CD2-CD2 3.97Å; L410-V450 HydrophobicContact CB-CG1 4.12Å; L410-V450 HydrophobicContact CB-CG2 3.95Å; L410-V450 HydrophobicContact CD1-CG1 4.36Å
411	T	97.6	Very high	97.5	Very high	17 Å²	17	34.9 Å²	34.9	10%	0.104	18%	0.176	C	C	.	.	H	α-helix	trans	-56.3	-51.7	176.5	-62.1	0	0	0	0	110.7	Q407 E408 L409 K415 K449 V450 Y453	Q407-T411 WeakPolarHBondContact O-CB 3.11Å; Q407-T411 PolarHBondContact O-N 3.1Å; Q407-T411 PolarHBondContact O-OG1 3.29Å; E408-T411 WeakPolarHBondContact O-CB 3.24Å; E408-T411 PolarHBondContact O-N 3.44Å; L409-T411 VanDerWaalsContact C-N 3.32Å; L409-T411 PolarHBondContact O-N 3.35Å; T411-K415 WeakPolarHBondContact O-CB 3.12Å; T411-K415 PolarHBondContact O-N 2.86Å; T411-K449 HydrophobicContact CG2-CB 4.34Å; T411-V450 WeakPolarHBondContact OG1-CG2 3.24Å; T411-Y453 HydrophobicContact CG2-CD2 3.54Å; T411-Y453 HydrophobicContact CG2-CE2 3.56Å
412	N	98.1	Very high	97.5	Very high	13 Å²	13	38.1 Å²	38.1	7%	0.07	19%	0.191	C	C	.	.	H	α-helix	trans	-67.9	-41	179.9	-75.7	-11.1	0	0	0	112.3	W336 V370 V373 G374 E408 L409 L410 K415 A416	W336-N412 WeakPolarHBondContact CH2-ND2 3.47Å; W336-N412 WeakPolarHBondContact CZ2-ND2 3.39Å; V370-N412 PolarHBondContact O-ND2 3.4Å; V373-N412 HydrophobicContact CB-CB 4.27Å; V373-N412 VanDerWaalsContact CG1-C 3.45Å; V373-N412 HydrophobicContact CG1-CB 3.91Å; G374-N412 WeakPolarHBondContact CA-ND2 3.37Å; E408-N412 PolarHBondContact O-N 3.14Å; L409-N412 PolarHBondContact O-N 3.09Å; L410-N412 PolarHBondContact O-N 2.96Å; N412-K415 PolarHBondContact O-N 3.46Å; N412-A416 WeakPolarHBondContact O-CB 3.37Å; N412-A416 PolarHBondContact O-N 3.25Å
413	T	98.3	Very high	97.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-47.2	-178.9	-55	0	0	0	0	110.8	V373 L398 L401 L402 L409 L410 K415 A416 V417	V373-T413 VanDerWaalsContact CG1-CA 3.4Å; L398-T413 WeakPolarHBondContact O-CG2 3.46Å; L401-T413 HydrophobicContact CB-CG2 3.72Å; L402-T413 HydrophobicContact CD2-CG2 3.59Å; L402-T413 HydrophobicContact CG-CG2 3.97Å; L409-T413 VanDerWaalsContact O-CB 3.26Å; L409-T413 WeakPolarHBondContact O-CB 2.99Å; L409-T413 PolarHBondContact O-N 2.86Å; L409-T413 PolarHBondContact O-OG1 3.45Å; L410-T413 PolarHBondContact O-N 3.22Å; T413-K415 VanDerWaalsContact C-N 3.3Å; T413-K415 PolarHBondContact O-N 2.93Å; T413-A416 PolarHBondContact O-N 3.15Å; T413-A416 VanDerWaalsContact O-N 3.14Å; T413-V417 HydrophobicContact CG2-CG2 4.34Å; T413-V417 WeakPolarHBondContact O-CG2 3.32Å; T413-V417 PolarHBondContact O-N 3.37Å
414	T	98.2	Very high	97.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-42.7	179	-54.5	0	0	0	0	111.1	L410 G418 L439 Y453 A454 A457	L410-T414 WeakPolarHBondContact O-CB 3.21Å; L410-T414 PolarHBondContact O-N 3.42Å; L410-T414 PolarHBondContact O-OG1 3Å; T414-G418 PolarHBondContact O-N 3.38Å; T414-L439 HydrophobicContact CG2-CD2 3.74Å; T414-Y453 WeakPolarHBondContact CG2-O 3.27Å; T414-A454 HydrophobicContact CG2-CB 4.03Å; T414-A454 VanDerWaalsContact CG2-N 3.29Å; T414-A457 HydrophobicContact CG2-CB 3.98Å
415	K	97.9	Very high	97.4	Very high	36 Å²	36	35.8 Å²	35.8	16%	0.157	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-43.9	174.1	-176.2	-178.4	171.3	-172	0	112.4	E378 T411 N412 T413 K419 Y453	E378-K415 IonicContact OE1-NZ 2.68Å; E378-K415 PolarHBondContact OE1-NZ 3.07Å; T411-K415 WeakPolarHBondContact O-CB 3.12Å; T411-K415 PolarHBondContact O-N 2.86Å; N412-K415 PolarHBondContact O-N 3.46Å; T413-K415 VanDerWaalsContact C-N 3.3Å; T413-K415 PolarHBondContact O-N 2.93Å; K415-K419 WeakPolarHBondContact O-CG 3.4Å; K415-K419 PolarHBondContact O-N 3.38Å; K415-Y453 HydrophobicContact CB-CD1 3.91Å; K415-Y453 HydrophobicContact CB-CE1 4.15Å; K415-Y453 HydrophobicContact CB-CG 4.42Å; K415-Y453 HydrophobicContact CD-CD1 4.45Å; K415-Y453 HydrophobicContact CD-CE1 3.85Å; K415-Y453 HydrophobicContact CG-CD1 4.16Å; K415-Y453 HydrophobicContact CG-CE1 3.98Å
416	A	98.3	Very high	97.4	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-46.2	178.4	0	0	0	0	0	112	V373 L398 N412 T413 K419 C420	V373-A416 HydrophobicContact CG1-CB 4.03Å; L398-A416 HydrophobicContact CD1-CB 4.25Å; L398-A416 HydrophobicContact CD2-CB 4.13Å; N412-A416 WeakPolarHBondContact O-CB 3.37Å; N412-A416 PolarHBondContact O-N 3.25Å; T413-A416 PolarHBondContact O-N 3.15Å; T413-A416 VanDerWaalsContact O-N 3.14Å; A416-K419 PolarHBondContact O-N 2.96Å; A416-C420 PolarHBondContact O-N 3.11Å; A416-C420 PolarHBondContact O-SG 3.02Å
417	V	98.4	Very high	97.5	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-46.8	176.6	172.8	0	0	0	0	110.4	L398 L402 T413 K419 C420 A421 I430 L439	L398-V417 HydrophobicContact CB-CG2 3.87Å; L402-V417 HydrophobicContact CD1-CG1 4.48Å; L402-V417 HydrophobicContact CD1-CG2 4.22Å; L402-V417 HydrophobicContact CD2-CG2 4.32Å; L402-V417 HydrophobicContact CG-CG2 4.37Å; T413-V417 HydrophobicContact CG2-CG2 4.34Å; T413-V417 WeakPolarHBondContact O-CG2 3.32Å; T413-V417 PolarHBondContact O-N 3.37Å; V417-K419 VanDerWaalsContact C-N 3.33Å; V417-K419 PolarHBondContact O-N 2.65Å; V417-C420 PolarHBondContact O-N 3.1Å; V417-C420 VanDerWaalsContact O-N 3.15Å; V417-A421 WeakPolarHBondContact O-CB 3.29Å; V417-A421 PolarHBondContact O-N 2.85Å; V417-I430 HydrophobicContact CG1-CD1 3.99Å; V417-I430 HydrophobicContact CG1-CG1 4.44Å; V417-I430 HydrophobicContact CG1-CG2 4.32Å; V417-L439 HydrophobicContact CG1-CD1 4.23Å
418	G	97.9	Very high	97.4	Very high	6 Å²	6	27.2 Å²	27.2	6%	0.062	15%	0.145	C	C	.	.	H	α-helix	trans	-58.4	-41.7	176.1	0	0	0	0	0	113	T414 A421 P460	T414-G418 PolarHBondContact O-N 3.38Å; G418-A421 PolarHBondContact O-N 3.23Å; G418-P460 VanDerWaalsContact O-CG 3.22Å; G418-P460 WeakPolarHBondContact O-CG 3.17Å
419	K	97.9	Very high	97.5	Very high	63 Å²	63	23.4 Å²	23.4	27%	0.274	13%	0.129	S	C	.	.	H	α-helix	trans	-67.1	-36.7	176	-71.9	-71.9	150.7	-155.7	0	112.9	A380 K381 R386 K415 A416 V417 E422	A380-K419 HydrophobicContact CB-CB 3.8Å; K381-K419 HydrophobicContact CG-CD 4.32Å; R386-K419 WeakPolarHBondContact CD-O 3.47Å; R386-K419 PolarHBondContact NE-O 3.2Å; K415-K419 WeakPolarHBondContact O-CG 3.4Å; K415-K419 PolarHBondContact O-N 3.38Å; A416-K419 PolarHBondContact O-N 2.96Å; V417-K419 VanDerWaalsContact C-N 3.33Å; V417-K419 PolarHBondContact O-N 2.65Å; K419-E422 WeakPolarHBondContact CD-OE1 3.49Å; K419-E422 IonicContact NZ-OE1 3.72Å; K419-E422 PolarHBondContact NZ-OE1 3.11Å
420	C	98	Very high	97.5	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.007	13%	0.129	C	C	.	.	H	α-helix	trans	-69.1	-37.9	175.1	-64.3	0	0	0	0	111.7	A416 V417 E422 E423 S426	A416-C420 PolarHBondContact O-N 3.11Å; A416-C420 PolarHBondContact O-SG 3.02Å; V417-C420 PolarHBondContact O-N 3.1Å; V417-C420 VanDerWaalsContact O-N 3.15Å; C420-E422 PolarHBondContact O-N 3.25Å; C420-E422 VanDerWaalsContact O-N 3.14Å; C420-E423 PolarHBondContact O-N 3.04Å; C420-E423 VanDerWaalsContact O-N 3.15Å; C420-S426 WeakPolarHBondContact O-CB 3.41Å
421	A	97.8	Very high	97.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-12.1	179.2	0	0	0	0	0	114.2	V417 G418 E423 M427 I430 P460 C461 N464	V417-A421 WeakPolarHBondContact O-CB 3.29Å; V417-A421 PolarHBondContact O-N 2.85Å; G418-A421 PolarHBondContact O-N 3.23Å; A421-E423 PolarHBondContact O-N 3.26Å; A421-M427 HydrophobicContact CB-SD 4.16Å; A421-I430 HydrophobicContact CB-CD1 3.76Å; A421-P460 HydrophobicContact CB-CB 4.24Å; A421-P460 HydrophobicContact CB-CG 4.18Å; A421-C461 VanDerWaalsContact CB-SG 3.6Å; A421-N464 PolarHBondContact O-ND2 3.18Å
422	E	97.3	Very high	97.3	Very high	71 Å²	71	31.9 Å²	31.9	33%	0.332	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.2	171.7	-71.4	-177.5	-149.2	0	0	112.7	R386 K419 C420 P460 N464	R386-E422 IonicContact CZ-OE2 3.29Å; R386-E422 IonicContact NH1-OE2 3.1Å; R386-E422 PolarHBondContact NH1-OE2 2.72Å; R386-E422 IonicContact NH2-OE1 2.64Å; R386-E422 IonicContact NH2-OE2 3.88Å; R386-E422 PolarHBondContact NH2-OE2 2.84Å; K419-E422 WeakPolarHBondContact CD-OE1 3.49Å; K419-E422 IonicContact NZ-OE1 3.72Å; K419-E422 PolarHBondContact NZ-OE1 3.11Å; C420-E422 PolarHBondContact O-N 3.25Å; C420-E422 VanDerWaalsContact O-N 3.14Å; E422-P460 HydrophobicContact CB-CB 4.45Å; E422-P460 HydrophobicContact CG-CB 3.79Å; E422-P460 HydrophobicContact CG-CG 4.32Å; E422-N464 VanDerWaalsContact C-ND2 3.3Å; E422-N464 WeakPolarHBondContact CA-ND2 3.33Å; E422-N464 PolarHBondContact O-ND2 2.68Å
423	E	95.6	Very high	97.3	Very high	40 Å²	40	34.7 Å²	34.7	19%	0.187	19%	0.186	C	C	.	.	S	Bend	trans	-106	128.3	174.4	-170.5	178	-178.8	0	0	111	R386 S387 R390 C420 A421 D425 S426 M427	R386-E423 WeakPolarHBondContact CB-OE2 3.11Å; S387-E423 PolarHBondContact N-OE2 3.4Å; S387-E423 PolarHBondContact OG-OE1 3.04Å; S387-E423 PolarHBondContact OG-OE2 3.01Å; R390-E423 IonicContact CZ-OE1 2.65Å; R390-E423 IonicContact CZ-OE2 3.15Å; R390-E423 IonicContact NH1-OE1 3.27Å; R390-E423 PolarHBondContact NH1-OE1 3.46Å; R390-E423 IonicContact NH1-OE2 2.85Å; R390-E423 PolarHBondContact NH1-OE2 3.27Å; R390-E423 IonicContact NH2-OE1 2.8Å; R390-E423 PolarHBondContact NH2-OE1 3.05Å; R390-E423 IonicContact NH2-OE2 3.24Å; C420-E423 PolarHBondContact O-N 3.04Å; C420-E423 VanDerWaalsContact O-N 3.15Å; A421-E423 PolarHBondContact O-N 3.26Å; E423-D425 VanDerWaalsContact C-N 3.35Å; E423-D425 PolarHBondContact O-N 3.41Å; E423-S426 WeakPolarHBondContact O-CB 3.33Å; E423-S426 PolarHBondContact O-N 2.7Å; E423-S426 PolarHBondContact OE2-OG 3.17Å; E423-M427 PolarHBondContact O-N 3.03Å
424	A	95.7	Very high	97.1	Very high	51 Å²	51	39.2 Å²	39.2	42%	0.421	21%	0.21	S	C	.	.	H	α-helix	trans	-58.6	-39	-172.9	0	0	0	0	0	114.3	S426 M427 S428	A424-S426 VanDerWaalsContact C-N 3.34Å; A424-S426 PolarHBondContact O-N 3.29Å; A424-M427 PolarHBondContact O-N 3.49Å; A424-S428 PolarHBondContact O-N 2.67Å; A424-S428 PolarHBondContact O-OG 3.33Å
425	D	96.4	Very high	97.1	Very high	92 Å²	92	39.2 Å²	39.2	49%	0.492	21%	0.21	S	C	.	.	H	α-helix	trans	-62.5	-43.2	175.9	-68.8	-11	0	0	0	111.8	R390 E423 M427 S428 I429	R390-D425 IonicContact CZ-OD2 2.7Å; R390-D425 IonicContact NE-OD2 3.24Å; R390-D425 IonicContact NH2-OD2 3.96Å; R390-D425 PolarHBondContact NH2-OD2 2.87Å; E423-D425 VanDerWaalsContact C-N 3.35Å; E423-D425 PolarHBondContact O-N 3.41Å; D425-M427 VanDerWaalsContact C-N 3.34Å; D425-S428 PolarHBondContact O-N 2.86Å; D425-I429 WeakPolarHBondContact O-CG1 3.32Å; D425-I429 PolarHBondContact O-N 3.47Å
426	S	97.1	Very high	97	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-40.4	178.7	-62.9	0	0	0	0	110.3	R390 I395 C420 E423 A424 I429 I430	R390-S426 PolarHBondContact NH1-OG 3.28Å; I395-S426 VanDerWaalsContact CD1-CB 3.4Å; I395-S426 WeakPolarHBondContact CD1-OG 3.48Å; C420-S426 WeakPolarHBondContact O-CB 3.41Å; E423-S426 WeakPolarHBondContact O-CB 3.33Å; E423-S426 PolarHBondContact O-N 2.7Å; E423-S426 PolarHBondContact OE2-OG 3.17Å; A424-S426 VanDerWaalsContact C-N 3.34Å; A424-S426 PolarHBondContact O-N 3.29Å; S426-I429 PolarHBondContact O-N 2.83Å; S426-I430 VanDerWaalsContact O-CG1 3.29Å; S426-I430 WeakPolarHBondContact O-CG1 3.29Å; S426-I430 PolarHBondContact O-N 3.35Å
427	M	96.8	Very high	97	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-43.7	175.5	-178.4	53.1	-155.3	0	0	112	A421 E423 A424 D425 I429 I430 E431 V436 C461 N464 A465 L471	A421-M427 HydrophobicContact CB-SD 4.16Å; E423-M427 PolarHBondContact O-N 3.03Å; A424-M427 PolarHBondContact O-N 3.49Å; D425-M427 VanDerWaalsContact C-N 3.34Å; M427-I429 PolarHBondContact O-N 3.36Å; M427-I430 WeakPolarHBondContact O-CB 3.3Å; M427-I430 PolarHBondContact O-N 3.22Å; M427-I430 HydrophobicContact SD-CB 4.31Å; M427-I430 HydrophobicContact SD-CG2 4.41Å; M427-E431 HydrophobicContact CE-CB 4.12Å; M427-E431 WeakPolarHBondContact O-CB 3.5Å; M427-E431 PolarHBondContact O-N 2.97Å; M427-V436 HydrophobicContact CE-CG2 3.41Å; M427-V436 VanDerWaalsContact CE-CG2 3.41Å; M427-C461 HydrophobicContact CE-CB 3.79Å; M427-C461 WeakPolarHBondContact CE-O 3.41Å; M427-C461 WeakPolarHBondContact SD-CA 3.46Å; M427-C461 HydrophobicContact SD-CB 3.73Å; M427-N464 HydrophobicContact CB-CB 4.05Å; M427-N464 HydrophobicContact CG-CB 4.07Å; M427-A465 HydrophobicContact CE-CB 4.36Å; M427-L471 HydrophobicContact CE-CD2 4.23Å
428	S	96.3	Very high	96.9	Very high	39 Å²	39	44.6 Å²	44.6	27%	0.273	23%	0.231	S	C	.	.	H	α-helix	trans	-57.7	-37.4	176.5	-59.2	0	0	0	0	112	A424 D425 N432	A424-S428 PolarHBondContact O-N 2.67Å; A424-S428 PolarHBondContact O-OG 3.33Å; D425-S428 PolarHBondContact O-N 2.86Å; S428-N432 WeakPolarHBondContact O-CB 3.45Å; S428-N432 PolarHBondContact O-N 3.38Å; S428-N432 VanDerWaalsContact O-N 3.13Å; S428-N432 PolarHBondContact O-ND2 2.86Å; S428-N432 VanDerWaalsContact O-ND2 3.12Å
429	I	97.5	Very high	96.9	Very high	56 Å²	56	44.3 Å²	44.3	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-70.5	-43.1	175	-61.8	167	0	0	0	110.8	R390 I395 D425 S426 M427 E431 N432 L433	R390-I429 HydrophobicContact CG-CD1 3.7Å; I395-I429 HydrophobicContact CB-CG2 4.19Å; I395-I429 HydrophobicContact CD1-CD1 4.35Å; I395-I429 HydrophobicContact CG2-CB 4.22Å; I395-I429 HydrophobicContact CG2-CG2 3.7Å; D425-I429 WeakPolarHBondContact O-CG1 3.32Å; D425-I429 PolarHBondContact O-N 3.47Å; S426-I429 PolarHBondContact O-N 2.83Å; M427-I429 PolarHBondContact O-N 3.36Å; I429-E431 VanDerWaalsContact C-N 3.31Å; I429-E431 PolarHBondContact O-N 3.16Å; I429-N432 PolarHBondContact O-N 3.27Å; I429-L433 HydrophobicContact CG2-CD1 3.74Å; I429-L433 HydrophobicContact CG2-CG 4.39Å; I429-L433 WeakPolarHBondContact O-CB 3.38Å; I429-L433 WeakPolarHBondContact O-CD1 3.3Å; I429-L433 WeakPolarHBondContact O-CG 3.44Å; I429-L433 PolarHBondContact O-N 2.94Å; I429-L433 VanDerWaalsContact O-N 3.13Å
430	I	97.7	Very high	96.9	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-60.7	-42.4	178.1	-68	164.2	0	0	0	110.8	I395 V399 V417 A421 S426 M427 L433 G435 V436	I395-I430 HydrophobicContact CG2-CD1 4.44Å; I395-I430 HydrophobicContact CG2-CG1 3.58Å; V399-I430 HydrophobicContact CG2-CG1 4.32Å; V417-I430 HydrophobicContact CG1-CD1 3.99Å; V417-I430 HydrophobicContact CG1-CG1 4.44Å; V417-I430 HydrophobicContact CG1-CG2 4.32Å; A421-I430 HydrophobicContact CB-CD1 3.76Å; S426-I430 VanDerWaalsContact O-CG1 3.29Å; S426-I430 WeakPolarHBondContact O-CG1 3.29Å; S426-I430 PolarHBondContact O-N 3.35Å; M427-I430 WeakPolarHBondContact O-CB 3.3Å; M427-I430 PolarHBondContact O-N 3.22Å; M427-I430 HydrophobicContact SD-CB 4.31Å; M427-I430 HydrophobicContact SD-CG2 4.41Å; I430-L433 PolarHBondContact O-N 3.34Å; I430-G435 WeakPolarHBondContact O-CA 3.47Å; I430-G435 PolarHBondContact O-N 3.29Å; I430-V436 HydrophobicContact CG2-CG2 4.27Å
431	E	96.2	Very high	96.8	Very high	61 Å²	61	45 Å²	45	29%	0.285	24%	0.24	S	C	.	.	H	α-helix	trans	-61.8	-51	176.4	-163.6	177.5	141.4	0	0	111.4	M427 I429 L433 D434 L471	M427-E431 HydrophobicContact CE-CB 4.12Å; M427-E431 WeakPolarHBondContact O-CB 3.5Å; M427-E431 PolarHBondContact O-N 2.97Å; I429-E431 VanDerWaalsContact C-N 3.31Å; I429-E431 PolarHBondContact O-N 3.16Å; E431-L433 PolarHBondContact O-N 2.92Å; E431-L433 VanDerWaalsContact O-N 3.1Å; E431-D434 PolarHBondContact O-N 3.27Å; E431-L471 HydrophobicContact CG-CD1 4.34Å
432	N	96.3	Very high	96.8	Very high	136 Å²	136	45.7 Å²	45.7	73%	0.727	24%	0.243	S	C	*	.	H	α-helix	trans	-61.5	-20.6	178.7	-72.3	-23.1	0	0	0	114	S428 I429	S428-N432 WeakPolarHBondContact O-CB 3.45Å; S428-N432 PolarHBondContact O-N 3.38Å; S428-N432 VanDerWaalsContact O-N 3.13Å; S428-N432 PolarHBondContact O-ND2 2.86Å; S428-N432 VanDerWaalsContact O-ND2 3.12Å; I429-N432 PolarHBondContact O-N 3.27Å
433	L	96.9	Very high	96.8	Very high	72 Å²	72	42.3 Å²	42.3	38%	0.377	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	12.4	177.8	-65.8	171.1	0	0	0	113	I395 P396 V399 I429 I430 E431 G435	I395-L433 HydrophobicContact CG2-CD1 4.45Å; P396-L433 HydrophobicContact CB-CD1 4.12Å; P396-L433 HydrophobicContact CG-CD1 4.07Å; V399-L433 HydrophobicContact CB-CB 4.43Å; V399-L433 HydrophobicContact CB-CD1 4.29Å; V399-L433 HydrophobicContact CG1-CB 3.93Å; V399-L433 HydrophobicContact CG2-CB 4.46Å; V399-L433 HydrophobicContact CG2-CD1 4.15Å; I429-L433 HydrophobicContact CG2-CD1 3.74Å; I429-L433 HydrophobicContact CG2-CG 4.39Å; I429-L433 WeakPolarHBondContact O-CB 3.38Å; I429-L433 WeakPolarHBondContact O-CD1 3.3Å; I429-L433 WeakPolarHBondContact O-CG 3.44Å; I429-L433 PolarHBondContact O-N 2.94Å; I429-L433 VanDerWaalsContact O-N 3.13Å; I430-L433 PolarHBondContact O-N 3.34Å; E431-L433 PolarHBondContact O-N 2.92Å; E431-L433 VanDerWaalsContact O-N 3.1Å; L433-G435 PolarHBondContact O-N 3.44Å; L433-G435 VanDerWaalsContact O-N 3.09Å
434	D	95.8	Very high	96.9	Very high	95 Å²	95	47.6 Å²	47.6	51%	0.508	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	22.6	-173.5	-69.7	-46.4	0	0	0	113.8	E431 V436 R437 L438	E431-D434 PolarHBondContact O-N 3.27Å; D434-V436 VanDerWaalsContact C-N 3.26Å; D434-V436 PolarHBondContact O-N 3.08Å; D434-R437 HydrophobicContact CB-CB 4.43Å; D434-R437 WeakPolarHBondContact O-CB 3.5Å; D434-R437 PolarHBondContact O-N 3.3Å; D434-R437 VanDerWaalsContact O-N 3.13Å; D434-L438 PolarHBondContact O-N 3.43Å
435	G	97.2	Very high	96.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-34.4	-176.7	0	0	0	0	0	112.4	I430 L433 R437 L438 L439	I430-G435 WeakPolarHBondContact O-CA 3.47Å; I430-G435 PolarHBondContact O-N 3.29Å; L433-G435 PolarHBondContact O-N 3.44Å; L433-G435 VanDerWaalsContact O-N 3.09Å; G435-R437 VanDerWaalsContact C-N 3.35Å; G435-R437 PolarHBondContact O-N 2.92Å; G435-L438 WeakPolarHBondContact O-CB 3.15Å; G435-L438 PolarHBondContact O-N 2.96Å; G435-L439 WeakPolarHBondContact O-CG 3.27Å; G435-L439 PolarHBondContact O-N 3.18Å
436	V	97.1	Very high	96.9	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.012	25%	0.25	C	S	.	.	H	α-helix	trans	-62.4	-42.4	176.2	-171.6	0	0	0	0	110.9	M427 I430 D434 L438 L439 W440 L458 C461 L471 F475	M427-V436 HydrophobicContact CE-CG2 3.41Å; M427-V436 VanDerWaalsContact CE-CG2 3.41Å; I430-V436 HydrophobicContact CG2-CG2 4.27Å; D434-V436 VanDerWaalsContact C-N 3.26Å; D434-V436 PolarHBondContact O-N 3.08Å; V436-L438 VanDerWaalsContact C-N 3.3Å; V436-L438 PolarHBondContact O-N 3.34Å; V436-L439 WeakPolarHBondContact O-CB 3.08Å; V436-L439 PolarHBondContact O-N 2.82Å; V436-W440 PolarHBondContact O-N 3.15Å; V436-L458 HydrophobicContact CG1-CD2 4.03Å; V436-C461 HydrophobicContact CG2-CB 4.39Å; V436-L471 HydrophobicContact CB-CD1 4.43Å; V436-L471 HydrophobicContact CG1-CD1 4.3Å; V436-L471 HydrophobicContact CG1-CD2 4.2Å; V436-L471 HydrophobicContact CG1-CG 4.32Å; V436-L471 HydrophobicContact CG2-CD2 4.33Å; V436-F475 HydrophobicContact CB-CE2 4.44Å; V436-F475 HydrophobicContact CB-CZ 4.08Å; V436-F475 HydrophobicContact CG1-CE2 3.71Å; V436-F475 HydrophobicContact CG1-CZ 3.85Å
437	R	96.8	Very high	96.8	Very high	122 Å²	122	50 Å²	50	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-60.8	-39.8	176	-169	179.4	59.2	73.7	2	111.8	D434 G435 W440 S441 F475	D434-R437 HydrophobicContact CB-CB 4.43Å; D434-R437 WeakPolarHBondContact O-CB 3.5Å; D434-R437 PolarHBondContact O-N 3.3Å; D434-R437 VanDerWaalsContact O-N 3.13Å; G435-R437 VanDerWaalsContact C-N 3.35Å; G435-R437 PolarHBondContact O-N 2.92Å; R437-W440 PolarHBondContact O-N 3.01Å; R437-S441 PolarHBondContact O-N 3.06Å; R437-F475 HydrophobicContact CB-CD1 4.3Å; R437-F475 HydrophobicContact CB-CE1 3.56Å; R437-F475 HydrophobicContact CB-CZ 4.25Å; R437-F475 HydrophobicContact CG-CD1 4.08Å; R437-F475 HydrophobicContact CG-CE1 3.81Å
438	L	97.5	Very high	96.9	Very high	27 Å²	27	52.4 Å²	52.4	14%	0.141	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-42.3	176.3	-62.2	178.2	0	0	0	111.4	V399 L402 T403 D434 G435 V436 W440 S441 L442	V399-L438 HydrophobicContact CG1-CD1 4.04Å; L402-L438 HydrophobicContact CB-CB 4.11Å; L402-L438 HydrophobicContact CB-CD1 4.09Å; L402-L438 HydrophobicContact CD1-CB 4.08Å; L402-L438 HydrophobicContact CD1-CD1 4.46Å; T403-L438 HydrophobicContact CG2-CD1 3.94Å; T403-L438 HydrophobicContact CG2-CD2 4.13Å; D434-L438 PolarHBondContact O-N 3.43Å; G435-L438 WeakPolarHBondContact O-CB 3.15Å; G435-L438 PolarHBondContact O-N 2.96Å; V436-L438 VanDerWaalsContact C-N 3.3Å; V436-L438 PolarHBondContact O-N 3.34Å; L438-W440 VanDerWaalsContact C-N 3.34Å; L438-W440 PolarHBondContact O-N 3.49Å; L438-S441 WeakPolarHBondContact O-CB 3.28Å; L438-S441 PolarHBondContact O-N 3.28Å; L438-S441 VanDerWaalsContact O-N 3.1Å; L438-L442 WeakPolarHBondContact O-CG 3.36Å; L438-L442 PolarHBondContact O-N 3.15Å
439	L	97.8	Very high	96.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-43.4	174.3	-66.4	174	0	0	0	111.8	L402 T414 V417 G435 V436 S441 L442 L443 A457 L458	L402-L439 HydrophobicContact CD1-CD2 4.07Å; L402-L439 HydrophobicContact CD1-CG 4.29Å; L402-L439 HydrophobicContact CD2-CD2 4.19Å; T414-L439 HydrophobicContact CG2-CD2 3.74Å; V417-L439 HydrophobicContact CG1-CD1 4.23Å; G435-L439 WeakPolarHBondContact O-CG 3.27Å; G435-L439 PolarHBondContact O-N 3.18Å; V436-L439 WeakPolarHBondContact O-CB 3.08Å; V436-L439 PolarHBondContact O-N 2.82Å; L439-S441 VanDerWaalsContact C-N 3.31Å; L439-S441 PolarHBondContact O-N 3.14Å; L439-L442 PolarHBondContact O-N 3.44Å; L439-L442 VanDerWaalsContact O-N 3.17Å; L439-L443 PolarHBondContact O-N 2.91Å; L439-A457 HydrophobicContact CD1-CB 4Å; L439-A457 HydrophobicContact CD2-CB 3.94Å; L439-L458 HydrophobicContact CB-CD2 3.81Å; L439-L458 HydrophobicContact CB-CG 4.23Å; L439-L458 HydrophobicContact CD1-CD2 4.39Å
440	W	97.3	Very high	96.9	Very high	10 Å²	10	53.6 Å²	53.6	4%	0.038	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-39.8	172.4	-82.5	103.4	0	0	0	112.7	V436 R437 L438 L442 L443 L458 V472 F475 G478 I482 I504	V436-W440 PolarHBondContact O-N 3.15Å; R437-W440 PolarHBondContact O-N 3.01Å; L438-W440 VanDerWaalsContact C-N 3.34Å; L438-W440 PolarHBondContact O-N 3.49Å; W440-L442 VanDerWaalsContact C-N 3.31Å; W440-L442 PolarHBondContact O-N 2.79Å; W440-L443 HydrophobicContact CD2-CD1 4.31Å; W440-L443 HydrophobicContact CE3-CD1 3.54Å; W440-L443 HydrophobicContact CZ3-CD1 3.79Å; W440-L443 WeakPolarHBondContact O-CB 3.15Å; W440-L443 PolarHBondContact O-N 3.39Å; W440-L458 HydrophobicContact CD2-CD1 4.02Å; W440-L458 HydrophobicContact CD2-CD2 4.48Å; W440-L458 HydrophobicContact CE3-CD1 4.38Å; W440-L458 HydrophobicContact CG-CD1 4.39Å; W440-L458 HydrophobicContact CG-CD2 4.25Å; W440-L458 HydrophobicContact CZ2-CD1 4.31Å; W440-V472 HydrophobicContact CH2-CG1 4.48Å; W440-V472 HydrophobicContact CZ2-CG1 4.05Å; W440-F475 AromaticContact CD1-CD2 3.24Å; W440-F475 AromaticContact CD1-CE2 3.31Å; W440-F475 AromaticContact CD1-CG 3.82Å; W440-F475 AromaticContact CD1-CZ 3.97Å; W440-F475 HydrophobicContact CD2-CD2 4.23Å; W440-F475 AromaticContact CE2-CD2 3.82Å; W440-F475 AromaticContact CG-CD2 3.94Å; W440-F475 HydrophobicContact CG-CD2 3.94Å; W440-F475 HydrophobicContact CG-CE2 4.35Å; W440-F475 HydrophobicContact CG-CG 4.16Å; W440-F475 AromaticContact NE1-CD2 3.16Å; W440-F475 AromaticContact NE1-CE2 3.32Å; W440-F475 VanDerWaalsContact NE1-CE2 3.32Å; W440-G478 VanDerWaalsContact CZ3-C 3.41Å; W440-G478 WeakPolarHBondContact CZ3-O 3.43Å; W440-I482 HydrophobicContact CH2-CB 4.22Å; W440-I482 HydrophobicContact CH2-CD1 4.15Å; W440-I482 HydrophobicContact CH2-CG2 4.13Å; W440-I482 HydrophobicContact CZ3-CB 3.93Å; W440-I482 HydrophobicContact CZ3-CD1 4.37Å; W440-I482 HydrophobicContact CZ3-CG2 4.23Å; W440-I504 HydrophobicContact CH2-CD1 3.87Å; W440-I504 HydrophobicContact CZ2-CD1 4.21Å
441	S	96.9	Very high	96.9	Very high	69 Å²	69	54.7 Å²	54.7	48%	0.483	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-35.8	175.6	-170.3	0	0	0	0	112.3	R437 L438 L439 L443 K444	R437-S441 PolarHBondContact O-N 3.06Å; L438-S441 WeakPolarHBondContact O-CB 3.28Å; L438-S441 PolarHBondContact O-N 3.28Å; L438-S441 VanDerWaalsContact O-N 3.1Å; L439-S441 VanDerWaalsContact C-N 3.31Å; L439-S441 PolarHBondContact O-N 3.14Å; S441-L443 PolarHBondContact O-N 3.12Å; S441-K444 WeakPolarHBondContact O-CB 3.38Å; S441-K444 PolarHBondContact O-N 3.02Å; S441-K444 VanDerWaalsContact O-N 3.13Å
442	L	97.4	Very high	97	Very high	15 Å²	15	51.9 Å²	51.9	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-18.2	178.9	-69.9	175.9	0	0	0	113.4	L402 L410 L438 L439 W440 K444 N445 V450 A454	L402-L442 HydrophobicContact CB-CD1 4.38Å; L402-L442 HydrophobicContact CD2-CD1 3.85Å; L410-L442 HydrophobicContact CD1-CD2 3.95Å; L410-L442 HydrophobicContact CD2-CD1 4.32Å; L410-L442 HydrophobicContact CD2-CD2 3.97Å; L438-L442 WeakPolarHBondContact O-CG 3.36Å; L438-L442 PolarHBondContact O-N 3.15Å; L439-L442 PolarHBondContact O-N 3.44Å; L439-L442 VanDerWaalsContact O-N 3.17Å; W440-L442 VanDerWaalsContact C-N 3.31Å; W440-L442 PolarHBondContact O-N 2.79Å; L442-K444 PolarHBondContact O-N 3.35Å; L442-N445 WeakPolarHBondContact O-CB 3.08Å; L442-N445 PolarHBondContact O-N 3.26Å; L442-V450 HydrophobicContact CB-CG1 4.25Å; L442-V450 HydrophobicContact CD2-CG1 4.1Å; L442-A454 HydrophobicContact CB-CB 3.84Å
443	L	97.6	Very high	97	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.6	169.6	-65.9	180	0	0	0	113.1	L439 W440 S441 N445 Q451 A454 A455 L458 L481 L485	L439-L443 PolarHBondContact O-N 2.91Å; W440-L443 HydrophobicContact CD2-CD1 4.31Å; W440-L443 HydrophobicContact CE3-CD1 3.54Å; W440-L443 HydrophobicContact CZ3-CD1 3.79Å; W440-L443 WeakPolarHBondContact O-CB 3.15Å; W440-L443 PolarHBondContact O-N 3.39Å; S441-L443 PolarHBondContact O-N 3.12Å; L443-N445 VanDerWaalsContact C-N 3.34Å; L443-Q451 PolarHBondContact O-NE2 3.13Å; L443-A454 HydrophobicContact CD2-CB 3.91Å; L443-A454 HydrophobicContact CG-CB 4.45Å; L443-A455 HydrophobicContact CD2-CB 3.87Å; L443-L458 HydrophobicContact CD1-CD1 3.76Å; L443-L458 HydrophobicContact CD2-CD1 4.39Å; L443-L458 HydrophobicContact CG-CD1 4.23Å; L443-L481 HydrophobicContact CB-CD2 3.84Å; L443-L481 HydrophobicContact CB-CG 4.45Å; L443-L481 HydrophobicContact CD1-CD2 4.43Å; L443-L485 HydrophobicContact CB-CD1 4.04Å; L443-L485 HydrophobicContact CD2-CD1 4.2Å
444	K	96.5	Very high	97.1	Very high	151 Å²	151	45.5 Å²	45.5	66%	0.657	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.4	176	-57.2	-179.7	-178.8	176.8	0	113.1	S441 L442 L481	S441-K444 WeakPolarHBondContact O-CB 3.38Å; S441-K444 PolarHBondContact O-N 3.02Å; S441-K444 VanDerWaalsContact O-N 3.13Å; L442-K444 PolarHBondContact O-N 3.35Å; K444-L481 HydrophobicContact CD-CD2 4.33Å; K444-L481 HydrophobicContact CG-CD1 4.17Å; K444-L481 HydrophobicContact CG-CD2 3.62Å
445	N	95.9	Very high	97.2	Very high	22 Å²	22	41 Å²	41	12%	0.118	21%	0.206	C	C	.	.			trans	-68.3	136.6	-177.9	-172.9	-53.7	0	0	0	110.5	Q407 L442 L443 N447 V450	Q407-N445 PolarHBondContact OE1-ND2 3.06Å; Q407-N445 PolarHBondContact OE1-OD1 3.06Å; L442-N445 WeakPolarHBondContact O-CB 3.08Å; L442-N445 PolarHBondContact O-N 3.26Å; L443-N445 VanDerWaalsContact C-N 3.34Å; N445-N447 PolarHBondContact O-N 3.09Å; N445-N447 VanDerWaalsContact OD1-CB 3.29Å; N445-N447 WeakPolarHBondContact OD1-CB 3.32Å; N445-N447 PolarHBondContact OD1-N 3.24Å; N445-V450 HydrophobicContact CB-CB 4.32Å; N445-V450 HydrophobicContact CB-CG1 3.95Å
446	P	95.6	Very high	97.3	Very high	124 Å²	124	46.5 Å²	46.5	81%	0.805	23%	0.227	S	C	*	.	S	Bend	trans	-67.5	-18.1	-179.8	27.5	-37	0	0	0	114.4	P448	P446-P448 WeakPolarHBondContact O-CD 3.49Å
447	N	96.5	Very high	97.4	Very high	46 Å²	46	46.5 Å²	46.5	25%	0.246	23%	0.227	C	C	.	.			trans	-80.1	117.5	179.1	-172.3	-37.1	0	0	0	110.9	N445 K449 V450 Q451	N445-N447 PolarHBondContact O-N 3.09Å; N445-N447 VanDerWaalsContact OD1-CB 3.29Å; N445-N447 WeakPolarHBondContact OD1-CB 3.32Å; N445-N447 PolarHBondContact OD1-N 3.24Å; N447-K449 PolarHBondContact O-N 3.23Å; N447-K449 WeakPolarHBondContact OD1-CB 3.32Å; N447-K449 PolarHBondContact OD1-N 3.28Å; N447-V450 HydrophobicContact CB-CB 4.27Å; N447-V450 HydrophobicContact CB-CG2 4.04Å; N447-V450 PolarHBondContact O-N 3.35Å; N447-V450 VanDerWaalsContact O-N 3.15Å; N447-Q451 PolarHBondContact O-N 3.31Å
448	P	97.3	Very high	97.4	Very high	52 Å²	52	40.7 Å²	40.7	34%	0.338	21%	0.205	S	C	.	.	H	α-helix	trans	-58.4	-32.7	-178.5	-24.9	34.7	0	0	0	113.9	P446 S452 D490 V493	P446-P448 WeakPolarHBondContact O-CD 3.49Å; P448-S452 WeakPolarHBondContact O-CB 3.46Å; P448-S452 PolarHBondContact O-N 3.23Å; P448-S452 PolarHBondContact O-OG 3.36Å; P448-D490 HydrophobicContact CB-CB 4.1Å; P448-V493 HydrophobicContact CB-CG2 3.9Å; P448-V493 VanDerWaalsContact O-CG2 3.29Å; P448-V493 WeakPolarHBondContact O-CG2 3Å
449	K	97	Very high	97.4	Very high	121 Å²	121	40 Å²	40	53%	0.526	20%	0.202	S	C	.	.	H	α-helix	trans	-68.1	-45.6	178.1	-67.8	-176.2	176.9	177.2	0	111.4	T411 N447 Q451 S452 Y453	T411-K449 HydrophobicContact CG2-CB 4.34Å; N447-K449 PolarHBondContact O-N 3.23Å; N447-K449 WeakPolarHBondContact OD1-CB 3.32Å; N447-K449 PolarHBondContact OD1-N 3.28Å; K449-Q451 VanDerWaalsContact C-N 3.3Å; K449-Q451 PolarHBondContact O-N 2.94Å; K449-S452 PolarHBondContact O-N 2.94Å; K449-S452 PolarHBondContact O-OG 3.23Å; K449-S452 VanDerWaalsContact O-OG 3.07Å; K449-Y453 WeakPolarHBondContact O-CD2 3.42Å; K449-Y453 PolarHBondContact O-N 3.29Å
450	V	97.8	Very high	97.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.3	-44.4	177.7	177.1	0	0	0	0	109.8	L410 T411 L442 N445 N447 Y453 A454	L410-V450 HydrophobicContact CB-CG1 4.12Å; L410-V450 HydrophobicContact CB-CG2 3.95Å; L410-V450 HydrophobicContact CD1-CG1 4.36Å; T411-V450 WeakPolarHBondContact OG1-CG2 3.24Å; L442-V450 HydrophobicContact CB-CG1 4.25Å; L442-V450 HydrophobicContact CD2-CG1 4.1Å; N445-V450 HydrophobicContact CB-CB 4.32Å; N445-V450 HydrophobicContact CB-CG1 3.95Å; N447-V450 HydrophobicContact CB-CB 4.27Å; N447-V450 HydrophobicContact CB-CG2 4.04Å; N447-V450 PolarHBondContact O-N 3.35Å; N447-V450 VanDerWaalsContact O-N 3.15Å; V450-Y453 PolarHBondContact O-N 2.85Å; V450-A454 VanDerWaalsContact O-CB 3.29Å; V450-A454 WeakPolarHBondContact O-CB 3.48Å; V450-A454 PolarHBondContact O-N 3.32Å
451	Q	97.3	Very high	97.4	Very high	23 Å²	23	40.2 Å²	40.2	11%	0.107	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-45.5	178.1	-176.7	175.1	59.4	0	0	112.7	L443 N447 K449 A454 A455 L485 V493	L443-Q451 PolarHBondContact O-NE2 3.13Å; N447-Q451 PolarHBondContact O-N 3.31Å; K449-Q451 VanDerWaalsContact C-N 3.3Å; K449-Q451 PolarHBondContact O-N 2.94Å; Q451-A454 PolarHBondContact O-N 2.6Å; Q451-A455 PolarHBondContact O-N 3.36Å; Q451-L485 HydrophobicContact CG-CD1 4.08Å; Q451-V493 HydrophobicContact CB-CG2 4.27Å; Q451-V493 HydrophobicContact CG-CG1 4.03Å; Q451-V493 HydrophobicContact CG-CG2 4.24Å
452	S	97.9	Very high	97.4	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-43.7	179.3	70.7	0	0	0	0	111.6	P448 K449 A454 A455 W456 A496	P448-S452 WeakPolarHBondContact O-CB 3.46Å; P448-S452 PolarHBondContact O-N 3.23Å; P448-S452 PolarHBondContact O-OG 3.36Å; K449-S452 PolarHBondContact O-N 2.94Å; K449-S452 PolarHBondContact O-OG 3.23Å; K449-S452 VanDerWaalsContact O-OG 3.07Å; S452-A454 VanDerWaalsContact C-N 3.31Å; S452-A454 PolarHBondContact O-N 3.38Å; S452-A455 PolarHBondContact O-N 3.3Å; S452-W456 PolarHBondContact O-N 3.29Å; S452-A496 WeakPolarHBondContact O-CB 3.34Å
453	Y	98.1	Very high	97.4	Very high	74 Å²	74	42 Å²	42	29%	0.29	21%	0.205	S	C	.	.	H	α-helix	trans	-66.4	-33.4	175.2	-78.2	-66	0	0	0	112.5	T411 T414 K415 K449 V450 W456 A457	T411-Y453 HydrophobicContact CG2-CD2 3.54Å; T411-Y453 HydrophobicContact CG2-CE2 3.56Å; T414-Y453 WeakPolarHBondContact CG2-O 3.27Å; K415-Y453 HydrophobicContact CB-CD1 3.91Å; K415-Y453 HydrophobicContact CB-CE1 4.15Å; K415-Y453 HydrophobicContact CB-CG 4.42Å; K415-Y453 HydrophobicContact CD-CD1 4.45Å; K415-Y453 HydrophobicContact CD-CE1 3.85Å; K415-Y453 HydrophobicContact CG-CD1 4.16Å; K415-Y453 HydrophobicContact CG-CE1 3.98Å; K449-Y453 WeakPolarHBondContact O-CD2 3.42Å; K449-Y453 PolarHBondContact O-N 3.29Å; V450-Y453 PolarHBondContact O-N 2.85Å; Y453-W456 PolarHBondContact O-N 3.38Å; Y453-A457 VanDerWaalsContact O-CB 3.28Å; Y453-A457 WeakPolarHBondContact O-CB 3.46Å; Y453-A457 PolarHBondContact O-N 3.02Å
454	A	98.4	Very high	97.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.4	-46.3	175.8	0	0	0	0	0	110.7	T414 L442 L443 V450 Q451 S452 W456 A457 L458	T414-A454 HydrophobicContact CG2-CB 4.03Å; T414-A454 VanDerWaalsContact CG2-N 3.29Å; L442-A454 HydrophobicContact CB-CB 3.84Å; L443-A454 HydrophobicContact CD2-CB 3.91Å; L443-A454 HydrophobicContact CG-CB 4.45Å; V450-A454 VanDerWaalsContact O-CB 3.29Å; V450-A454 WeakPolarHBondContact O-CB 3.48Å; V450-A454 PolarHBondContact O-N 3.32Å; Q451-A454 PolarHBondContact O-N 2.6Å; S452-A454 VanDerWaalsContact C-N 3.31Å; S452-A454 PolarHBondContact O-N 3.38Å; A454-W456 PolarHBondContact O-N 3.14Å; A454-A457 PolarHBondContact O-N 3.42Å; A454-L458 WeakPolarHBondContact O-CG 3.4Å; A454-L458 PolarHBondContact O-N 3.48Å
455	A	98.4	Very high	97.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-43.5	173.9	0	0	0	0	0	112.2	L443 Q451 S452 A457 L458 C459 A496 V497	L443-A455 HydrophobicContact CD2-CB 3.87Å; Q451-A455 PolarHBondContact O-N 3.36Å; S452-A455 PolarHBondContact O-N 3.3Å; A455-A457 VanDerWaalsContact C-N 3.32Å; A455-A457 PolarHBondContact O-N 3.37Å; A455-L458 PolarHBondContact O-N 2.66Å; A455-C459 PolarHBondContact O-N 3.41Å; A455-C459 PolarHBondContact O-SG 2.86Å; A455-A496 HydrophobicContact CB-CB 3.65Å; A455-V497 HydrophobicContact CB-CG2 4.2Å
456	W	98.1	Very high	96.9	Very high	116 Å²	116	44.9 Å²	44.9	44%	0.439	22%	0.221	S	C	.	.	H	α-helix	trans	-62.8	-35.5	174.9	-81.1	120.9	0	0	0	113.5	S452 Y453 A454 C459 P460 A496 A499	S452-W456 PolarHBondContact O-N 3.29Å; Y453-W456 PolarHBondContact O-N 3.38Å; A454-W456 PolarHBondContact O-N 3.14Å; W456-C459 WeakPolarHBondContact O-CB 3.22Å; W456-C459 PolarHBondContact O-N 3.25Å; W456-P460 WeakPolarHBondContact O-CD 3.36Å; W456-A496 VanDerWaalsContact CD1-CB 3.43Å; W456-A496 HydrophobicContact CD2-CB 4.09Å; W456-A496 HydrophobicContact CG-CB 3.88Å; W456-A499 HydrophobicContact CE3-CB 4.05Å; W456-A499 HydrophobicContact CH2-CB 3.63Å; W456-A499 HydrophobicContact CZ2-CB 4.47Å; W456-A499 HydrophobicContact CZ3-CB 3.38Å
457	A	98.3	Very high	96.8	Very high	2 Å²	2	44.3 Å²	44.3	2%	0.017	21%	0.212	C	C	.	.	H	α-helix	trans	-72.9	-29.5	178.3	0	0	0	0	0	112.4	T414 L439 Y453 A454 A455 C459 P460 C461	T414-A457 HydrophobicContact CG2-CB 3.98Å; L439-A457 HydrophobicContact CD1-CB 4Å; L439-A457 HydrophobicContact CD2-CB 3.94Å; Y453-A457 VanDerWaalsContact O-CB 3.28Å; Y453-A457 WeakPolarHBondContact O-CB 3.46Å; Y453-A457 PolarHBondContact O-N 3.02Å; A454-A457 PolarHBondContact O-N 3.42Å; A455-A457 VanDerWaalsContact C-N 3.32Å; A455-A457 PolarHBondContact O-N 3.37Å; A457-C459 VanDerWaalsContact C-N 3.3Å; A457-C459 PolarHBondContact O-N 2.91Å; A457-P460 VanDerWaalsContact O-CD 3.28Å; A457-P460 WeakPolarHBondContact O-CD 3.36Å; A457-P460 WeakPolarHBondContact O-CG 3.35Å; A457-C461 PolarHBondContact O-N 3.14Å; A457-C461 PolarHBondContact O-SG 2.86Å
458	L	98.1	Very high	96.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.7	-31.6	173.6	-71.9	171.9	0	0	0	112.3	V436 L439 W440 L443 A454 A455 C461 I462	V436-L458 HydrophobicContact CG1-CD2 4.03Å; L439-L458 HydrophobicContact CB-CD2 3.81Å; L439-L458 HydrophobicContact CB-CG 4.23Å; L439-L458 HydrophobicContact CD1-CD2 4.39Å; W440-L458 HydrophobicContact CD2-CD1 4.02Å; W440-L458 HydrophobicContact CD2-CD2 4.48Å; W440-L458 HydrophobicContact CE3-CD1 4.38Å; W440-L458 HydrophobicContact CG-CD1 4.39Å; W440-L458 HydrophobicContact CG-CD2 4.25Å; W440-L458 HydrophobicContact CZ2-CD1 4.31Å; L443-L458 HydrophobicContact CD1-CD1 3.76Å; L443-L458 HydrophobicContact CD2-CD1 4.39Å; L443-L458 HydrophobicContact CG-CD1 4.23Å; A454-L458 WeakPolarHBondContact O-CG 3.4Å; A454-L458 PolarHBondContact O-N 3.48Å; A455-L458 PolarHBondContact O-N 2.66Å; L458-C461 WeakPolarHBondContact O-CB 3.44Å; L458-C461 PolarHBondContact O-N 3.22Å; L458-I462 HydrophobicContact CB-CD1 4.33Å; L458-I462 WeakPolarHBondContact O-CB 3.49Å; L458-I462 VanDerWaalsContact O-CG1 3.26Å; L458-I462 WeakPolarHBondContact O-CG1 3.33Å; L458-I462 PolarHBondContact O-N 3.11Å
459	C	98.1	Very high	96.4	Very high	13 Å²	13	41.3 Å²	41.3	9%	0.088	20%	0.199	C	C	.	.	H	α-helix	trans	-54.1	-58.5	179.1	-63.1	0	0	0	0	113.8	A455 W456 A457 C461 I462 Q463 A500 K503	A455-C459 PolarHBondContact O-N 3.41Å; A455-C459 PolarHBondContact O-SG 2.86Å; W456-C459 WeakPolarHBondContact O-CB 3.22Å; W456-C459 PolarHBondContact O-N 3.25Å; A457-C459 VanDerWaalsContact C-N 3.3Å; A457-C459 PolarHBondContact O-N 2.91Å; C459-C461 VanDerWaalsContact C-N 3.28Å; C459-C461 PolarHBondContact O-N 3.44Å; C459-I462 PolarHBondContact O-N 3.17Å; C459-Q463 WeakPolarHBondContact O-CB 3.44Å; C459-Q463 PolarHBondContact O-N 3.48Å; C459-A500 VanDerWaalsContact SG-CA 3.59Å; C459-A500 PolarHBondContact SG-N 2.89Å; C459-K503 HydrophobicContact CB-CG 4.23Å
460	P	97.6	Very high	96.3	Very high	13 Å²	13	40.6 Å²	40.6	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-67.9	-27.8	176.2	27.1	-34.3	0	0	0	112.7	G418 A421 E422 W456 A457 Q463 N464	G418-P460 VanDerWaalsContact O-CG 3.22Å; G418-P460 WeakPolarHBondContact O-CG 3.17Å; A421-P460 HydrophobicContact CB-CB 4.24Å; A421-P460 HydrophobicContact CB-CG 4.18Å; E422-P460 HydrophobicContact CB-CB 4.45Å; E422-P460 HydrophobicContact CG-CB 3.79Å; E422-P460 HydrophobicContact CG-CG 4.32Å; W456-P460 WeakPolarHBondContact O-CD 3.36Å; A457-P460 VanDerWaalsContact O-CD 3.28Å; A457-P460 WeakPolarHBondContact O-CD 3.36Å; A457-P460 WeakPolarHBondContact O-CG 3.35Å; P460-Q463 PolarHBondContact O-N 3.45Å; P460-N464 WeakPolarHBondContact O-CB 3.33Å; P460-N464 PolarHBondContact O-N 3.45Å; P460-N464 PolarHBondContact O-ND2 3.03Å
461	C	97.4	Very high	96.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-47.1	175.1	-68	0	0	0	0	111.7	A421 M427 V436 A457 L458 C459 A465	A421-C461 VanDerWaalsContact CB-SG 3.6Å; M427-C461 HydrophobicContact CE-CB 3.79Å; M427-C461 WeakPolarHBondContact CE-O 3.41Å; M427-C461 WeakPolarHBondContact SD-CA 3.46Å; M427-C461 HydrophobicContact SD-CB 3.73Å; V436-C461 HydrophobicContact CG2-CB 4.39Å; A457-C461 PolarHBondContact O-N 3.14Å; A457-C461 PolarHBondContact O-SG 2.86Å; L458-C461 WeakPolarHBondContact O-CB 3.44Å; L458-C461 PolarHBondContact O-N 3.22Å; C459-C461 VanDerWaalsContact C-N 3.28Å; C459-C461 PolarHBondContact O-N 3.44Å; C461-A465 VanDerWaalsContact O-CB 3.27Å; C461-A465 WeakPolarHBondContact O-CB 3.44Å; C461-A465 PolarHBondContact O-N 2.73Å
462	I	96.8	Very high	96.1	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.041	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-42.8	177.9	-64.7	165.7	0	0	0	110	L458 C459 N464 A468 V472 K503 I504	L458-I462 HydrophobicContact CB-CD1 4.33Å; L458-I462 WeakPolarHBondContact O-CB 3.49Å; L458-I462 VanDerWaalsContact O-CG1 3.26Å; L458-I462 WeakPolarHBondContact O-CG1 3.33Å; L458-I462 PolarHBondContact O-N 3.11Å; C459-I462 PolarHBondContact O-N 3.17Å; I462-N464 VanDerWaalsContact C-N 3.3Å; I462-N464 PolarHBondContact O-N 3.47Å; I462-A468 HydrophobicContact CG2-CB 4.14Å; I462-A468 WeakPolarHBondContact O-CB 3.28Å; I462-V472 HydrophobicContact CD1-CG2 3.96Å; I462-V472 HydrophobicContact CG1-CG2 3.86Å; I462-V472 HydrophobicContact CG2-CG2 4.46Å; I462-K503 HydrophobicContact CB-CB 4.46Å; I462-K503 HydrophobicContact CG2-CB 4.19Å; I462-I504 HydrophobicContact CD1-CD1 4.26Å; I462-I504 HydrophobicContact CD1-CG1 3.58Å
463	Q	95.9	Very high	96	Very high	113 Å²	113	43.7 Å²	43.7	53%	0.528	21%	0.208	S	C	.	.	H	α-helix	trans	-64.2	-32	-178.1	-179.4	170.4	-12.4	0	0	113.8	C459 P460	C459-Q463 WeakPolarHBondContact O-CB 3.44Å; C459-Q463 PolarHBondContact O-N 3.48Å; P460-Q463 PolarHBondContact O-N 3.45Å
464	N	95.8	Very high	95.8	Very high	47 Å²	47	43.2 Å²	43.2	25%	0.251	22%	0.216	S	C	.	.	H	α-helix	trans	-108.2	0.8	-175.9	-67.8	-49.8	0	0	0	114	A421 E422 M427 P460 I462	A421-N464 PolarHBondContact O-ND2 3.18Å; E422-N464 VanDerWaalsContact C-ND2 3.3Å; E422-N464 WeakPolarHBondContact CA-ND2 3.33Å; E422-N464 PolarHBondContact O-ND2 2.68Å; M427-N464 HydrophobicContact CB-CB 4.05Å; M427-N464 HydrophobicContact CG-CB 4.07Å; P460-N464 WeakPolarHBondContact O-CB 3.33Å; P460-N464 PolarHBondContact O-N 3.45Å; P460-N464 PolarHBondContact O-ND2 3.03Å; I462-N464 VanDerWaalsContact C-N 3.3Å; I462-N464 PolarHBondContact O-N 3.47Å
465	A	94.2	Very high	95.6	Very high	13 Å²	13	44.7 Å²	44.7	11%	0.107	22%	0.223	C	C	.	.			trans	-69.7	144.1	172	0	0	0	0	0	110.4	M427 C461 A468 L471	M427-A465 HydrophobicContact CE-CB 4.36Å; C461-A465 VanDerWaalsContact O-CB 3.27Å; C461-A465 WeakPolarHBondContact O-CB 3.44Å; C461-A465 PolarHBondContact O-N 2.73Å; A465-A468 HydrophobicContact CB-CB 4.13Å; A465-L471 HydrophobicContact CB-CD2 3.54Å
466	K	90.6	Very high	95.2	Very high	174 Å²	174	51.8 Å²	51.8	76%	0.757	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-44.3	178	-67.5	-178.9	-177.5	175.4	0	111.5
467	D	92.8	Very high	95	Very high	113 Å²	113	48.2 Å²	48.2	60%	0.604	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	59.9	-179.4	-60.9	-50.1	0	0	0	110.1	G469 E470 L471	D467-G469 VanDerWaalsContact C-N 3.26Å; D467-G469 PolarHBondContact O-N 2.8Å; D467-E470 HydrophobicContact CB-CB 4.3Å; D467-E470 PolarHBondContact O-N 3.33Å; D467-L471 WeakPolarHBondContact O-CB 3.5Å; D467-L471 PolarHBondContact O-N 3.27Å
468	A	93	Very high	94.8	Very high	26 Å²	26	48.4 Å²	48.4	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-55.6	-38.4	-173.4	0	0	0	0	0	113.8	I462 A465 V472	I462-A468 HydrophobicContact CG2-CB 4.14Å; I462-A468 WeakPolarHBondContact O-CB 3.28Å; A465-A468 HydrophobicContact CB-CB 4.13Å; A468-V472 WeakPolarHBondContact O-CG2 3.1Å; A468-V472 PolarHBondContact O-N 3.06Å; A468-V472 VanDerWaalsContact O-N 3.14Å
469	G	93.8	Very high	94.8	Very high	9 Å²	9	49 Å²	49	9%	0.093	27%	0.27	C	S	.	.	H	α-helix	trans	-56.9	-60	175.6	0	0	0	0	0	111.8	D467 L471 V472 R473 N510	D467-G469 VanDerWaalsContact C-N 3.26Å; D467-G469 PolarHBondContact O-N 2.8Å; G469-L471 PolarHBondContact O-N 3.5Å; G469-V472 PolarHBondContact O-N 2.82Å; G469-R473 WeakPolarHBondContact O-CG 3.26Å; G469-R473 PolarHBondContact O-N 2.89Å; G469-R473 VanDerWaalsContact O-N 3.14Å; G469-N510 WeakPolarHBondContact CA-ND2 3.4Å; G469-N510 PolarHBondContact O-ND2 3.22Å
470	E	94.2	Very high	94.7	Very high	106 Å²	106	53.8 Å²	53.8	50%	0.495	29%	0.291	S	S	.	.	H	α-helix	trans	-60.9	-43.2	179.4	-169.1	62.6	-139.9	0	0	112.3	D467 V472 R473 S474	D467-E470 HydrophobicContact CB-CB 4.3Å; D467-E470 PolarHBondContact O-N 3.33Å; E470-V472 VanDerWaalsContact C-N 3.3Å; E470-V472 PolarHBondContact O-N 3.48Å; E470-R473 PolarHBondContact O-N 3.14Å; E470-R473 IonicContact OE1-NH1 2.72Å; E470-R473 PolarHBondContact OE1-NH1 3.29Å; E470-R473 IonicContact OE2-CZ 2.78Å; E470-R473 VanDerWaalsContact OE2-CZ 3.23Å; E470-R473 IonicContact OE2-NH1 2.76Å; E470-R473 PolarHBondContact OE2-NH1 3.46Å; E470-R473 IonicContact OE2-NH2 3.71Å; E470-R473 PolarHBondContact OE2-NH2 3.46Å; E470-S474 WeakPolarHBondContact O-CB 3.37Å; E470-S474 PolarHBondContact O-N 2.85Å
471	L	94.8	Very high	94.7	Very high	19 Å²	19	54.7 Å²	54.7	10%	0.099	30%	0.295	C	S	.	.	H	α-helix	trans	-53.9	-48.8	177.7	176.6	63.9	0	0	0	110.9	M427 E431 V436 A465 D467 G469 S474 F475	M427-L471 HydrophobicContact CE-CD2 4.23Å; E431-L471 HydrophobicContact CG-CD1 4.34Å; V436-L471 HydrophobicContact CB-CD1 4.43Å; V436-L471 HydrophobicContact CG1-CD1 4.3Å; V436-L471 HydrophobicContact CG1-CD2 4.2Å; V436-L471 HydrophobicContact CG1-CG 4.32Å; V436-L471 HydrophobicContact CG2-CD2 4.33Å; A465-L471 HydrophobicContact CB-CD2 3.54Å; D467-L471 WeakPolarHBondContact O-CB 3.5Å; D467-L471 PolarHBondContact O-N 3.27Å; G469-L471 PolarHBondContact O-N 3.5Å; L471-S474 PolarHBondContact O-N 3.04Å; L471-S474 PolarHBondContact O-OG 3.14Å; L471-F475 HydrophobicContact CD1-CE2 3.98Å; L471-F475 HydrophobicContact CD1-CZ 3.89Å; L471-F475 HydrophobicContact CG-CE2 4.17Å; L471-F475 WeakPolarHBondContact O-CD2 3.45Å; L471-F475 WeakPolarHBondContact O-CE2 3Å
472	V	96.2	Very high	94.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.3	-45	-180	171.9	0	0	0	0	111.6	W440 I462 A468 G469 E470 S474 F475 L479 I504	W440-V472 HydrophobicContact CH2-CG1 4.48Å; W440-V472 HydrophobicContact CZ2-CG1 4.05Å; I462-V472 HydrophobicContact CD1-CG2 3.96Å; I462-V472 HydrophobicContact CG1-CG2 3.86Å; I462-V472 HydrophobicContact CG2-CG2 4.46Å; A468-V472 WeakPolarHBondContact O-CG2 3.1Å; A468-V472 PolarHBondContact O-N 3.06Å; A468-V472 VanDerWaalsContact O-N 3.14Å; G469-V472 PolarHBondContact O-N 2.82Å; E470-V472 VanDerWaalsContact C-N 3.3Å; E470-V472 PolarHBondContact O-N 3.48Å; V472-S474 VanDerWaalsContact C-N 3.28Å; V472-S474 PolarHBondContact O-N 3.47Å; V472-F475 PolarHBondContact O-N 3.12Å; V472-L479 HydrophobicContact CG1-CD1 4.46Å; V472-L479 HydrophobicContact CG1-CD2 3.35Å; V472-L479 HydrophobicContact CG1-CG 4.02Å; V472-I504 HydrophobicContact CG1-CD1 4.42Å; V472-I504 HydrophobicContact CG1-CG1 4.29Å; V472-I504 HydrophobicContact CG1-CG2 4.21Å; V472-I504 HydrophobicContact CG2-CG1 4.38Å
473	R	94.8	Very high	94.7	Very high	71 Å²	71	54.4 Å²	54.4	27%	0.268	29%	0.294	S	S	.	.	H	α-helix	trans	-68.5	-25.1	-179.5	-67	-170.8	-80.6	76.3	-2	113.4	G469 E470 F475 E509 N510	G469-R473 WeakPolarHBondContact O-CG 3.26Å; G469-R473 PolarHBondContact O-N 2.89Å; G469-R473 VanDerWaalsContact O-N 3.14Å; E470-R473 PolarHBondContact O-N 3.14Å; E470-R473 IonicContact OE1-NH1 2.72Å; E470-R473 PolarHBondContact OE1-NH1 3.29Å; E470-R473 IonicContact OE2-CZ 2.78Å; E470-R473 VanDerWaalsContact OE2-CZ 3.23Å; E470-R473 IonicContact OE2-NH1 2.76Å; E470-R473 PolarHBondContact OE2-NH1 3.46Å; E470-R473 IonicContact OE2-NH2 3.71Å; E470-R473 PolarHBondContact OE2-NH2 3.46Å; R473-F475 PolarHBondContact O-N 3.4Å; R473-F475 VanDerWaalsContact O-N 3.16Å; R473-E509 IonicContact CZ-OE2 3.59Å; R473-E509 IonicContact NE-OE2 3.61Å; R473-E509 PolarHBondContact NE-OE2 2.94Å; R473-E509 IonicContact NH2-OE2 3.6Å; R473-E509 PolarHBondContact NH2-OE2 3.48Å; R473-N510 WeakPolarHBondContact CG-OD1 3.39Å
474	S	94.6	Very high	94.8	Very high	64 Å²	64	51.6 Å²	51.6	45%	0.448	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.6	176.5	78.2	0	0	0	0	113.1	E470 L471 V472 V476	E470-S474 WeakPolarHBondContact O-CB 3.37Å; E470-S474 PolarHBondContact O-N 2.85Å; L471-S474 PolarHBondContact O-N 3.04Å; L471-S474 PolarHBondContact O-OG 3.14Å; V472-S474 VanDerWaalsContact C-N 3.28Å; V472-S474 PolarHBondContact O-N 3.47Å; S474-V476 PolarHBondContact O-N 3.1Å
475	F	93.5	Very high	94.9	Very high	32 Å²	32	50.3 Å²	50.3	14%	0.14	28%	0.279	C	S	.	.	S	Bend	trans	-89	93.9	178.1	-54.6	-57.3	0	0	0	111.3	V436 R437 W440 L471 V472 R473 G477 G478	V436-F475 HydrophobicContact CB-CE2 4.44Å; V436-F475 HydrophobicContact CB-CZ 4.08Å; V436-F475 HydrophobicContact CG1-CE2 3.71Å; V436-F475 HydrophobicContact CG1-CZ 3.85Å; R437-F475 HydrophobicContact CB-CD1 4.3Å; R437-F475 HydrophobicContact CB-CE1 3.56Å; R437-F475 HydrophobicContact CB-CZ 4.25Å; R437-F475 HydrophobicContact CG-CD1 4.08Å; R437-F475 HydrophobicContact CG-CE1 3.81Å; W440-F475 AromaticContact CD1-CD2 3.24Å; W440-F475 AromaticContact CD1-CE2 3.31Å; W440-F475 AromaticContact CD1-CG 3.82Å; W440-F475 AromaticContact CD1-CZ 3.97Å; W440-F475 HydrophobicContact CD2-CD2 4.23Å; W440-F475 AromaticContact CE2-CD2 3.82Å; W440-F475 AromaticContact CG-CD2 3.94Å; W440-F475 HydrophobicContact CG-CD2 3.94Å; W440-F475 HydrophobicContact CG-CE2 4.35Å; W440-F475 HydrophobicContact CG-CG 4.16Å; W440-F475 AromaticContact NE1-CD2 3.16Å; W440-F475 AromaticContact NE1-CE2 3.32Å; W440-F475 VanDerWaalsContact NE1-CE2 3.32Å; L471-F475 HydrophobicContact CD1-CE2 3.98Å; L471-F475 HydrophobicContact CD1-CZ 3.89Å; L471-F475 HydrophobicContact CG-CE2 4.17Å; L471-F475 WeakPolarHBondContact O-CD2 3.45Å; L471-F475 WeakPolarHBondContact O-CE2 3Å; V472-F475 PolarHBondContact O-N 3.12Å; R473-F475 PolarHBondContact O-N 3.4Å; R473-F475 VanDerWaalsContact O-N 3.16Å; F475-G477 PolarHBondContact O-N 3.02Å; F475-G478 WeakPolarHBondContact O-CA 3.21Å; F475-G478 PolarHBondContact O-N 2.93Å
476	V	91.3	Very high	95.1	Very high	148 Å²	148	49.7 Å²	49.7	90%	0.897	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	123.1	178.1	-175.8	0	0	0	0	111.3	S474 G478	S474-V476 PolarHBondContact O-N 3.1Å; V476-G478 PolarHBondContact O-N 2.92Å
477	G	93.4	Very high	95.4	Very high	42 Å²	42	45.3 Å²	45.3	43%	0.433	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	2.9	-177.3	0	0	0	0	0	114.9	F475 L481	F475-G477 PolarHBondContact O-N 3.02Å; G477-L481 VanDerWaalsContact O-CB 3.3Å; G477-L481 WeakPolarHBondContact O-CB 3.49Å; G477-L481 PolarHBondContact O-N 3.39Å
478	G	94.7	Very high	95.5	Very high	6 Å²	6	41.4 Å²	41.4	6%	0.062	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-49	176.5	0	0	0	0	0	111.8	W440 F475 V476 E480 L481 I482	W440-G478 VanDerWaalsContact CZ3-C 3.41Å; W440-G478 WeakPolarHBondContact CZ3-O 3.43Å; F475-G478 WeakPolarHBondContact O-CA 3.21Å; F475-G478 PolarHBondContact O-N 2.93Å; V476-G478 PolarHBondContact O-N 2.92Å; G478-E480 PolarHBondContact O-N 3.46Å; G478-L481 WeakPolarHBondContact O-CB 3.38Å; G478-L481 PolarHBondContact O-N 2.88Å; G478-L481 VanDerWaalsContact O-N 3.15Å; G478-I482 PolarHBondContact O-N 3.47Å
479	L	96.7	Very high	95.7	Very high	11 Å²	11	50.2 Å²	50.2	6%	0.058	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-41.9	178.5	-68.5	-179.6	0	0	0	112.7	V472 I482 V483 I504 V513 I514	V472-L479 HydrophobicContact CG1-CD1 4.46Å; V472-L479 HydrophobicContact CG1-CD2 3.35Å; V472-L479 HydrophobicContact CG1-CG 4.02Å; L479-I482 WeakPolarHBondContact O-CG2 3.46Å; L479-V483 WeakPolarHBondContact O-CB 3.19Å; L479-V483 VanDerWaalsContact O-CG2 3.24Å; L479-V483 WeakPolarHBondContact O-CG2 3.36Å; L479-V483 PolarHBondContact O-N 2.95Å; L479-V483 VanDerWaalsContact O-N 3.14Å; L479-I504 HydrophobicContact CD2-CD1 4.21Å; L479-I504 HydrophobicContact CD2-CG2 3.6Å; L479-V513 HydrophobicContact CB-CG1 4.14Å; L479-V513 HydrophobicContact CD1-CB 3.73Å; L479-V513 HydrophobicContact CD1-CG1 3.5Å; L479-V513 HydrophobicContact CD1-CG2 4.46Å; L479-V513 HydrophobicContact CG-CG1 4.48Å; L479-I514 HydrophobicContact CB-CG2 4.15Å; L479-I514 HydrophobicContact CD1-CG2 4.48Å; L479-I514 HydrophobicContact CD2-CG2 3.73Å; L479-I514 HydrophobicContact CG-CG2 4.34Å
480	E	97.2	Very high	95.8	Very high	115 Å²	115	52.2 Å²	52.2	54%	0.537	28%	0.283	S	S	.	.	H	α-helix	trans	-60.2	-46.7	172	-173.7	-174.1	170.5	0	0	111.3	G478 V483 S484	G478-E480 PolarHBondContact O-N 3.46Å; E480-V483 PolarHBondContact O-N 3Å; E480-S484 WeakPolarHBondContact O-CB 3.38Å; E480-S484 PolarHBondContact O-N 3.3Å
481	L	97.2	Very high	95.9	Very high	31 Å²	31	50.7 Å²	50.7	16%	0.162	28%	0.278	C	S	.	.	H	α-helix	trans	-58.5	-52.5	179.8	175.4	64.9	0	0	0	111.2	L443 K444 G477 G478 V483 S484 L485	L443-L481 HydrophobicContact CB-CD2 3.84Å; L443-L481 HydrophobicContact CB-CG 4.45Å; L443-L481 HydrophobicContact CD1-CD2 4.43Å; K444-L481 HydrophobicContact CD-CD2 4.33Å; K444-L481 HydrophobicContact CG-CD1 4.17Å; K444-L481 HydrophobicContact CG-CD2 3.62Å; G477-L481 VanDerWaalsContact O-CB 3.3Å; G477-L481 WeakPolarHBondContact O-CB 3.49Å; G477-L481 PolarHBondContact O-N 3.39Å; G478-L481 WeakPolarHBondContact O-CB 3.38Å; G478-L481 PolarHBondContact O-N 2.88Å; G478-L481 VanDerWaalsContact O-N 3.15Å; L481-V483 VanDerWaalsContact C-N 3.3Å; L481-V483 PolarHBondContact O-N 3.32Å; L481-S484 WeakPolarHBondContact O-CB 3.37Å; L481-S484 PolarHBondContact O-N 3.1Å; L481-S484 VanDerWaalsContact O-N 3.11Å; L481-S484 PolarHBondContact O-OG 2.7Å; L481-L485 WeakPolarHBondContact O-CG 3.24Å; L481-L485 PolarHBondContact O-N 3.35Å; L481-L485 VanDerWaalsContact O-N 3.1Å
482	I	97.1	Very high	95.9	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-35.8	-176.4	-160.6	165.4	0	0	0	112	W440 G478 L479 L485 V497 A500 V501 I504	W440-I482 HydrophobicContact CH2-CB 4.22Å; W440-I482 HydrophobicContact CH2-CD1 4.15Å; W440-I482 HydrophobicContact CH2-CG2 4.13Å; W440-I482 HydrophobicContact CZ3-CB 3.93Å; W440-I482 HydrophobicContact CZ3-CD1 4.37Å; W440-I482 HydrophobicContact CZ3-CG2 4.23Å; G478-I482 PolarHBondContact O-N 3.47Å; L479-I482 WeakPolarHBondContact O-CG2 3.46Å; I482-L485 PolarHBondContact O-N 3.3Å; I482-V497 HydrophobicContact CG1-CG1 3.95Å; I482-V497 VanDerWaalsContact O-CG1 3.23Å; I482-V497 WeakPolarHBondContact O-CG1 3.34Å; I482-A500 HydrophobicContact CD1-CB 3.52Å; I482-V501 HydrophobicContact CG1-CG2 4.35Å; I482-I504 HydrophobicContact CD1-CD1 3.64Å; I482-I504 HydrophobicContact CG2-CD1 3.99Å
483	V	97.9	Very high	96	Very high	3 Å²	3	54 Å²	54	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-65.8	-42	173.2	173.6	0	0	0	0	110.5	L479 E480 L481 L485 L486 I514 H517 V519 L522	L479-V483 WeakPolarHBondContact O-CB 3.19Å; L479-V483 VanDerWaalsContact O-CG2 3.24Å; L479-V483 WeakPolarHBondContact O-CG2 3.36Å; L479-V483 PolarHBondContact O-N 2.95Å; L479-V483 VanDerWaalsContact O-N 3.14Å; E480-V483 PolarHBondContact O-N 3Å; L481-V483 VanDerWaalsContact C-N 3.3Å; L481-V483 PolarHBondContact O-N 3.32Å; V483-L485 PolarHBondContact O-N 3.21Å; V483-L486 VanDerWaalsContact O-CB 3.28Å; V483-L486 WeakPolarHBondContact O-CB 3.23Å; V483-L486 WeakPolarHBondContact O-CG 3.41Å; V483-L486 PolarHBondContact O-N 3.34Å; V483-L486 VanDerWaalsContact O-N 3.1Å; V483-I514 HydrophobicContact CG2-CB 3.84Å; V483-I514 HydrophobicContact CG2-CG2 3.92Å; V483-H517 HydrophobicContact CB-CB 4.25Å; V483-H517 HydrophobicContact CG1-CB 4.06Å; V483-H517 WeakPolarHBondContact CG1-O 3.36Å; V483-H517 HydrophobicContact CG2-CB 4.27Å; V483-V519 HydrophobicContact CG1-CB 4.37Å; V483-V519 HydrophobicContact CG2-CB 4.32Å; V483-V519 HydrophobicContact CG2-CG2 4.45Å; V483-L522 HydrophobicContact CG1-CD1 3.6Å; V483-L522 WeakPolarHBondContact O-CD1 3.46Å
484	S	97.3	Very high	96.2	Very high	53 Å²	53	51 Å²	51	37%	0.371	28%	0.282	S	S	.	.	H	α-helix	trans	-60.7	-32.7	178	81.6	0	0	0	0	113	E480 L481 L486 N487	E480-S484 WeakPolarHBondContact O-CB 3.38Å; E480-S484 PolarHBondContact O-N 3.3Å; L481-S484 WeakPolarHBondContact O-CB 3.37Å; L481-S484 PolarHBondContact O-N 3.1Å; L481-S484 VanDerWaalsContact O-N 3.11Å; L481-S484 PolarHBondContact O-OG 2.7Å; S484-L486 PolarHBondContact O-N 3.47Å; S484-N487 WeakPolarHBondContact O-CB 3.23Å; S484-N487 PolarHBondContact O-N 2.61Å; S484-N487 PolarHBondContact O-ND2 2.88Å
485	L	97.8	Very high	96.3	Very high	20 Å²	20	48.3 Å²	48.3	11%	0.105	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-68.1	-13.3	178.5	-66	-175.3	0	0	0	114	L443 Q451 L481 I482 V483 N487 S488 V497	L443-L485 HydrophobicContact CB-CD1 4.04Å; L443-L485 HydrophobicContact CD2-CD1 4.2Å; Q451-L485 HydrophobicContact CG-CD1 4.08Å; L481-L485 WeakPolarHBondContact O-CG 3.24Å; L481-L485 PolarHBondContact O-N 3.35Å; L481-L485 VanDerWaalsContact O-N 3.1Å; I482-L485 PolarHBondContact O-N 3.3Å; V483-L485 PolarHBondContact O-N 3.21Å; L485-N487 PolarHBondContact O-N 3.37Å; L485-N487 VanDerWaalsContact O-N 3.12Å; L485-S488 VanDerWaalsContact O-CB 3.23Å; L485-S488 WeakPolarHBondContact O-CB 3.42Å; L485-S488 PolarHBondContact O-N 3.21Å; L485-V497 HydrophobicContact CB-CG1 4.15Å; L485-V497 HydrophobicContact CB-CG2 3.76Å; L485-V497 HydrophobicContact CD1-CG2 4.11Å
486	L	97.7	Very high	96.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-65.4	-6.5	167.1	-62.3	171.9	0	0	0	112.9	V483 S484 L494 V497 V519 L522 L523 L526	V483-L486 VanDerWaalsContact O-CB 3.28Å; V483-L486 WeakPolarHBondContact O-CB 3.23Å; V483-L486 WeakPolarHBondContact O-CG 3.41Å; V483-L486 PolarHBondContact O-N 3.34Å; V483-L486 VanDerWaalsContact O-N 3.1Å; S484-L486 PolarHBondContact O-N 3.47Å; L486-L494 WeakPolarHBondContact O-CD2 3.31Å; L486-V497 HydrophobicContact CD2-CB 4.44Å; L486-V497 HydrophobicContact CD2-CG1 3.62Å; L486-V497 HydrophobicContact CG-CG1 3.95Å; L486-V519 HydrophobicContact CD1-CG2 3.91Å; L486-L522 HydrophobicContact CB-CB 3.92Å; L486-L522 HydrophobicContact CB-CD1 4.3Å; L486-L522 HydrophobicContact CD1-CB 3.95Å; L486-L522 HydrophobicContact CD1-CD1 4.46Å; L486-L523 HydrophobicContact CD1-CD2 3.85Å; L486-L523 HydrophobicContact CD1-CG 4.07Å; L486-L523 HydrophobicContact CD2-CD2 3.8Å; L486-L523 HydrophobicContact CG-CD2 4.49Å; L486-L526 HydrophobicContact CB-CD1 4.42Å; L486-L526 HydrophobicContact CD2-CD1 4.02Å
487	N	96.8	Very high	96.9	Very high	82 Å²	82	39.7 Å²	39.7	44%	0.439	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-89.9	-1.4	168	-66.1	-74.2	0	0	0	114	S484 L485 L522 R525	S484-N487 WeakPolarHBondContact O-CB 3.23Å; S484-N487 PolarHBondContact O-N 2.61Å; S484-N487 PolarHBondContact O-ND2 2.88Å; L485-N487 PolarHBondContact O-N 3.37Å; L485-N487 VanDerWaalsContact O-N 3.12Å; N487-L522 WeakPolarHBondContact OD1-CD2 3.06Å; N487-R525 PolarHBondContact OD1-NH1 3.25Å; N487-R525 PolarHBondContact OD1-NH2 2.95Å
488	S	96.4	Very high	97.1	Very high	32 Å²	32	37.7 Å²	37.7	22%	0.224	19%	0.193	C	C	.	.			trans	-58.3	146.9	179.3	-174.8	0	0	0	0	111.5	L485 D490 L494	L485-S488 VanDerWaalsContact O-CB 3.23Å; L485-S488 WeakPolarHBondContact O-CB 3.42Å; L485-S488 PolarHBondContact O-N 3.21Å; S488-D490 PolarHBondContact OG-N 2.72Å; S488-L494 WeakPolarHBondContact O-CD1 3.43Å
489	K	95.5	Very high	97.3	Very high	210 Å²	210	38.1 Å²	38.1	91%	0.913	20%	0.196	S	C	*	.	S	Bend	trans	-86.2	-13.5	173	-61.9	-177.5	-177.1	177	0	112.3
490	D	96.8	Very high	97.3	Very high	51 Å²	51	37.6 Å²	37.6	27%	0.273	19%	0.193	S	C	.	.			trans	-87	124.9	-177	-174.3	-82.9	0	0	0	111	P448 S488 E492 V493 L494	P448-D490 HydrophobicContact CB-CB 4.1Å; S488-D490 PolarHBondContact OG-N 2.72Å; D490-E492 VanDerWaalsContact C-N 3.35Å; D490-E492 PolarHBondContact O-N 2.73Å; D490-E492 WeakPolarHBondContact OD1-CA 3.28Å; D490-E492 WeakPolarHBondContact OD1-CB 3.48Å; D490-E492 PolarHBondContact OD1-N 3.4Å; D490-V493 HydrophobicContact CB-CB 4.08Å; D490-V493 HydrophobicContact CB-CG2 3.89Å; D490-V493 PolarHBondContact O-N 3.05Å; D490-V493 PolarHBondContact OD1-N 3.34Å; D490-L494 VanDerWaalsContact O-CG 3.31Å; D490-L494 WeakPolarHBondContact O-CG 3.42Å; D490-L494 PolarHBondContact O-N 3.31Å
491	L	96	Very high	97.4	Very high	74 Å²	74	32.1 Å²	32.1	39%	0.387	17%	0.168	S	C	.	.	H	α-helix	trans	-67.6	-32.7	-176.4	-73.3	171.3	0	0	0	112.9	A495 L534	L491-A495 WeakPolarHBondContact O-CB 3.42Å; L491-A495 PolarHBondContact O-N 3.24Å; L491-L534 HydrophobicContact CD2-CD2 4.19Å
492	E	95.8	Very high	97.4	Very high	89 Å²	89	31.1 Å²	31.1	42%	0.416	16%	0.163	S	C	.	.	H	α-helix	trans	-72.3	-40.3	179.4	-59.8	-169.1	149.5	0	0	110.7	D490 A495 A496	D490-E492 VanDerWaalsContact C-N 3.35Å; D490-E492 PolarHBondContact O-N 2.73Å; D490-E492 WeakPolarHBondContact OD1-CA 3.28Å; D490-E492 WeakPolarHBondContact OD1-CB 3.48Å; D490-E492 PolarHBondContact OD1-N 3.4Å; E492-A495 PolarHBondContact O-N 3.16Å; E492-A496 WeakPolarHBondContact O-CB 3.39Å; E492-A496 PolarHBondContact O-N 2.88Å
493	V	97.7	Very high	97.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.9	-50.3	171.7	174.4	0	0	0	0	110.3	P448 Q451 D490 A495 A496 V497	P448-V493 HydrophobicContact CB-CG2 3.9Å; P448-V493 VanDerWaalsContact O-CG2 3.29Å; P448-V493 WeakPolarHBondContact O-CG2 3Å; Q451-V493 HydrophobicContact CB-CG2 4.27Å; Q451-V493 HydrophobicContact CG-CG1 4.03Å; Q451-V493 HydrophobicContact CG-CG2 4.24Å; D490-V493 HydrophobicContact CB-CB 4.08Å; D490-V493 HydrophobicContact CB-CG2 3.89Å; D490-V493 PolarHBondContact O-N 3.05Å; D490-V493 PolarHBondContact OD1-N 3.34Å; V493-A495 VanDerWaalsContact C-N 3.34Å; V493-A495 PolarHBondContact O-N 3.04Å; V493-A496 PolarHBondContact O-N 3.18Å; V493-V497 HydrophobicContact CG1-CG2 3.97Å; V493-V497 WeakPolarHBondContact O-CB 3.43Å; V493-V497 WeakPolarHBondContact O-CG2 3.42Å; V493-V497 PolarHBondContact O-N 2.71Å
494	L	98.1	Very high	97.4	Very high	9 Å²	9	33.4 Å²	33.4	5%	0.047	17%	0.173	C	C	.	.	H	α-helix	trans	-59.1	-44	179.9	-71.5	174.2	0	0	0	112.1	L486 S488 D490 A496 V497 C498 L526 L534	L486-L494 WeakPolarHBondContact O-CD2 3.31Å; S488-L494 WeakPolarHBondContact O-CD1 3.43Å; D490-L494 VanDerWaalsContact O-CG 3.31Å; D490-L494 WeakPolarHBondContact O-CG 3.42Å; D490-L494 PolarHBondContact O-N 3.31Å; L494-A496 PolarHBondContact O-N 3.48Å; L494-V497 PolarHBondContact O-N 2.69Å; L494-C498 WeakPolarHBondContact O-CB 3.49Å; L494-C498 PolarHBondContact O-N 2.88Å; L494-C498 PolarHBondContact O-SG 3.28Å; L494-L526 HydrophobicContact CD1-CD2 3.91Å; L494-L526 HydrophobicContact CD2-CD1 4.03Å; L494-L526 HydrophobicContact CD2-CD2 4.12Å; L494-L534 HydrophobicContact CB-CD1 3.89Å; L494-L534 HydrophobicContact CB-CD2 4.27Å; L494-L534 HydrophobicContact CD1-CD2 4.28Å
495	A	97.7	Very high	97.4	Very high	6 Å²	6	31 Å²	31	5%	0.05	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-44.2	178.4	0	0	0	0	0	111.7	L491 E492 V493 A499 L534 P537	L491-A495 WeakPolarHBondContact O-CB 3.42Å; L491-A495 PolarHBondContact O-N 3.24Å; E492-A495 PolarHBondContact O-N 3.16Å; V493-A495 VanDerWaalsContact C-N 3.34Å; V493-A495 PolarHBondContact O-N 3.04Å; A495-A499 PolarHBondContact O-N 3.41Å; A495-A499 VanDerWaalsContact O-N 3.1Å; A495-L534 HydrophobicContact CB-CD1 4.36Å; A495-P537 HydrophobicContact CB-CG 4.03Å; A495-P537 WeakPolarHBondContact O-CB 3.37Å; A495-P537 WeakPolarHBondContact O-CG 3.44Å
496	A	98	Very high	97.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.7	-43.7	178.7	0	0	0	0	0	112.6	S452 A455 W456 E492 V493 L494 A499 A500	S452-A496 WeakPolarHBondContact O-CB 3.34Å; A455-A496 HydrophobicContact CB-CB 3.65Å; W456-A496 VanDerWaalsContact CD1-CB 3.43Å; W456-A496 HydrophobicContact CD2-CB 4.09Å; W456-A496 HydrophobicContact CG-CB 3.88Å; E492-A496 WeakPolarHBondContact O-CB 3.39Å; E492-A496 PolarHBondContact O-N 2.88Å; V493-A496 PolarHBondContact O-N 3.18Å; L494-A496 PolarHBondContact O-N 3.48Å; A496-A499 WeakPolarHBondContact O-CB 3.33Å; A496-A499 PolarHBondContact O-N 3.32Å; A496-A500 PolarHBondContact O-N 3.35Å
497	V	98.4	Very high	97.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-43.4	178.6	171.3	0	0	0	0	110.5	A455 I482 L485 L486 V493 L494 A499 A500 V501	A455-V497 HydrophobicContact CB-CG2 4.2Å; I482-V497 HydrophobicContact CG1-CG1 3.95Å; I482-V497 VanDerWaalsContact O-CG1 3.23Å; I482-V497 WeakPolarHBondContact O-CG1 3.34Å; L485-V497 HydrophobicContact CB-CG1 4.15Å; L485-V497 HydrophobicContact CB-CG2 3.76Å; L485-V497 HydrophobicContact CD1-CG2 4.11Å; L486-V497 HydrophobicContact CD2-CB 4.44Å; L486-V497 HydrophobicContact CD2-CG1 3.62Å; L486-V497 HydrophobicContact CG-CG1 3.95Å; V493-V497 HydrophobicContact CG1-CG2 3.97Å; V493-V497 WeakPolarHBondContact O-CB 3.43Å; V493-V497 WeakPolarHBondContact O-CG2 3.42Å; V493-V497 PolarHBondContact O-N 2.71Å; L494-V497 PolarHBondContact O-N 2.69Å; V497-A499 VanDerWaalsContact C-N 3.32Å; V497-A499 PolarHBondContact O-N 3Å; V497-A500 PolarHBondContact O-N 2.89Å; V497-V501 HydrophobicContact CG1-CG2 4.29Å; V497-V501 WeakPolarHBondContact O-CB 3.44Å; V497-V501 VanDerWaalsContact O-CG2 3.28Å; V497-V501 WeakPolarHBondContact O-CG2 3.19Å; V497-V501 PolarHBondContact O-N 3.37Å
498	C	98.4	Very high	97.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.1	-42.8	173.5	-74.2	0	0	0	0	111.8	L494 A500 V501 S502 P537 A541	L494-C498 WeakPolarHBondContact O-CB 3.49Å; L494-C498 PolarHBondContact O-N 2.88Å; L494-C498 PolarHBondContact O-SG 3.28Å; C498-A500 VanDerWaalsContact C-N 3.35Å; C498-A500 PolarHBondContact O-N 3.28Å; C498-V501 PolarHBondContact O-N 3.07Å; C498-S502 PolarHBondContact O-N 3.24Å; C498-P537 HydrophobicContact CB-CB 3.96Å; C498-A541 HydrophobicContact CB-CB 4.4Å; C498-A541 WeakPolarHBondContact O-CB 3.35Å
499	A	98.1	Very high	97.2	Very high	14 Å²	14	43.7 Å²	43.7	12%	0.116	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-43.1	176.4	0	0	0	0	0	111.9	W456 A495 A496 V497 S502 K503 P537	W456-A499 HydrophobicContact CE3-CB 4.05Å; W456-A499 HydrophobicContact CH2-CB 3.63Å; W456-A499 HydrophobicContact CZ2-CB 4.47Å; W456-A499 HydrophobicContact CZ3-CB 3.38Å; A495-A499 PolarHBondContact O-N 3.41Å; A495-A499 VanDerWaalsContact O-N 3.1Å; A496-A499 WeakPolarHBondContact O-CB 3.33Å; A496-A499 PolarHBondContact O-N 3.32Å; V497-A499 VanDerWaalsContact C-N 3.32Å; V497-A499 PolarHBondContact O-N 3Å; A499-S502 WeakPolarHBondContact O-CB 3.48Å; A499-S502 PolarHBondContact O-N 3.11Å; A499-K503 PolarHBondContact O-N 3.35Å; A499-P537 HydrophobicContact CB-CB 3.98Å
500	A	98.2	Very high	97.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.4	-43.3	177.1	0	0	0	0	0	112	C459 I482 A496 V497 C498 S502 K503 I504	C459-A500 VanDerWaalsContact SG-CA 3.59Å; C459-A500 PolarHBondContact SG-N 2.89Å; I482-A500 HydrophobicContact CD1-CB 3.52Å; A496-A500 PolarHBondContact O-N 3.35Å; V497-A500 PolarHBondContact O-N 2.89Å; C498-A500 VanDerWaalsContact C-N 3.35Å; C498-A500 PolarHBondContact O-N 3.28Å; A500-S502 VanDerWaalsContact C-N 3.28Å; A500-S502 PolarHBondContact O-N 3.47Å; A500-K503 PolarHBondContact O-N 3.47Å; A500-K503 VanDerWaalsContact O-N 3.07Å; A500-I504 WeakPolarHBondContact O-CG1 3.45Å; A500-I504 PolarHBondContact O-N 3.39Å
501	V	98.3	Very high	97.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.6	-40.6	174	168.5	0	0	0	0	111	I482 V497 C498 K503 I504 A505 I514 V519 A541	I482-V501 HydrophobicContact CG1-CG2 4.35Å; V497-V501 HydrophobicContact CG1-CG2 4.29Å; V497-V501 WeakPolarHBondContact O-CB 3.44Å; V497-V501 VanDerWaalsContact O-CG2 3.28Å; V497-V501 WeakPolarHBondContact O-CG2 3.19Å; V497-V501 PolarHBondContact O-N 3.37Å; C498-V501 PolarHBondContact O-N 3.07Å; V501-K503 VanDerWaalsContact C-N 3.28Å; V501-K503 PolarHBondContact O-N 3.21Å; V501-I504 PolarHBondContact O-N 2.96Å; V501-A505 WeakPolarHBondContact O-CB 3.4Å; V501-A505 PolarHBondContact O-N 3.28Å; V501-I514 HydrophobicContact CG1-CD1 4.19Å; V501-V519 HydrophobicContact CG1-CG2 3.96Å; V501-A541 HydrophobicContact CG1-CB 4.27Å
502	S	97.9	Very high	97.4	Very high	10 Å²	10	28.9 Å²	28.9	7%	0.07	15%	0.145	C	C	.	.	H	α-helix	trans	-58.9	-39.8	175.2	-172.3	0	0	0	0	112.2	C498 A499 A500 D540 K544	C498-S502 PolarHBondContact O-N 3.24Å; A499-S502 WeakPolarHBondContact O-CB 3.48Å; A499-S502 PolarHBondContact O-N 3.11Å; A500-S502 VanDerWaalsContact C-N 3.28Å; A500-S502 PolarHBondContact O-N 3.47Å; S502-D540 VanDerWaalsContact OG-C 3.27Å; S502-D540 PolarHBondContact OG-O 2.61Å; S502-D540 VanDerWaalsContact OG-O 3.05Å; S502-K544 WeakPolarHBondContact O-CG 3.46Å; S502-K544 WeakPolarHBondContact OG-CG 3.23Å
503	K	97.6	Very high	97.4	Very high	50 Å²	50	27 Å²	27	22%	0.217	14%	0.14	C	C	.	.	H	α-helix	trans	-73.5	-40.6	177.1	-65.7	-62.9	176	-175.4	0	113.3	C459 I462 A499 A500 V501 A505 E506	C459-K503 HydrophobicContact CB-CG 4.23Å; I462-K503 HydrophobicContact CB-CB 4.46Å; I462-K503 HydrophobicContact CG2-CB 4.19Å; A499-K503 PolarHBondContact O-N 3.35Å; A500-K503 PolarHBondContact O-N 3.47Å; A500-K503 VanDerWaalsContact O-N 3.07Å; V501-K503 VanDerWaalsContact C-N 3.28Å; V501-K503 PolarHBondContact O-N 3.21Å; K503-A505 VanDerWaalsContact C-N 3.31Å; K503-A505 PolarHBondContact O-N 3.02Å; K503-E506 IonicContact NZ-OE1 2.86Å; K503-E506 WeakPolarHBondContact O-CB 3.41Å; K503-E506 WeakPolarHBondContact O-CG 3.2Å; K503-E506 PolarHBondContact O-N 3.1Å
504	I	97.6	Very high	97.4	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-61.9	-41.8	175.5	-69.4	171.2	0	0	0	110.8	W440 I462 V472 L479 I482 A500 V501 E506 D507 N510 I514	W440-I504 HydrophobicContact CH2-CD1 3.87Å; W440-I504 HydrophobicContact CZ2-CD1 4.21Å; I462-I504 HydrophobicContact CD1-CD1 4.26Å; I462-I504 HydrophobicContact CD1-CG1 3.58Å; V472-I504 HydrophobicContact CG1-CD1 4.42Å; V472-I504 HydrophobicContact CG1-CG1 4.29Å; V472-I504 HydrophobicContact CG1-CG2 4.21Å; V472-I504 HydrophobicContact CG2-CG1 4.38Å; L479-I504 HydrophobicContact CD2-CD1 4.21Å; L479-I504 HydrophobicContact CD2-CG2 3.6Å; I482-I504 HydrophobicContact CD1-CD1 3.64Å; I482-I504 HydrophobicContact CG2-CD1 3.99Å; A500-I504 WeakPolarHBondContact O-CG1 3.45Å; A500-I504 PolarHBondContact O-N 3.39Å; V501-I504 PolarHBondContact O-N 2.96Å; I504-E506 PolarHBondContact O-N 3.4Å; I504-E506 VanDerWaalsContact O-N 3.11Å; I504-D507 PolarHBondContact O-N 2.97Å; I504-N510 HydrophobicContact CG2-CB 3.8Å; I504-N510 WeakPolarHBondContact O-CB 3.45Å; I504-I514 HydrophobicContact CG2-CG2 4.2Å
505	A	97.5	Very high	97.3	Very high	2 Å²	2	27.8 Å²	27.8	2%	0.017	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	2.9	-179.8	0	0	0	0	0	114.6	V501 K503 D507 L511 I514 K544	V501-A505 WeakPolarHBondContact O-CB 3.4Å; V501-A505 PolarHBondContact O-N 3.28Å; K503-A505 VanDerWaalsContact C-N 3.31Å; K503-A505 PolarHBondContact O-N 3.02Å; A505-D507 VanDerWaalsContact C-N 3.31Å; A505-L511 HydrophobicContact CB-CD1 4.09Å; A505-I514 HydrophobicContact CB-CD1 4.01Å; A505-K544 HydrophobicContact CB-CB 3.79Å
506	E	96	Very high	97.3	Very high	93 Å²	93	34.2 Å²	34.2	44%	0.435	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-23.6	170.9	-61	-169.1	152.2	0	0	112.1	K503 I504 K544	K503-E506 IonicContact NZ-OE1 2.86Å; K503-E506 WeakPolarHBondContact O-CB 3.41Å; K503-E506 WeakPolarHBondContact O-CG 3.2Å; K503-E506 PolarHBondContact O-N 3.1Å; I504-E506 PolarHBondContact O-N 3.4Å; I504-E506 VanDerWaalsContact O-N 3.11Å; E506-K544 HydrophobicContact CG-CD 4.1Å; E506-K544 VanDerWaalsContact OE1-CE 3.23Å; E506-K544 WeakPolarHBondContact OE1-CE 3.28Å; E506-K544 IonicContact OE1-NZ 2.71Å; E506-K544 PolarHBondContact OE1-NZ 2.91Å
507	D	96.6	Very high	97.2	Very high	51 Å²	51	38 Å²	38	27%	0.273	20%	0.196	S	C	.	.	S	Bend	trans	-94.2	132.5	173.4	174.9	81.2	0	0	0	110.7	I504 A505 E509 N510 L511	I504-D507 PolarHBondContact O-N 2.97Å; A505-D507 VanDerWaalsContact C-N 3.31Å; D507-E509 PolarHBondContact OD2-N 3.37Å; D507-N510 HydrophobicContact CB-CB 4.04Å; D507-N510 WeakPolarHBondContact OD2-CB 3.47Å; D507-N510 PolarHBondContact OD2-N 2.92Å; D507-N510 PolarHBondContact OD2-ND2 3.38Å; D507-L511 VanDerWaalsContact O-CB 3.31Å; D507-L511 WeakPolarHBondContact O-CB 3.33Å; D507-L511 PolarHBondContact O-N 2.93Å
508	E	95.9	Very high	97.1	Very high	146 Å²	146	39.2 Å²	39.2	68%	0.682	21%	0.208	S	C	*	.	H	α-helix	trans	-68.2	-37.2	-172.9	-69.6	-169.4	165.3	0	0	112.9	L511 A512 W548	E508-L511 PolarHBondContact O-N 3.42Å; E508-A512 PolarHBondContact O-N 3.1Å; E508-W548 HydrophobicContact CB-CZ3 4.38Å
509	E	96	Very high	97.1	Very high	111 Å²	111	39.2 Å²	39.2	52%	0.519	21%	0.208	S	C	.	.	H	α-helix	trans	-70.1	-45.4	179	-64	178.9	167.3	0	0	110.9	R473 D507 L511 A512 V513	R473-E509 IonicContact CZ-OE2 3.59Å; R473-E509 IonicContact NE-OE2 3.61Å; R473-E509 PolarHBondContact NE-OE2 2.94Å; R473-E509 IonicContact NH2-OE2 3.6Å; R473-E509 PolarHBondContact NH2-OE2 3.48Å; D507-E509 PolarHBondContact OD2-N 3.37Å; E509-L511 VanDerWaalsContact C-N 3.27Å; E509-L511 PolarHBondContact O-N 2.82Å; E509-A512 WeakPolarHBondContact O-CB 3.48Å; E509-A512 PolarHBondContact O-N 3.49Å; E509-V513 WeakPolarHBondContact O-CG2 3.34Å; E509-V513 PolarHBondContact O-N 3.47Å; E509-V513 VanDerWaalsContact O-N 3.1Å
510	N	97.1	Very high	97.1	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.011	20%	0.204	C	C	.	.	H	α-helix	trans	-57.2	-42.8	172.3	-81.2	-30.9	0	0	0	112	G469 R473 I504 D507 A512 V513 I514	G469-N510 WeakPolarHBondContact CA-ND2 3.4Å; G469-N510 PolarHBondContact O-ND2 3.22Å; R473-N510 WeakPolarHBondContact CG-OD1 3.39Å; I504-N510 HydrophobicContact CG2-CB 3.8Å; I504-N510 WeakPolarHBondContact O-CB 3.45Å; D507-N510 HydrophobicContact CB-CB 4.04Å; D507-N510 WeakPolarHBondContact OD2-CB 3.47Å; D507-N510 PolarHBondContact OD2-N 2.92Å; D507-N510 PolarHBondContact OD2-ND2 3.38Å; N510-A512 VanDerWaalsContact C-N 3.35Å; N510-V513 PolarHBondContact O-N 3.23Å; N510-I514 WeakPolarHBondContact O-CG1 3.33Å; N510-I514 PolarHBondContact O-N 2.96Å
511	L	97.1	Very high	97	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-42.3	177.5	177.2	53.9	0	0	0	111.9	A505 D507 E508 E509 I514 T515 C545 T547 W548	A505-L511 HydrophobicContact CB-CD1 4.09Å; D507-L511 VanDerWaalsContact O-CB 3.31Å; D507-L511 WeakPolarHBondContact O-CB 3.33Å; D507-L511 PolarHBondContact O-N 2.93Å; E508-L511 PolarHBondContact O-N 3.42Å; E509-L511 VanDerWaalsContact C-N 3.27Å; E509-L511 PolarHBondContact O-N 2.82Å; L511-I514 HydrophobicContact CD1-CD1 4.06Å; L511-I514 HydrophobicContact CD1-CG1 4.2Å; L511-I514 VanDerWaalsContact O-CG1 3.31Å; L511-I514 WeakPolarHBondContact O-CG1 3.47Å; L511-T515 VanDerWaalsContact O-CB 3.3Å; L511-T515 WeakPolarHBondContact O-CB 3.18Å; L511-T515 PolarHBondContact O-N 3.19Å; L511-T515 PolarHBondContact O-OG1 3.25Å; L511-C545 HydrophobicContact CD1-CB 4.2Å; L511-T547 WeakPolarHBondContact CD2-OG1 3.28Å; L511-W548 HydrophobicContact CD2-CB 3.78Å; L511-W548 HydrophobicContact CD2-CE3 4.23Å; L511-W548 HydrophobicContact CG-CB 4.02Å; L511-W548 HydrophobicContact CG-CE3 4.27Å; L511-W548 HydrophobicContact CG-CG 4.47Å
512	A	96.5	Very high	97	Very high	23 Å²	23	44 Å²	44	19%	0.19	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-48.3	174.5	0	0	0	0	0	111.1	E508 E509 N510 T515 D516 W548	E508-A512 PolarHBondContact O-N 3.1Å; E509-A512 WeakPolarHBondContact O-CB 3.48Å; E509-A512 PolarHBondContact O-N 3.49Å; N510-A512 VanDerWaalsContact C-N 3.35Å; A512-T515 VanDerWaalsContact O-CB 3.28Å; A512-T515 WeakPolarHBondContact O-CB 3.31Å; A512-T515 PolarHBondContact O-N 3.25Å; A512-T515 VanDerWaalsContact O-N 3.16Å; A512-D516 PolarHBondContact O-N 3.04Å; A512-W548 HydrophobicContact CB-CH2 3.76Å; A512-W548 HydrophobicContact CB-CZ2 3.84Å; A512-W548 HydrophobicContact CB-CZ3 4.3Å
513	V	96.7	Very high	97	Very high	50 Å²	50	43.6 Å²	43.6	30%	0.303	23%	0.233	S	C	.	.	H	α-helix	trans	-65.1	-44.7	-177.8	178.4	0	0	0	0	112.5	L479 E509 N510 T515 D516 H517	L479-V513 HydrophobicContact CB-CG1 4.14Å; L479-V513 HydrophobicContact CD1-CB 3.73Å; L479-V513 HydrophobicContact CD1-CG1 3.5Å; L479-V513 HydrophobicContact CD1-CG2 4.46Å; L479-V513 HydrophobicContact CG-CG1 4.48Å; E509-V513 WeakPolarHBondContact O-CG2 3.34Å; E509-V513 PolarHBondContact O-N 3.47Å; E509-V513 VanDerWaalsContact O-N 3.1Å; N510-V513 PolarHBondContact O-N 3.23Å; V513-T515 PolarHBondContact O-N 3.14Å; V513-D516 PolarHBondContact O-N 3.16Å; V513-H517 PolarHBondContact O-CD2 3.26Å; V513-H517 PolarHBondContact O-N 3.35Å; V513-H517 VanDerWaalsContact O-N 3.14Å
514	I	97.6	Very high	97	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.5	-27	176.6	64.5	176.6	0	0	0	112.2	L479 V483 V501 I504 A505 N510 L511 H517 G518 V519	L479-I514 HydrophobicContact CB-CG2 4.15Å; L479-I514 HydrophobicContact CD1-CG2 4.48Å; L479-I514 HydrophobicContact CD2-CG2 3.73Å; L479-I514 HydrophobicContact CG-CG2 4.34Å; V483-I514 HydrophobicContact CG2-CB 3.84Å; V483-I514 HydrophobicContact CG2-CG2 3.92Å; V501-I514 HydrophobicContact CG1-CD1 4.19Å; I504-I514 HydrophobicContact CG2-CG2 4.2Å; A505-I514 HydrophobicContact CB-CD1 4.01Å; N510-I514 WeakPolarHBondContact O-CG1 3.33Å; N510-I514 PolarHBondContact O-N 2.96Å; L511-I514 HydrophobicContact CD1-CD1 4.06Å; L511-I514 HydrophobicContact CD1-CG1 4.2Å; L511-I514 VanDerWaalsContact O-CG1 3.31Å; L511-I514 WeakPolarHBondContact O-CG1 3.47Å; I514-H517 PolarHBondContact O-N 3.03Å; I514-G518 PolarHBondContact O-N 3.47Å; I514-V519 HydrophobicContact CB-CB 4.39Å; I514-V519 HydrophobicContact CB-CG1 4.44Å; I514-V519 HydrophobicContact CD1-CG1 4.48Å; I514-V519 HydrophobicContact CG1-CG1 4.15Å; I514-V519 VanDerWaalsContact O-CB 3.26Å; I514-V519 WeakPolarHBondContact O-CB 3.26Å; I514-V519 WeakPolarHBondContact O-CG1 3.3Å; I514-V519 PolarHBondContact O-N 3.39Å
515	T	97.1	Very high	97	Very high	25 Å²	25	47.8 Å²	47.8	15%	0.153	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-46.9	173.1	-61.7	0	0	0	0	110.4	L511 A512 V513 H517 G518 N551	L511-T515 VanDerWaalsContact O-CB 3.3Å; L511-T515 WeakPolarHBondContact O-CB 3.18Å; L511-T515 PolarHBondContact O-N 3.19Å; L511-T515 PolarHBondContact O-OG1 3.25Å; A512-T515 VanDerWaalsContact O-CB 3.28Å; A512-T515 WeakPolarHBondContact O-CB 3.31Å; A512-T515 PolarHBondContact O-N 3.25Å; A512-T515 VanDerWaalsContact O-N 3.16Å; V513-T515 PolarHBondContact O-N 3.14Å; T515-H517 PolarHBondContact O-N 2.66Å; T515-G518 PolarHBondContact O-N 2.7Å; T515-N551 WeakPolarHBondContact CG2-OD1 3.45Å; T515-N551 PolarHBondContact OG1-ND2 2.86Å
516	D	96	Very high	96.9	Very high	141 Å²	141	48.8 Å²	48.8	75%	0.754	25%	0.254	S	S	*	.	H	α-helix	trans	-61.8	-31	176.3	-68.6	-17.4	0	0	0	112.5	A512 V513 G518	A512-D516 PolarHBondContact O-N 3.04Å; V513-D516 PolarHBondContact O-N 3.16Å; D516-G518 PolarHBondContact O-N 3.25Å
517	H	96.6	Very high	97	Very high	79 Å²	79	44.4 Å²	44.4	37%	0.366	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	4.5	173.2	-69.9	-59.5	0	0	0	114.7	V483 V513 I514 T515	V483-H517 HydrophobicContact CB-CB 4.25Å; V483-H517 HydrophobicContact CG1-CB 4.06Å; V483-H517 WeakPolarHBondContact CG1-O 3.36Å; V483-H517 HydrophobicContact CG2-CB 4.27Å; V513-H517 PolarHBondContact O-CD2 3.26Å; V513-H517 PolarHBondContact O-N 3.35Å; V513-H517 VanDerWaalsContact O-N 3.14Å; I514-H517 PolarHBondContact O-N 3.03Å; T515-H517 PolarHBondContact O-N 2.66Å
518	G	96.7	Very high	96.9	Very high	25 Å²	25	48.3 Å²	48.3	26%	0.258	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	32.8	173.1	0	0	0	0	0	114.5	I514 T515 D516 V520 P521 L522	I514-G518 PolarHBondContact O-N 3.47Å; T515-G518 PolarHBondContact O-N 2.7Å; D516-G518 PolarHBondContact O-N 3.25Å; G518-V520 PolarHBondContact O-N 3.01Å; G518-P521 WeakPolarHBondContact O-CD 3.42Å; G518-L522 WeakPolarHBondContact O-CG 3.23Å
519	V	97.9	Very high	96.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.2	-35.4	176.8	73.1	0	0	0	0	112.8	V483 L486 V501 I514 L522 L523	V483-V519 HydrophobicContact CG1-CB 4.37Å; V483-V519 HydrophobicContact CG2-CB 4.32Å; V483-V519 HydrophobicContact CG2-CG2 4.45Å; L486-V519 HydrophobicContact CD1-CG2 3.91Å; V501-V519 HydrophobicContact CG1-CG2 3.96Å; I514-V519 HydrophobicContact CB-CB 4.39Å; I514-V519 HydrophobicContact CB-CG1 4.44Å; I514-V519 HydrophobicContact CD1-CG1 4.48Å; I514-V519 HydrophobicContact CG1-CG1 4.15Å; I514-V519 VanDerWaalsContact O-CB 3.26Å; I514-V519 WeakPolarHBondContact O-CB 3.26Å; I514-V519 WeakPolarHBondContact O-CG1 3.3Å; I514-V519 PolarHBondContact O-N 3.39Å; V519-L522 PolarHBondContact O-N 3.3Å; V519-L523 HydrophobicContact CG2-CD1 3.74Å; V519-L523 HydrophobicContact CG2-CG 3.97Å; V519-L523 WeakPolarHBondContact O-CB 3.48Å; V519-L523 WeakPolarHBondContact O-CG 3.36Å; V519-L523 PolarHBondContact O-N 3.24Å
520	V	97.6	Very high	96.7	Very high	6 Å²	6	46 Å²	46	4%	0.036	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-54	-175.5	172.8	0	0	0	0	112.5	G518 L522 L523 S524 N551 D554 F555	G518-V520 PolarHBondContact O-N 3.01Å; V520-L522 VanDerWaalsContact C-N 3.27Å; V520-L522 PolarHBondContact O-N 2.92Å; V520-L523 PolarHBondContact O-N 3.4Å; V520-S524 VanDerWaalsContact O-CB 3.3Å; V520-S524 WeakPolarHBondContact O-CB 3.35Å; V520-S524 PolarHBondContact O-N 2.94Å; V520-S524 PolarHBondContact O-OG 3.35Å; V520-N551 HydrophobicContact CG2-CB 3.88Å; V520-D554 HydrophobicContact CG1-CB 3.78Å; V520-F555 HydrophobicContact CB-CE1 4.44Å; V520-F555 HydrophobicContact CB-CE2 4.44Å; V520-F555 HydrophobicContact CB-CZ 4.28Å; V520-F555 HydrophobicContact CG1-CB 4.47Å; V520-F555 HydrophobicContact CG1-CD1 3.85Å; V520-F555 HydrophobicContact CG1-CD2 4.07Å; V520-F555 HydrophobicContact CG1-CE1 4.01Å; V520-F555 HydrophobicContact CG1-CE2 4.23Å; V520-F555 HydrophobicContact CG1-CG 3.86Å; V520-F555 HydrophobicContact CG1-CZ 4.19Å; V520-F555 HydrophobicContact CG2-CD2 4.22Å; V520-F555 HydrophobicContact CG2-CE2 3.76Å; V520-F555 HydrophobicContact CG2-CZ 3.95Å
521	P	97.4	Very high	96.5	Very high	84 Å²	84	47.6 Å²	47.6	55%	0.545	25%	0.246	S	C	.	.	H	α-helix	trans	-55.6	-40	174	-27.2	32.1	0	0	0	113.8	G518 S524 R525	G518-P521 WeakPolarHBondContact O-CD 3.42Å; P521-S524 PolarHBondContact O-N 3.35Å; P521-R525 PolarHBondContact O-N 3.32Å; P521-R525 VanDerWaalsContact O-N 3.09Å
522	L	97.7	Very high	96.2	Very high	26 Å²	26	49.9 Å²	49.9	14%	0.136	26%	0.258	C	S	.	.	H	α-helix	trans	-68.4	-49.5	-177	-66.6	172.9	0	0	0	111.6	V483 L486 N487 G518 V519 V520 S524 R525 L526	V483-L522 HydrophobicContact CG1-CD1 3.6Å; V483-L522 WeakPolarHBondContact O-CD1 3.46Å; L486-L522 HydrophobicContact CB-CB 3.92Å; L486-L522 HydrophobicContact CB-CD1 4.3Å; L486-L522 HydrophobicContact CD1-CB 3.95Å; L486-L522 HydrophobicContact CD1-CD1 4.46Å; N487-L522 WeakPolarHBondContact OD1-CD2 3.06Å; G518-L522 WeakPolarHBondContact O-CG 3.23Å; V519-L522 PolarHBondContact O-N 3.3Å; V520-L522 VanDerWaalsContact C-N 3.27Å; V520-L522 PolarHBondContact O-N 2.92Å; L522-S524 VanDerWaalsContact C-N 3.35Å; L522-S524 PolarHBondContact O-N 3.49Å; L522-R525 PolarHBondContact O-N 3.49Å; L522-L526 WeakPolarHBondContact O-CG 3.45Å; L522-L526 PolarHBondContact O-N 3.36Å
523	L	98.1	Very high	95.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-41.4	174	-68	178.7	0	0	0	111.5	L486 V519 V520 R525 L526 T527 L538 A541 V542 F555	L486-L523 HydrophobicContact CD1-CD2 3.85Å; L486-L523 HydrophobicContact CD1-CG 4.07Å; L486-L523 HydrophobicContact CD2-CD2 3.8Å; L486-L523 HydrophobicContact CG-CD2 4.49Å; V519-L523 HydrophobicContact CG2-CD1 3.74Å; V519-L523 HydrophobicContact CG2-CG 3.97Å; V519-L523 WeakPolarHBondContact O-CB 3.48Å; V519-L523 WeakPolarHBondContact O-CG 3.36Å; V519-L523 PolarHBondContact O-N 3.24Å; V520-L523 PolarHBondContact O-N 3.4Å; L523-R525 VanDerWaalsContact C-N 3.29Å; L523-R525 PolarHBondContact O-N 3.09Å; L523-L526 PolarHBondContact O-N 2.78Å; L523-T527 WeakPolarHBondContact O-CG2 3.31Å; L523-T527 PolarHBondContact O-N 2.76Å; L523-L538 HydrophobicContact CB-CD1 4.15Å; L523-L538 HydrophobicContact CD2-CD1 3.71Å; L523-L538 HydrophobicContact CG-CD1 4.49Å; L523-A541 HydrophobicContact CD1-CB 4.06Å; L523-A541 HydrophobicContact CD2-CB 4.23Å; L523-V542 HydrophobicContact CB-CG2 4.32Å; L523-V542 HydrophobicContact CD1-CG2 4.43Å; L523-F555 HydrophobicContact CB-CE1 3.89Å; L523-F555 HydrophobicContact CB-CZ 4.23Å; L523-F555 HydrophobicContact CD1-CZ 4.03Å
524	S	97.6	Very high	95.9	Very high	6 Å²	6	53.7 Å²	53.7	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-56.7	-43.2	178	-60.9	0	0	0	0	112	V520 P521 L522 L526 T527 F555 A558	V520-S524 VanDerWaalsContact O-CB 3.3Å; V520-S524 WeakPolarHBondContact O-CB 3.35Å; V520-S524 PolarHBondContact O-N 2.94Å; V520-S524 PolarHBondContact O-OG 3.35Å; P521-S524 PolarHBondContact O-N 3.35Å; L522-S524 VanDerWaalsContact C-N 3.35Å; L522-S524 PolarHBondContact O-N 3.49Å; S524-L526 VanDerWaalsContact C-N 3.28Å; S524-L526 PolarHBondContact O-N 3.05Å; S524-T527 WeakPolarHBondContact O-CB 3.27Å; S524-T527 WeakPolarHBondContact O-CG2 3.25Å; S524-T527 PolarHBondContact O-N 3.06Å; S524-T527 PolarHBondContact O-OG1 2.88Å; S524-F555 VanDerWaalsContact OG-CD1 3.28Å; S524-F555 WeakPolarHBondContact OG-CD1 3.43Å; S524-A558 WeakPolarHBondContact OG-CB 3.3Å
525	R	96.8	Very high	95.9	Very high	134 Å²	134	55.6 Å²	55.6	51%	0.506	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-34.5	177.9	-173.7	178.7	61.9	-165.9	-4.4	112.6	N487 P521 L522 L523 T527	N487-R525 PolarHBondContact OD1-NH1 3.25Å; N487-R525 PolarHBondContact OD1-NH2 2.95Å; P521-R525 PolarHBondContact O-N 3.32Å; P521-R525 VanDerWaalsContact O-N 3.09Å; L522-R525 PolarHBondContact O-N 3.49Å; L523-R525 VanDerWaalsContact C-N 3.29Å; L523-R525 PolarHBondContact O-N 3.09Å; R525-T527 PolarHBondContact O-N 3.35Å
526	L	97.1	Very high	95.8	Very high	22 Å²	22	55.8 Å²	55.8	12%	0.115	27%	0.272	C	S	.	.	H	α-helix	trans	-72.1	-17	179.9	-62.4	176.7	0	0	0	113.1	L486 L494 L522 L523 S524 H528 T529 L538	L486-L526 HydrophobicContact CB-CD1 4.42Å; L486-L526 HydrophobicContact CD2-CD1 4.02Å; L494-L526 HydrophobicContact CD1-CD2 3.91Å; L494-L526 HydrophobicContact CD2-CD1 4.03Å; L494-L526 HydrophobicContact CD2-CD2 4.12Å; L522-L526 WeakPolarHBondContact O-CG 3.45Å; L522-L526 PolarHBondContact O-N 3.36Å; L523-L526 PolarHBondContact O-N 2.78Å; S524-L526 VanDerWaalsContact C-N 3.28Å; S524-L526 PolarHBondContact O-N 3.05Å; L526-H528 PolarHBondContact O-N 3.48Å; L526-T529 WeakPolarHBondContact O-CG2 3.45Å; L526-T529 PolarHBondContact O-N 3.13Å; L526-L538 HydrophobicContact CB-CD1 4.05Å; L526-L538 HydrophobicContact CB-CD2 3.86Å; L526-L538 WeakPolarHBondContact O-CD2 3.26Å
527	T	96.5	Very high	95.8	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.5	-177.1	66.9	0	0	0	0	114.7	L523 S524 R525 T529 L538 A560 P563 I564 Y567	L523-T527 WeakPolarHBondContact O-CG2 3.31Å; L523-T527 PolarHBondContact O-N 2.76Å; S524-T527 WeakPolarHBondContact O-CB 3.27Å; S524-T527 WeakPolarHBondContact O-CG2 3.25Å; S524-T527 PolarHBondContact O-N 3.06Å; S524-T527 PolarHBondContact O-OG1 2.88Å; R525-T527 PolarHBondContact O-N 3.35Å; T527-T529 VanDerWaalsContact C-N 3.28Å; T527-T529 PolarHBondContact O-N 3.35Å; T527-L538 HydrophobicContact CG2-CD2 4.27Å; T527-A560 HydrophobicContact CG2-CB 4.05Å; T527-P563 VanDerWaalsContact O-CB 3.3Å; T527-P563 WeakPolarHBondContact O-CB 3.18Å; T527-I564 HydrophobicContact CG2-CD1 4.06Å; T527-I564 HydrophobicContact CG2-CG1 3.91Å; T527-Y567 VanDerWaalsContact CA-OH 3.26Å; T527-Y567 WeakPolarHBondContact CA-OH 3.39Å; T527-Y567 WeakPolarHBondContact O-CE1 3.37Å; T527-Y567 VanDerWaalsContact O-CZ 3.22Å; T527-Y567 PolarHBondContact O-OH 3.44Å
528	H	94.7	Very high	95.9	Very high	133 Å²	133	45.9 Å²	45.9	62%	0.616	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	0.2	173.5	-64.9	-71	0	0	0	114.3	L526	L526-H528 PolarHBondContact O-N 3.48Å
529	T	94.9	Very high	95.9	Very high	26 Å²	26	44.7 Å²	44.7	16%	0.16	21%	0.21	C	C	.	.			trans	-61.5	148.4	180	-172.2	0	0	0	0	113.5	L526 T527 D531 L534 R535 L538 Y567	L526-T529 WeakPolarHBondContact O-CG2 3.45Å; L526-T529 PolarHBondContact O-N 3.13Å; T527-T529 VanDerWaalsContact C-N 3.28Å; T527-T529 PolarHBondContact O-N 3.35Å; T529-D531 PolarHBondContact OG1-N 3.35Å; T529-L534 HydrophobicContact CG2-CB 4.17Å; T529-L534 HydrophobicContact CG2-CD2 3.84Å; T529-L534 HydrophobicContact CG2-CG 3.95Å; T529-R535 HydrophobicContact CG2-CG 3.91Å; T529-R535 PolarHBondContact O-NE 3.02Å; T529-R535 PolarHBondContact O-NH2 3.42Å; T529-L538 HydrophobicContact CG2-CD2 4.37Å; T529-Y567 VanDerWaalsContact CG2-OH 3.23Å; T529-Y567 WeakPolarHBondContact CG2-OH 3.41Å
530	K	92.9	Very high	95.9	Very high	182 Å²	182	47 Å²	47	79%	0.791	22%	0.223	S	C	*	.			trans	-100.5	-9.6	172.7	-64.3	-175.7	-176.1	177.2	0	113.6	R535	K530-R535 PolarHBondContact O-NH1 2.87Å; K530-R535 PolarHBondContact O-NH2 3.28Å
531	D	93.2	Very high	95.9	Very high	37 Å²	37	46.7 Å²	46.7	20%	0.198	22%	0.221	C	C	.	.			trans	-89.5	116	-172.7	-164.3	-45.4	0	0	0	111.4	T529 R533 L534 R535	T529-D531 PolarHBondContact OG1-N 3.35Å; D531-R533 PolarHBondContact O-N 3.32Å; D531-R533 WeakPolarHBondContact OD1-CB 3.38Å; D531-R533 WeakPolarHBondContact OD1-CG 3.34Å; D531-R533 IonicContact OD1-CZ 3.68Å; D531-R533 PolarHBondContact OD1-N 3.14Å; D531-R533 IonicContact OD1-NE 2.7Å; D531-R533 PolarHBondContact OD1-NE 3.45Å; D531-R533 IonicContact OD1-NH2 3.19Å; D531-R533 IonicContact OD2-CZ 2.87Å; D531-R533 IonicContact OD2-NE 3.98Å; D531-R533 PolarHBondContact OD2-NE 2.93Å; D531-R533 IonicContact OD2-NH2 3.73Å; D531-R533 PolarHBondContact OD2-NH2 3.39Å; D531-L534 PolarHBondContact O-N 2.91Å; D531-L534 VanDerWaalsContact O-N 3.08Å; D531-R535 WeakPolarHBondContact O-CG 3.38Å; D531-R535 PolarHBondContact O-N 3.46Å; D531-R535 VanDerWaalsContact O-N 3.07Å
532	D	91.1	Very high	96	Very high	47 Å²	47	42.7 Å²	42.7	25%	0.251	20%	0.195	S	C	.	.	H	α-helix	trans	-60.5	-26.5	-178.8	-72.5	-35.1	0	0	0	113	L534 R535 C536 S570 V575	D532-L534 PolarHBondContact O-N 2.88Å; D532-R535 PolarHBondContact O-N 2.98Å; D532-R535 VanDerWaalsContact OD1-CD 3.31Å; D532-R535 WeakPolarHBondContact OD1-CD 3.39Å; D532-R535 IonicContact OD1-CZ 3.99Å; D532-R535 IonicContact OD1-NE 3.53Å; D532-R535 IonicContact OD1-NH1 2.6Å; D532-R535 PolarHBondContact OD1-NH1 3.07Å; D532-C536 PolarHBondContact O-N 3.08Å; D532-S570 VanDerWaalsContact CG-OG 3.22Å; D532-S570 PolarHBondContact OD1-OG 3.27Å; D532-S570 PolarHBondContact OD2-OG 2.85Å; D532-S570 VanDerWaalsContact OD2-OG 3.12Å; D532-V575 HydrophobicContact CB-CG2 3.98Å
533	R	90.8	Very high	96	Very high	150 Å²	150	42 Å²	42	57%	0.566	19%	0.192	S	C	*	.	H	α-helix	trans	-64.1	-30.6	176.6	-59.4	175.1	-69.7	173.2	-1.8	112.4	D531 P537	D531-R533 PolarHBondContact O-N 3.32Å; D531-R533 WeakPolarHBondContact OD1-CB 3.38Å; D531-R533 WeakPolarHBondContact OD1-CG 3.34Å; D531-R533 IonicContact OD1-CZ 3.68Å; D531-R533 PolarHBondContact OD1-N 3.14Å; D531-R533 IonicContact OD1-NE 2.7Å; D531-R533 PolarHBondContact OD1-NE 3.45Å; D531-R533 IonicContact OD1-NH2 3.19Å; D531-R533 IonicContact OD2-CZ 2.87Å; D531-R533 IonicContact OD2-NE 3.98Å; D531-R533 PolarHBondContact OD2-NE 2.93Å; D531-R533 IonicContact OD2-NH2 3.73Å; D531-R533 PolarHBondContact OD2-NH2 3.39Å; R533-P537 WeakPolarHBondContact O-CD 3Å; R533-P537 VanDerWaalsContact O-CG 3.25Å; R533-P537 WeakPolarHBondContact O-CG 3.47Å
534	L	95.9	Very high	95.9	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-90.3	-35.1	174.9	177.5	57.8	0	0	0	111.4	L491 L494 A495 T529 D531 D532 C536 P537 L538	L491-L534 HydrophobicContact CD2-CD2 4.19Å; L494-L534 HydrophobicContact CB-CD1 3.89Å; L494-L534 HydrophobicContact CB-CD2 4.27Å; L494-L534 HydrophobicContact CD1-CD2 4.28Å; A495-L534 HydrophobicContact CB-CD1 4.36Å; T529-L534 HydrophobicContact CG2-CB 4.17Å; T529-L534 HydrophobicContact CG2-CD2 3.84Å; T529-L534 HydrophobicContact CG2-CG 3.95Å; D531-L534 PolarHBondContact O-N 2.91Å; D531-L534 VanDerWaalsContact O-N 3.08Å; D532-L534 PolarHBondContact O-N 2.88Å; L534-C536 PolarHBondContact O-N 3.2Å; L534-P537 VanDerWaalsContact O-CD 3.27Å; L534-P537 WeakPolarHBondContact O-CD 3.3Å; L534-P537 WeakPolarHBondContact O-CG 3.4Å; L534-L538 HydrophobicContact CD1-CB 4.34Å; L534-L538 HydrophobicContact CG-CB 4.47Å; L534-L538 WeakPolarHBondContact O-CB 3.48Å; L534-L538 PolarHBondContact O-N 3.32Å
535	R	96.9	Very high	95.9	Very high	39 Å²	39	45.1 Å²	45.1	15%	0.147	21%	0.205	C	C	.	.	H	α-helix	trans	-56.1	-47.9	-175.6	-71.9	-179.8	176.7	156.2	-9.1	112.8	T529 K530 D531 D532 L538 T539 Y567 V575	T529-R535 HydrophobicContact CG2-CG 3.91Å; T529-R535 PolarHBondContact O-NE 3.02Å; T529-R535 PolarHBondContact O-NH2 3.42Å; K530-R535 PolarHBondContact O-NH1 2.87Å; K530-R535 PolarHBondContact O-NH2 3.28Å; D531-R535 WeakPolarHBondContact O-CG 3.38Å; D531-R535 PolarHBondContact O-N 3.46Å; D531-R535 VanDerWaalsContact O-N 3.07Å; D532-R535 PolarHBondContact O-N 2.98Å; D532-R535 VanDerWaalsContact OD1-CD 3.31Å; D532-R535 WeakPolarHBondContact OD1-CD 3.39Å; D532-R535 IonicContact OD1-CZ 3.99Å; D532-R535 IonicContact OD1-NE 3.53Å; D532-R535 IonicContact OD1-NH1 2.6Å; D532-R535 PolarHBondContact OD1-NH1 3.07Å; R535-L538 PolarHBondContact O-N 3.41Å; R535-T539 WeakPolarHBondContact O-CG2 3.46Å; R535-T539 PolarHBondContact O-N 3.06Å; R535-T539 PolarHBondContact O-OG1 2.94Å; R535-Y567 HydrophobicContact CB-CD2 3.94Å; R535-Y567 HydrophobicContact CB-CE2 3.89Å; R535-Y567 HydrophobicContact CB-CG 4.49Å; R535-Y567 HydrophobicContact CG-CD1 4.14Å; R535-Y567 HydrophobicContact CG-CD2 3.86Å; R535-Y567 HydrophobicContact CG-CE1 3.91Å; R535-Y567 HydrophobicContact CG-CE2 3.6Å; R535-Y567 HydrophobicContact CG-CG 4.11Å; R535-V575 HydrophobicContact CB-CG1 4.06Å; R535-V575 HydrophobicContact CB-CG2 4.21Å
536	C	94.8	Very high	95.9	Very high	29 Å²	29	38.7 Å²	38.7	20%	0.196	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-55.8	-178.5	-174.3	0	0	0	0	113.4	D532 L534 L538 T539 D540 V575	D532-C536 PolarHBondContact O-N 3.08Å; L534-C536 PolarHBondContact O-N 3.2Å; C536-L538 VanDerWaalsContact C-N 3.27Å; C536-L538 PolarHBondContact O-N 2.93Å; C536-T539 PolarHBondContact O-N 2.72Å; C536-T539 PolarHBondContact O-OG1 2.91Å; C536-T539 VanDerWaalsContact O-OG1 3.06Å; C536-D540 PolarHBondContact O-N 3.47Å; C536-V575 HydrophobicContact CB-CG2 4.24Å
537	P	97.1	Very high	95.8	Very high	13 Å²	13	40.9 Å²	40.9	8%	0.084	20%	0.195	C	C	.	.	H	α-helix	trans	-65.9	-30.8	178.2	24.6	-33.8	0	0	0	112.5	A495 C498 A499 R533 L534 A541	A495-P537 HydrophobicContact CB-CG 4.03Å; A495-P537 WeakPolarHBondContact O-CB 3.37Å; A495-P537 WeakPolarHBondContact O-CG 3.44Å; C498-P537 HydrophobicContact CB-CB 3.96Å; A499-P537 HydrophobicContact CB-CB 3.98Å; R533-P537 WeakPolarHBondContact O-CD 3Å; R533-P537 VanDerWaalsContact O-CG 3.25Å; R533-P537 WeakPolarHBondContact O-CG 3.47Å; L534-P537 VanDerWaalsContact O-CD 3.27Å; L534-P537 WeakPolarHBondContact O-CD 3.3Å; L534-P537 WeakPolarHBondContact O-CG 3.4Å; P537-A541 WeakPolarHBondContact O-CB 3.04Å; P537-A541 PolarHBondContact O-N 3.01Å
538	L	98.1	Very high	95.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-48.8	174.9	174.9	59.5	0	0	0	111.8	L523 L526 T527 T529 L534 R535 C536 D540 A541 V542	L523-L538 HydrophobicContact CB-CD1 4.15Å; L523-L538 HydrophobicContact CD2-CD1 3.71Å; L523-L538 HydrophobicContact CG-CD1 4.49Å; L526-L538 HydrophobicContact CB-CD1 4.05Å; L526-L538 HydrophobicContact CB-CD2 3.86Å; L526-L538 WeakPolarHBondContact O-CD2 3.26Å; T527-L538 HydrophobicContact CG2-CD2 4.27Å; T529-L538 HydrophobicContact CG2-CD2 4.37Å; L534-L538 HydrophobicContact CD1-CB 4.34Å; L534-L538 HydrophobicContact CG-CB 4.47Å; L534-L538 WeakPolarHBondContact O-CB 3.48Å; L534-L538 PolarHBondContact O-N 3.32Å; R535-L538 PolarHBondContact O-N 3.41Å; C536-L538 VanDerWaalsContact C-N 3.27Å; C536-L538 PolarHBondContact O-N 2.93Å; L538-D540 VanDerWaalsContact C-N 3.34Å; L538-A541 WeakPolarHBondContact O-CB 3.23Å; L538-A541 PolarHBondContact O-N 3.06Å; L538-V542 HydrophobicContact CD1-CG2 4.32Å; L538-V542 WeakPolarHBondContact O-CG2 3.49Å; L538-V542 PolarHBondContact O-N 3.17Å
539	T	97.8	Very high	95.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.8	-34.1	179.3	47.5	0	0	0	0	111.8	R535 C536 V542 A543 I564 Y567 S578 A582	R535-T539 WeakPolarHBondContact O-CG2 3.46Å; R535-T539 PolarHBondContact O-N 3.06Å; R535-T539 PolarHBondContact O-OG1 2.94Å; C536-T539 PolarHBondContact O-N 2.72Å; C536-T539 PolarHBondContact O-OG1 2.91Å; C536-T539 VanDerWaalsContact O-OG1 3.06Å; T539-V542 PolarHBondContact O-N 3.31Å; T539-A543 VanDerWaalsContact O-CB 3.3Å; T539-A543 WeakPolarHBondContact O-CB 3.44Å; T539-A543 PolarHBondContact O-N 3.47Å; T539-I564 HydrophobicContact CG2-CG2 4.22Å; T539-Y567 HydrophobicContact CG2-CD2 3.66Å; T539-Y567 HydrophobicContact CG2-CE2 3.94Å; T539-S578 WeakPolarHBondContact OG1-CB 3.39Å; T539-S578 PolarHBondContact OG1-OG 2.63Å; T539-A582 HydrophobicContact CG2-CB 4.48Å; T539-A582 WeakPolarHBondContact O-CB 3.36Å
540	D	97.2	Very high	95	Very high	48 Å²	48	43 Å²	43	26%	0.257	22%	0.216	S	C	.	.	H	α-helix	trans	-64.2	-38.8	171.1	-75.3	-29	0	0	0	112	S502 C536 L538 A543 K544 S578	S502-D540 VanDerWaalsContact OG-C 3.27Å; S502-D540 PolarHBondContact OG-O 2.61Å; S502-D540 VanDerWaalsContact OG-O 3.05Å; C536-D540 PolarHBondContact O-N 3.47Å; L538-D540 VanDerWaalsContact C-N 3.34Å; D540-A543 PolarHBondContact O-N 3.38Å; D540-K544 WeakPolarHBondContact O-CG 3.33Å; D540-K544 PolarHBondContact O-N 3.18Å; D540-K544 VanDerWaalsContact O-N 3.13Å; D540-S578 WeakPolarHBondContact OD1-CB 3.32Å
541	A	98.2	Very high	95.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.8	-47	173.3	0	0	0	0	0	111.7	C498 V501 L523 P537 L538 A543 K544 C545	C498-A541 HydrophobicContact CB-CB 4.4Å; C498-A541 WeakPolarHBondContact O-CB 3.35Å; V501-A541 HydrophobicContact CG1-CB 4.27Å; L523-A541 HydrophobicContact CD1-CB 4.06Å; L523-A541 HydrophobicContact CD2-CB 4.23Å; P537-A541 WeakPolarHBondContact O-CB 3.04Å; P537-A541 PolarHBondContact O-N 3.01Å; L538-A541 WeakPolarHBondContact O-CB 3.23Å; L538-A541 PolarHBondContact O-N 3.06Å; A541-A543 VanDerWaalsContact C-N 3.34Å; A541-A543 PolarHBondContact O-N 3.34Å; A541-K544 PolarHBondContact O-N 3.45Å; A541-C545 WeakPolarHBondContact O-CB 3.41Å; A541-C545 PolarHBondContact O-N 2.69Å; A541-C545 PolarHBondContact O-SG 3.28Å
542	V	98.2	Very high	95.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.6	-43.9	176.6	173.2	0	0	0	0	110.9	L523 L538 T539 K544 C545 C546 F555 I564 A582 L586	L523-V542 HydrophobicContact CB-CG2 4.32Å; L523-V542 HydrophobicContact CD1-CG2 4.43Å; L538-V542 HydrophobicContact CD1-CG2 4.32Å; L538-V542 WeakPolarHBondContact O-CG2 3.49Å; L538-V542 PolarHBondContact O-N 3.17Å; T539-V542 PolarHBondContact O-N 3.31Å; V542-K544 VanDerWaalsContact C-N 3.34Å; V542-K544 PolarHBondContact O-N 3.48Å; V542-C545 PolarHBondContact O-N 3.02Å; V542-C546 WeakPolarHBondContact O-CB 3.41Å; V542-C546 PolarHBondContact O-N 3.16Å; V542-C546 PolarHBondContact O-SG 2.97Å; V542-F555 HydrophobicContact CB-CE1 4.5Å; V542-F555 HydrophobicContact CB-CZ 4.36Å; V542-F555 HydrophobicContact CG1-CD1 4.29Å; V542-F555 HydrophobicContact CG1-CD2 4.36Å; V542-F555 HydrophobicContact CG1-CE1 4.16Å; V542-F555 HydrophobicContact CG1-CE2 4.24Å; V542-F555 HydrophobicContact CG1-CG 4.41Å; V542-F555 HydrophobicContact CG1-CZ 4.15Å; V542-F555 HydrophobicContact CG2-CE1 3.83Å; V542-F555 HydrophobicContact CG2-CZ 4.03Å; V542-I564 HydrophobicContact CG1-CD1 3.97Å; V542-I564 HydrophobicContact CG2-CD1 4.44Å; V542-A582 HydrophobicContact CG1-CB 4.43Å; V542-L586 HydrophobicContact CG1-CD1 4.16Å; V542-L586 HydrophobicContact CG1-CG 4.48Å
543	A	97.6	Very high	95.5	Very high	10 Å²	10	35.2 Å²	35.2	8%	0.083	18%	0.179	C	C	.	.	H	α-helix	trans	-58.1	-46.5	178.9	0	0	0	0	0	111.7	T539 D540 A541 K581 A582 Q585	T539-A543 VanDerWaalsContact O-CB 3.3Å; T539-A543 WeakPolarHBondContact O-CB 3.44Å; T539-A543 PolarHBondContact O-N 3.47Å; D540-A543 PolarHBondContact O-N 3.38Å; A541-A543 VanDerWaalsContact C-N 3.34Å; A541-A543 PolarHBondContact O-N 3.34Å; A543-K581 HydrophobicContact CB-CB 4.3Å; A543-A582 HydrophobicContact CB-CB 4.1Å; A543-Q585 WeakPolarHBondContact O-CG 3.46Å
544	K	97.4	Very high	95.8	Very high	72 Å²	72	30.8 Å²	30.8	31%	0.313	17%	0.167	S	C	.	.	H	α-helix	trans	-69.5	-42.8	178.5	-66.3	-67.9	-167.5	158.4	0	112	S502 A505 E506 D540 A541 V542 C546 T547	S502-K544 WeakPolarHBondContact O-CG 3.46Å; S502-K544 WeakPolarHBondContact OG-CG 3.23Å; A505-K544 HydrophobicContact CB-CB 3.79Å; E506-K544 HydrophobicContact CG-CD 4.1Å; E506-K544 VanDerWaalsContact OE1-CE 3.23Å; E506-K544 WeakPolarHBondContact OE1-CE 3.28Å; E506-K544 IonicContact OE1-NZ 2.71Å; E506-K544 PolarHBondContact OE1-NZ 2.91Å; D540-K544 WeakPolarHBondContact O-CG 3.33Å; D540-K544 PolarHBondContact O-N 3.18Å; D540-K544 VanDerWaalsContact O-N 3.13Å; A541-K544 PolarHBondContact O-N 3.45Å; V542-K544 VanDerWaalsContact C-N 3.34Å; V542-K544 PolarHBondContact O-N 3.48Å; K544-C546 VanDerWaalsContact C-N 3.27Å; K544-C546 PolarHBondContact O-N 2.66Å; K544-T547 WeakPolarHBondContact O-CB 3.48Å; K544-T547 WeakPolarHBondContact O-CG2 3.19Å; K544-T547 PolarHBondContact O-N 3.2Å; K544-T547 VanDerWaalsContact O-N 3.16Å; K544-T547 PolarHBondContact O-OG1 3.13Å
545	C	97.6	Very high	95.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-30.1	177.8	-66.2	0	0	0	0	113.3	L511 A541 V542 T547 W548 N551 F555	L511-C545 HydrophobicContact CD1-CB 4.2Å; A541-C545 WeakPolarHBondContact O-CB 3.41Å; A541-C545 PolarHBondContact O-N 2.69Å; A541-C545 PolarHBondContact O-SG 3.28Å; V542-C545 PolarHBondContact O-N 3.02Å; C545-T547 PolarHBondContact O-N 3.11Å; C545-W548 PolarHBondContact O-N 3.42Å; C545-N551 VanDerWaalsContact O-CB 3.24Å; C545-N551 WeakPolarHBondContact O-CB 3.34Å; C545-N551 PolarHBondContact O-ND2 3.16Å; C545-F555 HydrophobicContact CB-CE2 3.82Å; C545-F555 HydrophobicContact CB-CZ 4.12Å
546	C	96.8	Very high	95.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.6	178.1	-73.3	0	0	0	0	114.4	V542 K544 W548 R552 F555 Q585 L586	V542-C546 WeakPolarHBondContact O-CB 3.41Å; V542-C546 PolarHBondContact O-N 3.16Å; V542-C546 PolarHBondContact O-SG 2.97Å; K544-C546 VanDerWaalsContact C-N 3.27Å; K544-C546 PolarHBondContact O-N 2.66Å; C546-W548 PolarHBondContact O-N 3.04Å; C546-R552 HydrophobicContact CB-CB 4.38Å; C546-R552 PolarHBondContact O-NE 3.42Å; C546-R552 VanDerWaalsContact O-NE 3.16Å; C546-R552 PolarHBondContact O-NH2 3.34Å; C546-F555 WeakPolarHBondContact SG-CD2 3.47Å; C546-Q585 HydrophobicContact CB-CB 3.65Å; C546-L586 WeakPolarHBondContact SG-CD2 3.3Å
547	T	93.6	Very high	95.9	Very high	67 Å²	67	37.8 Å²	37.8	41%	0.411	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-32.4	173.1	59.9	0	0	0	0	110.8	L511 K544 C545 R552	L511-T547 WeakPolarHBondContact CD2-OG1 3.28Å; K544-T547 WeakPolarHBondContact O-CB 3.48Å; K544-T547 WeakPolarHBondContact O-CG2 3.19Å; K544-T547 PolarHBondContact O-N 3.2Å; K544-T547 VanDerWaalsContact O-N 3.16Å; K544-T547 PolarHBondContact O-OG1 3.13Å; C545-T547 PolarHBondContact O-N 3.11Å; T547-R552 PolarHBondContact O-NH2 2.83Å
548	W	92	Very high	95.8	Very high	91 Å²	91	39.6 Å²	39.6	35%	0.345	21%	0.211	S	C	.	.	S	Bend	trans	-68.6	128.3	167.3	-151.4	-111.6	0	0	0	111.5	E508 L511 A512 C545 C546 T550 N551	E508-W548 HydrophobicContact CB-CZ3 4.38Å; L511-W548 HydrophobicContact CD2-CB 3.78Å; L511-W548 HydrophobicContact CD2-CE3 4.23Å; L511-W548 HydrophobicContact CG-CB 4.02Å; L511-W548 HydrophobicContact CG-CE3 4.27Å; L511-W548 HydrophobicContact CG-CG 4.47Å; A512-W548 HydrophobicContact CB-CH2 3.76Å; A512-W548 HydrophobicContact CB-CZ2 3.84Å; A512-W548 HydrophobicContact CB-CZ3 4.3Å; C545-W548 PolarHBondContact O-N 3.42Å; C546-W548 PolarHBondContact O-N 3.04Å; W548-T550 PolarHBondContact O-N 3.31Å; W548-N551 HydrophobicContact CB-CB 4.18Å; W548-N551 PolarHBondContact O-N 3.37Å
549	G	84.3	Confident	95.6	Very high	41 Å²	41	41.7 Å²	41.7	42%	0.423	23%	0.232	S	C	.	.	H	α-helix	trans	-63.8	-35	-169.4	0	0	0	0	0	114.9	R552	G549-R552 VanDerWaalsContact O-CG 3.24Å; G549-R552 WeakPolarHBondContact O-CG 3.15Å
550	T	94.1	Very high	95.6	Very high	72 Å²	72	41.7 Å²	41.7	44%	0.442	23%	0.232	S	C	.	.	H	α-helix	trans	-75.3	-37.5	178	51.6	0	0	0	0	111.7	W548 R552 I553 D554	W548-T550 PolarHBondContact O-N 3.31Å; T550-R552 VanDerWaalsContact C-N 3.33Å; T550-R552 PolarHBondContact O-N 3.1Å; T550-I553 WeakPolarHBondContact O-CB 3.48Å; T550-I553 PolarHBondContact O-N 2.84Å; T550-D554 PolarHBondContact O-N 3.41Å
551	N	96.6	Very high	95.6	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-58.2	-40.3	-176.4	-72.4	-4.2	0	0	0	113.3	T515 V520 C545 W548 I553 D554 F555	T515-N551 WeakPolarHBondContact CG2-OD1 3.45Å; T515-N551 PolarHBondContact OG1-ND2 2.86Å; V520-N551 HydrophobicContact CG2-CB 3.88Å; C545-N551 VanDerWaalsContact O-CB 3.24Å; C545-N551 WeakPolarHBondContact O-CB 3.34Å; C545-N551 PolarHBondContact O-ND2 3.16Å; W548-N551 HydrophobicContact CB-CB 4.18Å; W548-N551 PolarHBondContact O-N 3.37Å; N551-I553 VanDerWaalsContact C-N 3.27Å; N551-I553 PolarHBondContact O-N 3.12Å; N551-D554 PolarHBondContact O-N 3.39Å; N551-F555 HydrophobicContact CB-CD2 4.35Å; N551-F555 HydrophobicContact CB-CE2 4.32Å; N551-F555 WeakPolarHBondContact O-CB 3.45Å; N551-F555 WeakPolarHBondContact O-CD2 3.24Å; N551-F555 PolarHBondContact O-N 3.29Å
552	R	94.9	Very high	95.4	Very high	43 Å²	43	42.2 Å²	42.2	16%	0.162	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-36.2	177.6	65.7	-169.2	63.9	161.6	5.3	112.2	C546 T547 G549 T550 G556 D589 N592	C546-R552 HydrophobicContact CB-CB 4.38Å; C546-R552 PolarHBondContact O-NE 3.42Å; C546-R552 VanDerWaalsContact O-NE 3.16Å; C546-R552 PolarHBondContact O-NH2 3.34Å; T547-R552 PolarHBondContact O-NH2 2.83Å; G549-R552 VanDerWaalsContact O-CG 3.24Å; G549-R552 WeakPolarHBondContact O-CG 3.15Å; T550-R552 VanDerWaalsContact C-N 3.33Å; T550-R552 PolarHBondContact O-N 3.1Å; R552-G556 PolarHBondContact O-N 2.95Å; R552-D589 HydrophobicContact CG-CB 4.13Å; R552-N592 PolarHBondContact O-ND2 2.92Å
553	I	96.5	Very high	95.4	Very high	59 Å²	59	42.6 Å²	42.6	30%	0.303	24%	0.237	S	C	.	.	H	α-helix	trans	-69.6	-44.6	176.6	-58.9	171.2	0	0	0	108.8	T550 N551 G556 R557	T550-I553 WeakPolarHBondContact O-CB 3.48Å; T550-I553 PolarHBondContact O-N 2.84Å; N551-I553 VanDerWaalsContact C-N 3.27Å; N551-I553 PolarHBondContact O-N 3.12Å; I553-G556 WeakPolarHBondContact O-CA 3.45Å; I553-G556 PolarHBondContact O-N 2.84Å; I553-G556 VanDerWaalsContact O-N 3.11Å; I553-R557 HydrophobicContact CG2-CG 4.45Å; I553-R557 WeakPolarHBondContact O-CG 3.4Å; I553-R557 PolarHBondContact O-N 2.72Å
554	D	97	Very high	95.3	Very high	58 Å²	58	42.2 Å²	42.2	31%	0.31	23%	0.233	S	C	.	.	H	α-helix	trans	-69.6	-36.6	-176.8	-65.5	-28.4	0	0	0	112.8	V520 T550 N551 G556 R557 A558	V520-D554 HydrophobicContact CG1-CB 3.78Å; T550-D554 PolarHBondContact O-N 3.41Å; N551-D554 PolarHBondContact O-N 3.39Å; D554-G556 VanDerWaalsContact C-N 3.28Å; D554-G556 PolarHBondContact O-N 2.99Å; D554-R557 PolarHBondContact O-N 3.2Å; D554-R557 IonicContact OD1-NH1 3.23Å; D554-A558 VanDerWaalsContact O-CB 3.23Å; D554-A558 WeakPolarHBondContact O-CB 3.31Å; D554-A558 PolarHBondContact O-N 2.81Å
555	F	97.6	Very high	95.3	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-39.4	168.6	-84.3	-63.9	0	0	0	111.9	V520 L523 S524 V542 C545 C546 N551 G559 A560 L586	V520-F555 HydrophobicContact CB-CE1 4.44Å; V520-F555 HydrophobicContact CB-CE2 4.44Å; V520-F555 HydrophobicContact CB-CZ 4.28Å; V520-F555 HydrophobicContact CG1-CB 4.47Å; V520-F555 HydrophobicContact CG1-CD1 3.85Å; V520-F555 HydrophobicContact CG1-CD2 4.07Å; V520-F555 HydrophobicContact CG1-CE1 4.01Å; V520-F555 HydrophobicContact CG1-CE2 4.23Å; V520-F555 HydrophobicContact CG1-CG 3.86Å; V520-F555 HydrophobicContact CG1-CZ 4.19Å; V520-F555 HydrophobicContact CG2-CD2 4.22Å; V520-F555 HydrophobicContact CG2-CE2 3.76Å; V520-F555 HydrophobicContact CG2-CZ 3.95Å; L523-F555 HydrophobicContact CB-CE1 3.89Å; L523-F555 HydrophobicContact CB-CZ 4.23Å; L523-F555 HydrophobicContact CD1-CZ 4.03Å; S524-F555 VanDerWaalsContact OG-CD1 3.28Å; S524-F555 WeakPolarHBondContact OG-CD1 3.43Å; V542-F555 HydrophobicContact CB-CE1 4.5Å; V542-F555 HydrophobicContact CB-CZ 4.36Å; V542-F555 HydrophobicContact CG1-CD1 4.29Å; V542-F555 HydrophobicContact CG1-CD2 4.36Å; V542-F555 HydrophobicContact CG1-CE1 4.16Å; V542-F555 HydrophobicContact CG1-CE2 4.24Å; V542-F555 HydrophobicContact CG1-CG 4.41Å; V542-F555 HydrophobicContact CG1-CZ 4.15Å; V542-F555 HydrophobicContact CG2-CE1 3.83Å; V542-F555 HydrophobicContact CG2-CZ 4.03Å; C545-F555 HydrophobicContact CB-CE2 3.82Å; C545-F555 HydrophobicContact CB-CZ 4.12Å; C546-F555 WeakPolarHBondContact SG-CD2 3.47Å; N551-F555 HydrophobicContact CB-CD2 4.35Å; N551-F555 HydrophobicContact CB-CE2 4.32Å; N551-F555 WeakPolarHBondContact O-CB 3.45Å; N551-F555 WeakPolarHBondContact O-CD2 3.24Å; N551-F555 PolarHBondContact O-N 3.29Å; F555-G559 PolarHBondContact O-N 3.46Å; F555-A560 HydrophobicContact CB-CB 4.43Å; F555-A560 HydrophobicContact CD1-CB 4.03Å; F555-A560 WeakPolarHBondContact O-CB 3.1Å; F555-A560 PolarHBondContact O-N 3.35Å; F555-A560 VanDerWaalsContact O-N 3.11Å; F555-L586 HydrophobicContact CB-CD2 3.66Å; F555-L586 HydrophobicContact CG-CD2 4.31Å
556	G	95.3	Very high	95.2	Very high	19 Å²	19	46.3 Å²	46.3	20%	0.196	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-53.6	173	0	0	0	0	0	112.3	R552 I553 D554 A558 G559 N592	R552-G556 PolarHBondContact O-N 2.95Å; I553-G556 WeakPolarHBondContact O-CA 3.45Å; I553-G556 PolarHBondContact O-N 2.84Å; I553-G556 VanDerWaalsContact O-N 3.11Å; D554-G556 VanDerWaalsContact C-N 3.28Å; D554-G556 PolarHBondContact O-N 2.99Å; G556-A558 VanDerWaalsContact C-N 3.28Å; G556-A558 PolarHBondContact O-N 3.02Å; G556-G559 PolarHBondContact O-N 3.23Å; G556-N592 WeakPolarHBondContact CA-OD1 3.32Å
557	R	95.7	Very high	95.2	Very high	200 Å²	200	46.6 Å²	46.6	76%	0.755	25%	0.248	S	C	*	.	H	α-helix	trans	-61.3	-34.1	178.1	-71	174.2	173.4	172.2	-4.3	112.9	I553 D554 G559	I553-R557 HydrophobicContact CG2-CG 4.45Å; I553-R557 WeakPolarHBondContact O-CG 3.4Å; I553-R557 PolarHBondContact O-N 2.72Å; D554-R557 PolarHBondContact O-N 3.2Å; D554-R557 IonicContact OD1-NH1 3.23Å; R557-G559 PolarHBondContact O-N 3.5Å
558	A	95.4	Very high	95.2	Very high	51 Å²	51	43.6 Å²	43.6	42%	0.421	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-1.4	176	0	0	0	0	0	113.7	S524 D554 G556 A560	S524-A558 WeakPolarHBondContact OG-CB 3.3Å; D554-A558 VanDerWaalsContact O-CB 3.23Å; D554-A558 WeakPolarHBondContact O-CB 3.31Å; D554-A558 PolarHBondContact O-N 2.81Å; G556-A558 VanDerWaalsContact C-N 3.28Å; G556-A558 PolarHBondContact O-N 3.02Å; A558-A560 VanDerWaalsContact C-N 3.32Å; A558-A560 PolarHBondContact O-N 3.14Å
559	G	94.8	Very high	95.2	Very high	43 Å²	43	45.8 Å²	45.8	44%	0.443	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	16.7	176.2	0	0	0	0	0	114.6	F555 G556 R557 V561 P563	F555-G559 PolarHBondContact O-N 3.46Å; G556-G559 PolarHBondContact O-N 3.23Å; R557-G559 PolarHBondContact O-N 3.5Å; G559-V561 VanDerWaalsContact C-N 3.32Å; G559-V561 PolarHBondContact O-N 3.48Å; G559-P563 WeakPolarHBondContact O-CD 3.24Å
560	A	96.5	Very high	95.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.226	C	C	.	.			trans	-69.4	-26.9	-176.3	0	0	0	0	0	113.5	T527 F555 A558 I562 P563 I564	T527-A560 HydrophobicContact CG2-CB 4.05Å; F555-A560 HydrophobicContact CB-CB 4.43Å; F555-A560 HydrophobicContact CD1-CB 4.03Å; F555-A560 WeakPolarHBondContact O-CB 3.1Å; F555-A560 PolarHBondContact O-N 3.35Å; F555-A560 VanDerWaalsContact O-N 3.11Å; A558-A560 VanDerWaalsContact C-N 3.32Å; A558-A560 PolarHBondContact O-N 3.14Å; A560-I562 PolarHBondContact O-N 3.28Å; A560-P563 WeakPolarHBondContact O-CD 3.46Å; A560-I564 HydrophobicContact CB-CD1 4.24Å; A560-I564 WeakPolarHBondContact O-CD1 3.36Å; A560-I564 WeakPolarHBondContact O-CG1 3.38Å; A560-I564 PolarHBondContact O-N 3.44Å; A560-I564 VanDerWaalsContact O-N 3.14Å
561	V	96.7	Very high	95.6	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-61.4	-50	-171.3	178	0	0	0	0	112.6	G559 I564 V565 L586 N592 M596	G559-V561 VanDerWaalsContact C-N 3.32Å; G559-V561 PolarHBondContact O-N 3.48Å; V561-I564 PolarHBondContact O-N 3.11Å; V561-V565 WeakPolarHBondContact O-CG2 3.28Å; V561-V565 PolarHBondContact O-N 3.01Å; V561-L586 HydrophobicContact CG2-CD1 4.46Å; V561-L586 HydrophobicContact CG2-CD2 4.44Å; V561-N592 HydrophobicContact CG2-CB 4.22Å; V561-M596 HydrophobicContact CG1-CB 4.45Å; V561-M596 HydrophobicContact CG1-CE 3.88Å; V561-M596 HydrophobicContact CG1-CG 3.35Å
562	I	95.6	Very high	95.5	Very high	56 Å²	56	48.6 Å²	48.6	29%	0.287	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-47.7	-176.3	-67.9	169.9	0	0	0	111.9	A560 I564 V565 R566 V599	A560-I562 PolarHBondContact O-N 3.28Å; I562-I564 VanDerWaalsContact C-N 3.33Å; I562-I564 PolarHBondContact O-N 3.36Å; I562-V565 PolarHBondContact O-N 3.43Å; I562-R566 WeakPolarHBondContact O-CG 3.42Å; I562-R566 PolarHBondContact O-N 3.11Å; I562-V599 HydrophobicContact CD1-CG1 4.4Å; I562-V599 HydrophobicContact CG1-CG1 4.06Å; I562-V599 HydrophobicContact CG2-CG1 4.07Å
563	P	96.4	Very high	95.4	Very high	9 Å²	9	50.2 Å²	50.2	6%	0.058	27%	0.271	C	S	.	.	H	α-helix	trans	-55.1	-44	171.9	-27	34.3	0	0	0	113.5	T527 G559 A560 V565 R566 Y567	T527-P563 VanDerWaalsContact O-CB 3.3Å; T527-P563 WeakPolarHBondContact O-CB 3.18Å; G559-P563 WeakPolarHBondContact O-CD 3.24Å; A560-P563 WeakPolarHBondContact O-CD 3.46Å; P563-V565 PolarHBondContact O-N 3.11Å; P563-R566 WeakPolarHBondContact O-CB 3.35Å; P563-R566 PolarHBondContact O-N 2.89Å; P563-R566 VanDerWaalsContact O-N 3.11Å; P563-Y567 WeakPolarHBondContact O-CD1 3.21Å
564	I	97	Very high	95.3	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-62.1	-43.4	178	-68	168.1	0	0	0	111.1	T527 T539 V542 A560 V561 I562 R566 Y567 T579 A582 L583 L586	T527-I564 HydrophobicContact CG2-CD1 4.06Å; T527-I564 HydrophobicContact CG2-CG1 3.91Å; T539-I564 HydrophobicContact CG2-CG2 4.22Å; V542-I564 HydrophobicContact CG1-CD1 3.97Å; V542-I564 HydrophobicContact CG2-CD1 4.44Å; A560-I564 HydrophobicContact CB-CD1 4.24Å; A560-I564 WeakPolarHBondContact O-CD1 3.36Å; A560-I564 WeakPolarHBondContact O-CG1 3.38Å; A560-I564 PolarHBondContact O-N 3.44Å; A560-I564 VanDerWaalsContact O-N 3.14Å; V561-I564 PolarHBondContact O-N 3.11Å; I562-I564 VanDerWaalsContact C-N 3.33Å; I562-I564 PolarHBondContact O-N 3.36Å; I564-R566 PolarHBondContact O-N 2.84Å; I564-Y567 VanDerWaalsContact O-CB 3.3Å; I564-Y567 WeakPolarHBondContact O-CB 3.44Å; I564-Y567 PolarHBondContact O-N 3.33Å; I564-T579 HydrophobicContact CG2-CG2 3.88Å; I564-T579 VanDerWaalsContact O-CG2 3.28Å; I564-T579 WeakPolarHBondContact O-CG2 3.48Å; I564-A582 HydrophobicContact CG2-CB 4.42Å; I564-L583 HydrophobicContact CB-CD2 4.44Å; I564-L583 HydrophobicContact CG2-CD2 3.75Å; I564-L583 HydrophobicContact CG2-CG 4.03Å; I564-L586 HydrophobicContact CD1-CD1 3.89Å
565	V	96.5	Very high	95.2	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.024	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-35	175.9	172.8	0	0	0	0	111.7	V561 I562 P563 Y567 L568 L583 M596 V599 V601	V561-V565 WeakPolarHBondContact O-CG2 3.28Å; V561-V565 PolarHBondContact O-N 3.01Å; I562-V565 PolarHBondContact O-N 3.43Å; P563-V565 PolarHBondContact O-N 3.11Å; V565-Y567 PolarHBondContact O-N 3.38Å; V565-L568 WeakPolarHBondContact O-CB 3.45Å; V565-L568 PolarHBondContact O-N 3.32Å; V565-L583 HydrophobicContact CG2-CD1 4.23Å; V565-L583 HydrophobicContact CG2-CD2 3.61Å; V565-M596 HydrophobicContact CG2-CB 4.49Å; V565-M596 HydrophobicContact CG2-CG 4.11Å; V565-V599 HydrophobicContact CB-CG2 3.96Å; V565-V599 HydrophobicContact CG1-CG2 3.65Å; V565-V599 HydrophobicContact CG2-CG2 4.05Å; V565-V601 HydrophobicContact CG1-CB 4.06Å; V565-V601 HydrophobicContact CG1-CG2 3.86Å; V565-V601 HydrophobicContact CG2-CB 4.36Å; V565-V601 HydrophobicContact CG2-CG2 3.94Å
566	R	95.2	Very high	95.2	Very high	155 Å²	155	49.6 Å²	49.6	59%	0.585	27%	0.267	S	S	*	.	H	α-helix	trans	-66.7	-20.8	178.4	-65.5	171.5	-180	174.3	0.2	113	I562 P563 I564 L568 K569	I562-R566 WeakPolarHBondContact O-CG 3.42Å; I562-R566 PolarHBondContact O-N 3.11Å; P563-R566 WeakPolarHBondContact O-CB 3.35Å; P563-R566 PolarHBondContact O-N 2.89Å; P563-R566 VanDerWaalsContact O-N 3.11Å; I564-R566 PolarHBondContact O-N 2.84Å; R566-L568 PolarHBondContact O-N 2.64Å; R566-K569 WeakPolarHBondContact O-CB 3.37Å; R566-K569 PolarHBondContact O-N 2.71Å; R566-K569 VanDerWaalsContact O-N 3.16Å
567	Y	96.4	Very high	95.2	Very high	6 Å²	6	52.5 Å²	52.5	2%	0.024	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-21.7	176.5	-64.5	-5.8	0	0	0	113	T527 T529 R535 T539 P563 I564 V565 K569 S570	T527-Y567 VanDerWaalsContact CA-OH 3.26Å; T527-Y567 WeakPolarHBondContact CA-OH 3.39Å; T527-Y567 WeakPolarHBondContact O-CE1 3.37Å; T527-Y567 VanDerWaalsContact O-CZ 3.22Å; T527-Y567 PolarHBondContact O-OH 3.44Å; T529-Y567 VanDerWaalsContact CG2-OH 3.23Å; T529-Y567 WeakPolarHBondContact CG2-OH 3.41Å; R535-Y567 HydrophobicContact CB-CD2 3.94Å; R535-Y567 HydrophobicContact CB-CE2 3.89Å; R535-Y567 HydrophobicContact CB-CG 4.49Å; R535-Y567 HydrophobicContact CG-CD1 4.14Å; R535-Y567 HydrophobicContact CG-CD2 3.86Å; R535-Y567 HydrophobicContact CG-CE1 3.91Å; R535-Y567 HydrophobicContact CG-CE2 3.6Å; R535-Y567 HydrophobicContact CG-CG 4.11Å; T539-Y567 HydrophobicContact CG2-CD2 3.66Å; T539-Y567 HydrophobicContact CG2-CE2 3.94Å; P563-Y567 WeakPolarHBondContact O-CD1 3.21Å; I564-Y567 VanDerWaalsContact O-CB 3.3Å; I564-Y567 WeakPolarHBondContact O-CB 3.44Å; I564-Y567 PolarHBondContact O-N 3.33Å; V565-Y567 PolarHBondContact O-N 3.38Å; Y567-K569 PolarHBondContact O-N 2.68Å; Y567-S570 VanDerWaalsContact O-CB 3.23Å; Y567-S570 WeakPolarHBondContact O-CB 3.3Å; Y567-S570 PolarHBondContact O-N 3.41Å
568	L	94.6	Very high	95.2	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-12.2	171.7	-63	178	0	0	0	113.2	V565 R566 H576 T579 L583 V601 Y604 L605	V565-L568 WeakPolarHBondContact O-CB 3.45Å; V565-L568 PolarHBondContact O-N 3.32Å; R566-L568 PolarHBondContact O-N 2.64Å; L568-H576 PolarHBondContact O-NE2 3.42Å; L568-T579 HydrophobicContact CD2-CG2 3.62Å; L568-T579 HydrophobicContact CG-CG2 3.86Å; L568-L583 HydrophobicContact CD1-CD1 3.72Å; L568-L583 HydrophobicContact CD2-CD1 4.42Å; L568-L583 HydrophobicContact CG-CD1 4.16Å; L568-V601 HydrophobicContact CD1-CG2 4.06Å; L568-Y604 HydrophobicContact CB-CG 4.44Å; L568-L605 HydrophobicContact CD1-CD2 3.83Å; L568-L605 HydrophobicContact CD1-CG 4.25Å; L568-L605 HydrophobicContact CD2-CD2 4.47Å
569	K	92.9	Very high	95.3	Very high	136 Å²	136	40.7 Å²	40.7	59%	0.591	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-5.6	172.8	-58.6	179.5	178.3	-175.7	0	113.7	R566 Y567 Y604	R566-K569 WeakPolarHBondContact O-CB 3.37Å; R566-K569 PolarHBondContact O-N 2.71Å; R566-K569 VanDerWaalsContact O-N 3.16Å; Y567-K569 PolarHBondContact O-N 2.68Å; K569-Y604 WeakPolarHBondContact CE-OH 3.49Å; K569-Y604 HydrophobicContact CG-CE1 4.14Å
570	S	93.3	Very high	95.5	Very high	14 Å²	14	38.6 Å²	38.6	10%	0.098	20%	0.196	C	C	.	.	S	Bend	trans	-60.8	159.5	175.1	-178.7	0	0	0	0	110.5	D532 Y567 D572 H576	D532-S570 VanDerWaalsContact CG-OG 3.22Å; D532-S570 PolarHBondContact OD1-OG 3.27Å; D532-S570 PolarHBondContact OD2-OG 2.85Å; D532-S570 VanDerWaalsContact OD2-OG 3.12Å; Y567-S570 VanDerWaalsContact O-CB 3.23Å; Y567-S570 WeakPolarHBondContact O-CB 3.3Å; Y567-S570 PolarHBondContact O-N 3.41Å; S570-D572 PolarHBondContact OG-N 3.23Å; S570-H576 PolarHBondContact O-CE1 2.86Å; S570-H576 PolarHBondContact O-NE2 2.93Å
571	S	93.1	Very high	95.5	Very high	114 Å²	114	41.9 Å²	41.9	80%	0.797	21%	0.21	S	C	*	.	S	Bend	trans	-88.1	-10.1	171.2	51.8	0	0	0	0	113.2	P573	S571-P573 WeakPolarHBondContact O-CD 3.4Å
572	D	93.4	Very high	95.5	Very high	46 Å²	46	41.7 Å²	41.7	25%	0.246	21%	0.209	C	C	.	.			trans	-86	118	-175.9	-174.3	-11.3	0	0	0	112.1	S570 N574 V575 H576	S570-D572 PolarHBondContact OG-N 3.23Å; D572-N574 VanDerWaalsContact C-N 3.25Å; D572-N574 PolarHBondContact O-N 3.02Å; D572-N574 WeakPolarHBondContact OD1-CB 3.08Å; D572-N574 PolarHBondContact OD1-N 3.38Å; D572-N574 PolarHBondContact OD1-ND2 3.32Å; D572-V575 HydrophobicContact CB-CB 4.1Å; D572-V575 HydrophobicContact CB-CG2 3.8Å; D572-V575 WeakPolarHBondContact O-CB 3.48Å; D572-V575 PolarHBondContact O-N 3.05Å; D572-V575 VanDerWaalsContact O-N 3.13Å; D572-H576 PolarHBondContact O-N 3.43Å; D572-H576 VanDerWaalsContact O-N 3.11Å
573	P	93.2	Very high	95.6	Very high	77 Å²	77	39 Å²	39	50%	0.5	20%	0.195	S	C	.	.	H	α-helix	trans	-59.1	-30.9	176.4	-23.9	34.8	0	0	0	114.3	S571 V575 H576 R577	S571-P573 WeakPolarHBondContact O-CD 3.4Å; P573-V575 VanDerWaalsContact C-N 3.35Å; P573-H576 WeakPolarHBondContact O-CB 3.41Å; P573-H576 PolarHBondContact O-N 3.34Å; P573-R577 PolarHBondContact O-N 2.98Å
574	N	93.7	Very high	95.7	Very high	78 Å²	78	41 Å²	41	42%	0.417	20%	0.203	S	C	.	.	H	α-helix	trans	-69.7	-36.9	177.8	-60.2	-60.4	0	0	0	111.1	D572 H576 R577 S578	D572-N574 VanDerWaalsContact C-N 3.25Å; D572-N574 PolarHBondContact O-N 3.02Å; D572-N574 WeakPolarHBondContact OD1-CB 3.08Å; D572-N574 PolarHBondContact OD1-N 3.38Å; D572-N574 PolarHBondContact OD1-ND2 3.32Å; N574-H576 VanDerWaalsContact C-N 3.31Å; N574-R577 PolarHBondContact O-N 3.16Å; N574-S578 WeakPolarHBondContact O-CB 3.43Å; N574-S578 PolarHBondContact O-N 3.44Å; N574-S578 PolarHBondContact O-OG 3.36Å
575	V	96	Very high	95.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-39.9	172	176.1	0	0	0	0	109.8	D532 R535 C536 D572 P573 S578 T579	D532-V575 HydrophobicContact CB-CG2 3.98Å; R535-V575 HydrophobicContact CB-CG1 4.06Å; R535-V575 HydrophobicContact CB-CG2 4.21Å; C536-V575 HydrophobicContact CB-CG2 4.24Å; D572-V575 HydrophobicContact CB-CB 4.1Å; D572-V575 HydrophobicContact CB-CG2 3.8Å; D572-V575 WeakPolarHBondContact O-CB 3.48Å; D572-V575 PolarHBondContact O-N 3.05Å; D572-V575 VanDerWaalsContact O-N 3.13Å; P573-V575 VanDerWaalsContact C-N 3.35Å; V575-S578 WeakPolarHBondContact CA-OG 3.07Å; V575-S578 PolarHBondContact O-OG 3.22Å; V575-S578 VanDerWaalsContact O-OG 3.11Å; V575-T579 WeakPolarHBondContact O-CB 3.16Å; V575-T579 PolarHBondContact O-N 3.42Å; V575-T579 PolarHBondContact O-OG1 2.88Å
576	H	96.2	Very high	95.7	Very high	26 Å²	26	42.3 Å²	42.3	12%	0.12	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-50.4	174.6	-62.2	164.8	0	0	0	112	L568 S570 D572 P573 N574 T579 A580 M608 L616	L568-H576 PolarHBondContact O-NE2 3.42Å; S570-H576 PolarHBondContact O-CE1 2.86Å; S570-H576 PolarHBondContact O-NE2 2.93Å; D572-H576 PolarHBondContact O-N 3.43Å; D572-H576 VanDerWaalsContact O-N 3.11Å; P573-H576 WeakPolarHBondContact O-CB 3.41Å; P573-H576 PolarHBondContact O-N 3.34Å; N574-H576 VanDerWaalsContact C-N 3.31Å; H576-T579 PolarHBondContact O-N 2.9Å; H576-A580 VanDerWaalsContact O-CB 3.32Å; H576-A580 WeakPolarHBondContact O-CB 3.4Å; H576-A580 PolarHBondContact O-N 3.26Å; H576-M608 HydrophobicContact CB-SD 4.21Å; H576-L616 HydrophobicContact CB-CD1 4.21Å; H576-L616 HydrophobicContact CB-CD2 3.97Å
577	R	96	Very high	95.8	Very high	79 Å²	79	35.1 Å²	35.1	30%	0.298	18%	0.182	S	C	.	.	H	α-helix	trans	-57.4	-54.7	-179.9	-173.6	-168.4	-61.8	143.3	8.4	112	P573 N574 A580 K581 D613 E615 L616	P573-R577 PolarHBondContact O-N 2.98Å; N574-R577 PolarHBondContact O-N 3.16Å; R577-A580 PolarHBondContact O-N 3.41Å; R577-K581 WeakPolarHBondContact O-CG 3.32Å; R577-K581 PolarHBondContact O-N 2.91Å; R577-D613 IonicContact CZ-OD2 3.11Å; R577-D613 IonicContact NE-OD1 3.41Å; R577-D613 IonicContact NE-OD2 2.68Å; R577-D613 PolarHBondContact NE-OD2 3.25Å; R577-D613 IonicContact NH2-OD1 2.66Å; R577-D613 IonicContact NH2-OD2 2.91Å; R577-D613 PolarHBondContact NH2-OD2 3.11Å; R577-E615 WeakPolarHBondContact CD-OE2 3.33Å; R577-E615 HydrophobicContact CG-CB 4.23Å; R577-L616 HydrophobicContact CB-CB 4.45Å
578	S	96.6	Very high	95.8	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-63	-42	-179.5	55.3	0	0	0	0	111.9	T539 D540 N574 V575 K581 A582	T539-S578 WeakPolarHBondContact OG1-CB 3.39Å; T539-S578 PolarHBondContact OG1-OG 2.63Å; D540-S578 WeakPolarHBondContact OD1-CB 3.32Å; N574-S578 WeakPolarHBondContact O-CB 3.43Å; N574-S578 PolarHBondContact O-N 3.44Å; N574-S578 PolarHBondContact O-OG 3.36Å; V575-S578 WeakPolarHBondContact CA-OG 3.07Å; V575-S578 PolarHBondContact O-OG 3.22Å; V575-S578 VanDerWaalsContact O-OG 3.11Å; S578-K581 PolarHBondContact O-N 3.41Å; S578-A582 PolarHBondContact O-N 3.23Å
579	T	97.6	Very high	95.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.2	-44.9	175.5	-59.1	0	0	0	0	111.6	I564 L568 V575 H576 K581 A582 L583	I564-T579 HydrophobicContact CG2-CG2 3.88Å; I564-T579 VanDerWaalsContact O-CG2 3.28Å; I564-T579 WeakPolarHBondContact O-CG2 3.48Å; L568-T579 HydrophobicContact CD2-CG2 3.62Å; L568-T579 HydrophobicContact CG-CG2 3.86Å; V575-T579 WeakPolarHBondContact O-CB 3.16Å; V575-T579 PolarHBondContact O-N 3.42Å; V575-T579 PolarHBondContact O-OG1 2.88Å; H576-T579 PolarHBondContact O-N 2.9Å; T579-K581 VanDerWaalsContact C-N 3.33Å; T579-K581 PolarHBondContact O-N 3.03Å; T579-A582 PolarHBondContact O-N 2.91Å; T579-L583 HydrophobicContact CG2-CD1 3.99Å; T579-L583 HydrophobicContact CG2-CG 4.31Å; T579-L583 WeakPolarHBondContact O-CG 3.23Å; T579-L583 PolarHBondContact O-N 3.43Å
580	A	97.7	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-39.7	178.2	0	0	0	0	0	111.8	H576 R577 L583 F584 L616 A619	H576-A580 VanDerWaalsContact O-CB 3.32Å; H576-A580 WeakPolarHBondContact O-CB 3.4Å; H576-A580 PolarHBondContact O-N 3.26Å; R577-A580 PolarHBondContact O-N 3.41Å; A580-L583 PolarHBondContact O-N 3.47Å; A580-F584 WeakPolarHBondContact O-CB 3.4Å; A580-F584 PolarHBondContact O-N 3.21Å; A580-L616 HydrophobicContact CB-CD1 3.47Å; A580-L616 VanDerWaalsContact CB-CD1 3.47Å; A580-A619 HydrophobicContact CB-CB 3.92Å
581	K	97.2	Very high	96	Very high	68 Å²	68	42.6 Å²	42.6	30%	0.296	22%	0.223	S	C	.	.	H	α-helix	trans	-60.6	-44.7	173.3	-71.9	176.2	179.9	-178.5	0	111.8	A543 R577 S578 T579 F584 Q585 E615 A619	A543-K581 HydrophobicContact CB-CB 4.3Å; R577-K581 WeakPolarHBondContact O-CG 3.32Å; R577-K581 PolarHBondContact O-N 2.91Å; S578-K581 PolarHBondContact O-N 3.41Å; T579-K581 VanDerWaalsContact C-N 3.33Å; T579-K581 PolarHBondContact O-N 3.03Å; K581-F584 PolarHBondContact O-N 3.16Å; K581-Q585 PolarHBondContact O-N 3.36Å; K581-Q585 VanDerWaalsContact O-N 3.16Å; K581-E615 WeakPolarHBondContact CE-OE2 3.32Å; K581-E615 IonicContact NZ-OE2 2.68Å; K581-E615 PolarHBondContact NZ-OE2 3.11Å; K581-A619 HydrophobicContact CG-CB 4.07Å
582	A	97.9	Very high	96.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-48	176.8	0	0	0	0	0	112	T539 V542 A543 I564 S578 T579 F584 Q585 L586	T539-A582 HydrophobicContact CG2-CB 4.48Å; T539-A582 WeakPolarHBondContact O-CB 3.36Å; V542-A582 HydrophobicContact CG1-CB 4.43Å; A543-A582 HydrophobicContact CB-CB 4.1Å; I564-A582 HydrophobicContact CG2-CB 4.42Å; S578-A582 PolarHBondContact O-N 3.23Å; T579-A582 PolarHBondContact O-N 2.91Å; A582-F584 VanDerWaalsContact C-N 3.31Å; A582-F584 PolarHBondContact O-N 2.7Å; A582-Q585 PolarHBondContact O-N 3.04Å; A582-L586 WeakPolarHBondContact O-CB 3.42Å; A582-L586 WeakPolarHBondContact O-CG 3.28Å; A582-L586 PolarHBondContact O-N 2.97Å
583	L	97.7	Very high	96.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-38	177.7	-67.5	175.3	0	0	0	111.8	I564 V565 L568 T579 A580 Q585 L586 S587 M596 V601 L605	I564-L583 HydrophobicContact CB-CD2 4.44Å; I564-L583 HydrophobicContact CG2-CD2 3.75Å; I564-L583 HydrophobicContact CG2-CG 4.03Å; V565-L583 HydrophobicContact CG2-CD1 4.23Å; V565-L583 HydrophobicContact CG2-CD2 3.61Å; L568-L583 HydrophobicContact CD1-CD1 3.72Å; L568-L583 HydrophobicContact CD2-CD1 4.42Å; L568-L583 HydrophobicContact CG-CD1 4.16Å; T579-L583 HydrophobicContact CG2-CD1 3.99Å; T579-L583 HydrophobicContact CG2-CG 4.31Å; T579-L583 WeakPolarHBondContact O-CG 3.23Å; T579-L583 PolarHBondContact O-N 3.43Å; A580-L583 PolarHBondContact O-N 3.47Å; L583-Q585 PolarHBondContact O-N 2.8Å; L583-L586 PolarHBondContact O-N 3.31Å; L583-S587 WeakPolarHBondContact O-CB 3.32Å; L583-S587 PolarHBondContact O-N 3.2Å; L583-S587 PolarHBondContact O-OG 2.9Å; L583-M596 HydrophobicContact CB-CE 4.33Å; L583-M596 HydrophobicContact CB-SD 4.47Å; L583-M596 HydrophobicContact CD2-CE 3.73Å; L583-M596 HydrophobicContact CD2-CG 4.39Å; L583-M596 HydrophobicContact CD2-SD 4.08Å; L583-M596 WeakPolarHBondContact O-CE 3.23Å; L583-V601 HydrophobicContact CD1-CG2 4.06Å; L583-L605 HydrophobicContact CD1-CD2 4.47Å
584	F	97.6	Very high	96.4	Very high	50 Å²	50	34.7 Å²	34.7	22%	0.219	17%	0.17	C	C	.	.	H	α-helix	trans	-59.6	-45.9	174.4	176.5	-140.5	0	0	0	111.9	A580 K581 A582 S587 A619 C623	A580-F584 WeakPolarHBondContact O-CB 3.4Å; A580-F584 PolarHBondContact O-N 3.21Å; K581-F584 PolarHBondContact O-N 3.16Å; A582-F584 VanDerWaalsContact C-N 3.31Å; A582-F584 PolarHBondContact O-N 2.7Å; F584-S587 PolarHBondContact O-N 3.26Å; F584-S587 PolarHBondContact O-OG 3.46Å; F584-A619 HydrophobicContact CB-CB 4.4Å; F584-C623 HydrophobicContact CB-CB 4.33Å
585	Q	97.1	Very high	96.5	Very high	33 Å²	33	32.7 Å²	32.7	15%	0.154	16%	0.161	C	C	.	.	H	α-helix	trans	-68.6	-42.8	177.9	-64.4	-64.7	-12.2	0	0	112.4	A543 C546 K581 A582 L583 S587 R588	A543-Q585 WeakPolarHBondContact O-CG 3.46Å; C546-Q585 HydrophobicContact CB-CB 3.65Å; K581-Q585 PolarHBondContact O-N 3.36Å; K581-Q585 VanDerWaalsContact O-N 3.16Å; A582-Q585 PolarHBondContact O-N 3.04Å; L583-Q585 PolarHBondContact O-N 2.8Å; Q585-S587 VanDerWaalsContact C-N 3.31Å; Q585-S587 PolarHBondContact O-N 3.14Å; Q585-R588 WeakPolarHBondContact O-CB 3.42Å; Q585-R588 WeakPolarHBondContact O-CG 3.36Å; Q585-R588 PolarHBondContact O-N 3.27Å; Q585-R588 VanDerWaalsContact OE1-CZ 3.3Å
586	L	97.3	Very high	96.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.5	-36.4	176.4	-75.3	165.5	0	0	0	112.6	V542 C546 F555 V561 I564 A582 L583 R588 D589 N592 M596	V542-L586 HydrophobicContact CG1-CD1 4.16Å; V542-L586 HydrophobicContact CG1-CG 4.48Å; C546-L586 WeakPolarHBondContact SG-CD2 3.3Å; F555-L586 HydrophobicContact CB-CD2 3.66Å; F555-L586 HydrophobicContact CG-CD2 4.31Å; V561-L586 HydrophobicContact CG2-CD1 4.46Å; V561-L586 HydrophobicContact CG2-CD2 4.44Å; I564-L586 HydrophobicContact CD1-CD1 3.89Å; A582-L586 WeakPolarHBondContact O-CB 3.42Å; A582-L586 WeakPolarHBondContact O-CG 3.28Å; A582-L586 PolarHBondContact O-N 2.97Å; L583-L586 PolarHBondContact O-N 3.31Å; L586-R588 PolarHBondContact O-N 3.05Å; L586-R588 VanDerWaalsContact O-N 3.1Å; L586-D589 PolarHBondContact O-N 2.98Å; L586-D589 VanDerWaalsContact O-N 3.14Å; L586-N592 VanDerWaalsContact O-CB 3.23Å; L586-N592 WeakPolarHBondContact O-CB 3.34Å; L586-N592 PolarHBondContact O-ND2 3.24Å; L586-M596 HydrophobicContact CB-CE 3.35Å; L586-M596 HydrophobicContact CD1-CE 4.42Å
587	S	96.8	Very high	96.3	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.021	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-5.6	-179.8	71.1	0	0	0	0	113.9	L583 F584 Q585 D589 C593 N626	L583-S587 WeakPolarHBondContact O-CB 3.32Å; L583-S587 PolarHBondContact O-N 3.2Å; L583-S587 PolarHBondContact O-OG 2.9Å; F584-S587 PolarHBondContact O-N 3.26Å; F584-S587 PolarHBondContact O-OG 3.46Å; Q585-S587 VanDerWaalsContact C-N 3.31Å; Q585-S587 PolarHBondContact O-N 3.14Å; S587-D589 PolarHBondContact O-N 3.25Å; S587-C593 PolarHBondContact O-SG 2.93Å; S587-N626 WeakPolarHBondContact O-CB 3.42Å; S587-N626 PolarHBondContact OG-ND2 3.11Å
588	R	95.6	Very high	96.1	Very high	123 Å²	123	39.2 Å²	39.2	46%	0.464	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-16.1	171.1	-63.3	-179.7	175.8	-162.5	-1.9	112.5	Q585 L586	Q585-R588 WeakPolarHBondContact O-CB 3.42Å; Q585-R588 WeakPolarHBondContact O-CG 3.36Å; Q585-R588 PolarHBondContact O-N 3.27Å; Q585-R588 VanDerWaalsContact OE1-CZ 3.3Å; L586-R588 PolarHBondContact O-N 3.05Å; L586-R588 VanDerWaalsContact O-N 3.1Å
589	D	96.2	Very high	95.9	Very high	16 Å²	16	41.1 Å²	41.1	9%	0.086	21%	0.207	C	C	.	.	S	Bend	trans	-93.8	132.2	169.6	174.8	72.2	0	0	0	111.2	R552 L586 S587 N591 N592 C593	R552-D589 HydrophobicContact CG-CB 4.13Å; L586-D589 PolarHBondContact O-N 2.98Å; L586-D589 VanDerWaalsContact O-N 3.14Å; S587-D589 PolarHBondContact O-N 3.25Å; D589-N591 PolarHBondContact O-N 3.26Å; D589-N591 WeakPolarHBondContact OD2-CA 2.98Å; D589-N591 WeakPolarHBondContact OD2-CB 3.47Å; D589-N591 PolarHBondContact OD2-N 3.48Å; D589-N592 HydrophobicContact CB-CB 4.13Å; D589-N592 PolarHBondContact O-N 3.46Å; D589-N592 PolarHBondContact OD2-N 2.96Å; D589-C593 PolarHBondContact O-N 3.24Å; D589-C593 VanDerWaalsContact O-N 3.13Å
590	P	94.9	Very high	95.7	Very high	68 Å²	68	46.5 Å²	46.5	44%	0.442	24%	0.236	S	C	.	.	H	α-helix	trans	-60.7	-39.6	178.6	-27.6	36.4	0	0	0	115	C593 V594 L630	P590-C593 WeakPolarHBondContact O-CB 3.47Å; P590-C593 PolarHBondContact O-N 2.71Å; P590-V594 WeakPolarHBondContact O-CG2 3.4Å; P590-V594 PolarHBondContact O-N 2.94Å; P590-V594 VanDerWaalsContact O-N 3.1Å; P590-L630 HydrophobicContact CB-CD1 4Å; P590-L630 HydrophobicContact CB-CD2 4.25Å; P590-L630 WeakPolarHBondContact O-CD2 3.35Å
591	N	95.3	Very high	95.6	Very high	111 Å²	111	46.5 Å²	46.5	59%	0.594	24%	0.236	S	C	*	.	H	α-helix	trans	-68.5	-39.6	-178.2	-64.6	-51.8	0	0	0	110.7	D589 C593 V594 S595	D589-N591 PolarHBondContact O-N 3.26Å; D589-N591 WeakPolarHBondContact OD2-CA 2.98Å; D589-N591 WeakPolarHBondContact OD2-CB 3.47Å; D589-N591 PolarHBondContact OD2-N 3.48Å; N591-C593 VanDerWaalsContact C-N 3.32Å; N591-C593 PolarHBondContact O-N 2.91Å; N591-V594 WeakPolarHBondContact O-CB 3.19Å; N591-V594 PolarHBondContact O-N 3.39Å; N591-V594 VanDerWaalsContact O-N 3.13Å; N591-S595 PolarHBondContact O-N 2.77Å; N591-S595 PolarHBondContact O-OG 2.87Å
592	N	96.7	Very high	95.5	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.011	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-42.6	172.1	-70.2	-15.8	0	0	0	111.9	R552 G556 V561 L586 D589 V594 S595 M596	R552-N592 PolarHBondContact O-ND2 2.92Å; G556-N592 WeakPolarHBondContact CA-OD1 3.32Å; V561-N592 HydrophobicContact CG2-CB 4.22Å; L586-N592 VanDerWaalsContact O-CB 3.23Å; L586-N592 WeakPolarHBondContact O-CB 3.34Å; L586-N592 PolarHBondContact O-ND2 3.24Å; D589-N592 HydrophobicContact CB-CB 4.13Å; D589-N592 PolarHBondContact O-N 3.46Å; D589-N592 PolarHBondContact OD2-N 2.96Å; N592-V594 VanDerWaalsContact C-N 3.29Å; N592-V594 PolarHBondContact O-N 2.71Å; N592-S595 PolarHBondContact O-N 3.43Å; N592-M596 HydrophobicContact CB-CE 4.35Å; N592-M596 WeakPolarHBondContact O-CB 3.19Å; N592-M596 VanDerWaalsContact O-CG 3.23Å; N592-M596 WeakPolarHBondContact O-CG 3.38Å; N592-M596 PolarHBondContact O-N 2.98Å
593	C	96.1	Very high	95.2	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.02	26%	0.262	C	S	.	.	H	α-helix	trans	-57.6	-42.1	174	-79.3	0	0	0	0	112.3	S587 D589 P590 N591 M596 H597 I627 L630	S587-C593 PolarHBondContact O-SG 2.93Å; D589-C593 PolarHBondContact O-N 3.24Å; D589-C593 VanDerWaalsContact O-N 3.13Å; P590-C593 WeakPolarHBondContact O-CB 3.47Å; P590-C593 PolarHBondContact O-N 2.71Å; N591-C593 VanDerWaalsContact C-N 3.32Å; N591-C593 PolarHBondContact O-N 2.91Å; C593-M596 PolarHBondContact O-N 2.72Å; C593-H597 WeakPolarHBondContact O-CB 3.42Å; C593-H597 PolarHBondContact O-N 2.99Å; C593-I627 HydrophobicContact CB-CG1 4.29Å; C593-L630 HydrophobicContact CB-CD2 3.47Å; C593-L630 VanDerWaalsContact CB-CD2 3.47Å
594	V	94.7	Very high	95.1	Very high	66 Å²	66	54.5 Å²	54.5	40%	0.4	27%	0.273	S	S	.	.	H	α-helix	trans	-60.8	-49.9	175.8	176	0	0	0	0	110.4	P590 N591 N592 M596 H597 Q598 L630	P590-V594 WeakPolarHBondContact O-CG2 3.4Å; P590-V594 PolarHBondContact O-N 2.94Å; P590-V594 VanDerWaalsContact O-N 3.1Å; N591-V594 WeakPolarHBondContact O-CB 3.19Å; N591-V594 PolarHBondContact O-N 3.39Å; N591-V594 VanDerWaalsContact O-N 3.13Å; N592-V594 VanDerWaalsContact C-N 3.29Å; N592-V594 PolarHBondContact O-N 2.71Å; V594-M596 VanDerWaalsContact C-N 3.33Å; V594-M596 PolarHBondContact O-N 3.22Å; V594-H597 PolarHBondContact O-N 2.87Å; V594-Q598 VanDerWaalsContact O-CG 3.31Å; V594-Q598 WeakPolarHBondContact O-CG 3.44Å; V594-Q598 PolarHBondContact O-N 3.1Å; V594-L630 HydrophobicContact CG2-CD2 4.08Å
595	S	94.8	Very high	95	Very high	35 Å²	35	52.1 Å²	52.1	25%	0.245	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-39.3	178.1	-58.7	0	0	0	0	112.9	N591 N592	N591-S595 PolarHBondContact O-N 2.77Å; N591-S595 PolarHBondContact O-OG 2.87Å; N592-S595 PolarHBondContact O-N 3.43Å
596	M	96.2	Very high	94.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67	-41.1	175.9	-68.5	179.1	-166.2	0	0	112.2	V561 V565 L583 L586 N592 C593 V594 V599 V601 I627	V561-M596 HydrophobicContact CG1-CB 4.45Å; V561-M596 HydrophobicContact CG1-CE 3.88Å; V561-M596 HydrophobicContact CG1-CG 3.35Å; V565-M596 HydrophobicContact CG2-CB 4.49Å; V565-M596 HydrophobicContact CG2-CG 4.11Å; L583-M596 HydrophobicContact CB-CE 4.33Å; L583-M596 HydrophobicContact CB-SD 4.47Å; L583-M596 HydrophobicContact CD2-CE 3.73Å; L583-M596 HydrophobicContact CD2-CG 4.39Å; L583-M596 HydrophobicContact CD2-SD 4.08Å; L583-M596 WeakPolarHBondContact O-CE 3.23Å; L586-M596 HydrophobicContact CB-CE 3.35Å; L586-M596 HydrophobicContact CD1-CE 4.42Å; N592-M596 HydrophobicContact CB-CE 4.35Å; N592-M596 WeakPolarHBondContact O-CB 3.19Å; N592-M596 VanDerWaalsContact O-CG 3.23Å; N592-M596 WeakPolarHBondContact O-CG 3.38Å; N592-M596 PolarHBondContact O-N 2.98Å; C593-M596 PolarHBondContact O-N 2.72Å; V594-M596 VanDerWaalsContact C-N 3.33Å; V594-M596 PolarHBondContact O-N 3.22Å; M596-V599 VanDerWaalsContact O-CG2 3.24Å; M596-V599 WeakPolarHBondContact O-CG2 3.18Å; M596-V599 PolarHBondContact O-N 3.41Å; M596-V601 HydrophobicContact CB-CB 4.21Å; M596-V601 HydrophobicContact CB-CG1 3.78Å; M596-V601 WeakPolarHBondContact O-CB 3.48Å; M596-V601 WeakPolarHBondContact O-CG1 3.41Å; M596-V601 PolarHBondContact O-N 3.13Å; M596-I627 HydrophobicContact CB-CD1 4.44Å
597	H	92.2	Very high	94.6	Very high	110 Å²	110	61.3 Å²	61.3	51%	0.509	31%	0.308	S	S	.	.	H	α-helix	trans	-66.1	-39.5	179	-170.7	-89.7	0	0	0	111.7	C593 V594 V599 N600	C593-H597 WeakPolarHBondContact O-CB 3.42Å; C593-H597 PolarHBondContact O-N 2.99Å; V594-H597 PolarHBondContact O-N 2.87Å; H597-V599 PolarHBondContact O-N 3.48Å; H597-V599 VanDerWaalsContact O-N 3.11Å; H597-N600 PolarHBondContact O-N 2.83Å
598	Q	91.7	Very high	94.5	Very high	133 Å²	133	62.2 Å²	62.2	62%	0.621	31%	0.312	S	S	*	.	H	α-helix	trans	-56.3	-26.8	176.1	-75.4	171.1	-11.7	0	0	113.7	V594	V594-Q598 VanDerWaalsContact O-CG 3.31Å; V594-Q598 WeakPolarHBondContact O-CG 3.44Å; V594-Q598 PolarHBondContact O-N 3.1Å
599	V	93.3	Very high	94.4	Very high	43 Å²	43	58.8 Å²	58.8	26%	0.261	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	20.2	179.2	-63.3	0	0	0	0	113.6	I562 V565 M596 H597 V601	I562-V599 HydrophobicContact CD1-CG1 4.4Å; I562-V599 HydrophobicContact CG1-CG1 4.06Å; I562-V599 HydrophobicContact CG2-CG1 4.07Å; V565-V599 HydrophobicContact CB-CG2 3.96Å; V565-V599 HydrophobicContact CG1-CG2 3.65Å; V565-V599 HydrophobicContact CG2-CG2 4.05Å; M596-V599 VanDerWaalsContact O-CG2 3.24Å; M596-V599 WeakPolarHBondContact O-CG2 3.18Å; M596-V599 PolarHBondContact O-N 3.41Å; H597-V599 PolarHBondContact O-N 3.48Å; H597-V599 VanDerWaalsContact O-N 3.11Å; V599-V601 VanDerWaalsContact C-N 3.31Å; V599-V601 PolarHBondContact O-N 3.43Å
600	N	92.9	Very high	94.2	Very high	113 Å²	113	61.4 Å²	61.4	60%	0.604	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	37.1	175.5	-63.1	-51.6	0	0	0	114.1	H597 V602 K603 Y604	H597-N600 PolarHBondContact O-N 2.83Å; N600-V602 PolarHBondContact O-N 3.23Å; N600-V602 VanDerWaalsContact O-N 3.11Å; N600-K603 PolarHBondContact O-N 3.47Å; N600-Y604 WeakPolarHBondContact O-CD2 3.12Å
601	V	95.2	Very high	94	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-54.2	-33.7	-179.2	75.5	0	0	0	0	112.9	V565 L568 L583 M596 V599 K603 Y604 L605 I627	V565-V601 HydrophobicContact CG1-CB 4.06Å; V565-V601 HydrophobicContact CG1-CG2 3.86Å; V565-V601 HydrophobicContact CG2-CB 4.36Å; V565-V601 HydrophobicContact CG2-CG2 3.94Å; L568-V601 HydrophobicContact CD1-CG2 4.06Å; L583-V601 HydrophobicContact CD1-CG2 4.06Å; M596-V601 HydrophobicContact CB-CB 4.21Å; M596-V601 HydrophobicContact CB-CG1 3.78Å; M596-V601 WeakPolarHBondContact O-CB 3.48Å; M596-V601 WeakPolarHBondContact O-CG1 3.41Å; M596-V601 PolarHBondContact O-N 3.13Å; V599-V601 VanDerWaalsContact C-N 3.31Å; V599-V601 PolarHBondContact O-N 3.43Å; V601-K603 VanDerWaalsContact C-N 3.29Å; V601-K603 PolarHBondContact O-N 3.4Å; V601-Y604 PolarHBondContact O-N 3.13Å; V601-Y604 VanDerWaalsContact O-N 3.09Å; V601-L605 HydrophobicContact CG1-CD1 4.32Å; V601-L605 HydrophobicContact CG2-CD1 3.73Å; V601-L605 HydrophobicContact CG2-CG 3.93Å; V601-L605 PolarHBondContact O-N 3.1Å; V601-I627 HydrophobicContact CG1-CD1 3.47Å; V601-I627 VanDerWaalsContact CG1-CD1 3.47Å
602	V	94.4	Very high	93.9	Very high	42 Å²	42	60.3 Å²	60.3	26%	0.255	34%	0.338	S	S	.	.	H	α-helix	trans	-60.7	-38.2	-173.6	179.3	0	0	0	0	111.5	N600 Y604 L605 L606 I627	N600-V602 PolarHBondContact O-N 3.23Å; N600-V602 VanDerWaalsContact O-N 3.11Å; V602-Y604 VanDerWaalsContact C-N 3.33Å; V602-Y604 PolarHBondContact O-N 3.45Å; V602-L605 PolarHBondContact O-N 2.87Å; V602-L606 HydrophobicContact CG1-CD1 3.87Å; V602-L606 HydrophobicContact CG1-CG 4.16Å; V602-L606 WeakPolarHBondContact O-CB 3.23Å; V602-L606 VanDerWaalsContact O-CG 3.29Å; V602-L606 WeakPolarHBondContact O-CG 3.49Å; V602-L606 PolarHBondContact O-N 3.38Å; V602-I627 HydrophobicContact CG2-CD1 4.42Å; V602-I627 HydrophobicContact CG2-CG2 4.39Å
603	K	93.5	Very high	93.8	Very high	138 Å²	138	61.3 Å²	61.3	60%	0.6	34%	0.343	S	S	*	.	H	α-helix	trans	-60.2	-44.3	177.1	-179.8	177.9	178.4	175.8	0	111.4	N600 V601 Q607	N600-K603 PolarHBondContact O-N 3.47Å; V601-K603 VanDerWaalsContact C-N 3.29Å; V601-K603 PolarHBondContact O-N 3.4Å; K603-Q607 WeakPolarHBondContact O-CG 3.35Å; K603-Q607 PolarHBondContact O-N 2.99Å
604	Y	94.1	Very high	93.8	Very high	56 Å²	56	65.4 Å²	65.4	22%	0.22	37%	0.37	C	S	.	.	H	α-helix	trans	-68.6	-48.6	179	-60.8	-71.3	0	0	0	110.7	L568 K569 N600 V601 V602 L606 Q607 M608	L568-Y604 HydrophobicContact CB-CG 4.44Å; K569-Y604 WeakPolarHBondContact CE-OH 3.49Å; K569-Y604 HydrophobicContact CG-CE1 4.14Å; N600-Y604 WeakPolarHBondContact O-CD2 3.12Å; V601-Y604 PolarHBondContact O-N 3.13Å; V601-Y604 VanDerWaalsContact O-N 3.09Å; V602-Y604 VanDerWaalsContact C-N 3.33Å; V602-Y604 PolarHBondContact O-N 3.45Å; Y604-L606 VanDerWaalsContact C-N 3.34Å; Y604-L606 PolarHBondContact O-N 3.4Å; Y604-Q607 WeakPolarHBondContact O-CB 3.42Å; Y604-Q607 PolarHBondContact O-N 3.22Å; Y604-Q607 VanDerWaalsContact O-N 3.14Å; Y604-M608 WeakPolarHBondContact O-CG 3.35Å; Y604-M608 PolarHBondContact O-N 3.33Å; Y604-M608 VanDerWaalsContact O-N 3.14Å
605	L	95.3	Very high	93.8	Very high	0 Å²	0	67 Å²	67	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-64.3	-35.9	-178.1	-65.6	176.6	0	0	0	112.7	L568 L583 V601 V602 Q607 M608 V609 C623 I624	L568-L605 HydrophobicContact CD1-CD2 3.83Å; L568-L605 HydrophobicContact CD1-CG 4.25Å; L568-L605 HydrophobicContact CD2-CD2 4.47Å; L583-L605 HydrophobicContact CD1-CD2 4.47Å; V601-L605 HydrophobicContact CG1-CD1 4.32Å; V601-L605 HydrophobicContact CG2-CD1 3.73Å; V601-L605 HydrophobicContact CG2-CG 3.93Å; V601-L605 PolarHBondContact O-N 3.1Å; V602-L605 PolarHBondContact O-N 2.87Å; L605-Q607 VanDerWaalsContact C-N 3.3Å; L605-Q607 PolarHBondContact O-N 3.24Å; L605-M608 PolarHBondContact O-N 3.34Å; L605-M608 VanDerWaalsContact O-N 3.11Å; L605-V609 WeakPolarHBondContact O-CG2 3.49Å; L605-V609 PolarHBondContact O-N 3Å; L605-C623 HydrophobicContact CD1-CB 3.79Å; L605-C623 VanDerWaalsContact CD1-SG 3.57Å; L605-I624 HydrophobicContact CB-CD1 3.68Å; L605-I624 HydrophobicContact CB-CG1 3.8Å; L605-I624 HydrophobicContact CD1-CG1 4.03Å
606	L	94.9	Very high	93.9	Very high	105 Å²	105	65.6 Å²	65.6	55%	0.55	36%	0.363	S	S	.	.	H	α-helix	trans	-61.6	-38	174.5	-78.2	172.5	0	0	0	112.3	V602 Y604 M608 V609 I624	V602-L606 HydrophobicContact CG1-CD1 3.87Å; V602-L606 HydrophobicContact CG1-CG 4.16Å; V602-L606 WeakPolarHBondContact O-CB 3.23Å; V602-L606 VanDerWaalsContact O-CG 3.29Å; V602-L606 WeakPolarHBondContact O-CG 3.49Å; V602-L606 PolarHBondContact O-N 3.38Å; Y604-L606 VanDerWaalsContact C-N 3.34Å; Y604-L606 PolarHBondContact O-N 3.4Å; L606-M608 VanDerWaalsContact C-N 3.33Å; L606-V609 PolarHBondContact O-N 3.11Å; L606-I624 HydrophobicContact CD2-CD1 4Å; L606-I624 HydrophobicContact CG-CD1 4.12Å
607	Q	92.7	Very high	93.9	Very high	121 Å²	121	69 Å²	69	57%	0.565	38%	0.379	S	S	*	.	H	α-helix	trans	-64.1	-40.8	173.2	-67.4	174.6	-15.4	0	0	111	K603 Y604 L605 G610	K603-Q607 WeakPolarHBondContact O-CG 3.35Å; K603-Q607 PolarHBondContact O-N 2.99Å; Y604-Q607 WeakPolarHBondContact O-CB 3.42Å; Y604-Q607 PolarHBondContact O-N 3.22Å; Y604-Q607 VanDerWaalsContact O-N 3.14Å; L605-Q607 VanDerWaalsContact C-N 3.3Å; L605-Q607 PolarHBondContact O-N 3.24Å; Q607-G610 PolarHBondContact O-N 2.85Å; Q607-G610 VanDerWaalsContact O-N 3.1Å
608	M	93.4	Very high	94.1	Very high	22 Å²	22	68.5 Å²	68.5	11%	0.108	38%	0.383	C	S	.	.	H	α-helix	trans	-70.6	-28.8	179.9	-59.8	-54.5	159.1	0	0	113.6	H576 Y604 L605 L606 G610 S611 L616	H576-M608 HydrophobicContact CB-SD 4.21Å; Y604-M608 WeakPolarHBondContact O-CG 3.35Å; Y604-M608 PolarHBondContact O-N 3.33Å; Y604-M608 VanDerWaalsContact O-N 3.14Å; L605-M608 PolarHBondContact O-N 3.34Å; L605-M608 VanDerWaalsContact O-N 3.11Å; L606-M608 VanDerWaalsContact C-N 3.33Å; M608-G610 PolarHBondContact O-N 3.32Å; M608-S611 WeakPolarHBondContact O-CB 3.31Å; M608-S611 PolarHBondContact O-N 2.72Å; M608-S611 PolarHBondContact O-OG 3.47Å; M608-L616 HydrophobicContact CB-CD1 3.93Å; M608-L616 HydrophobicContact CB-CD2 4.23Å; M608-L616 HydrophobicContact CB-CG 4.06Å; M608-L616 HydrophobicContact CG-CD1 4.35Å; M608-L616 HydrophobicContact SD-CD2 4.21Å
609	V	93.7	Very high	94.4	Very high	51 Å²	51	62.3 Å²	62.3	31%	0.309	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-25.6	170.2	172.8	0	0	0	0	111.3	L605 L606 S611 Q617 A621 I624	L605-V609 WeakPolarHBondContact O-CG2 3.49Å; L605-V609 PolarHBondContact O-N 3Å; L606-V609 PolarHBondContact O-N 3.11Å; V609-S611 VanDerWaalsContact C-N 3.29Å; V609-S611 PolarHBondContact O-N 3.31Å; V609-Q617 WeakPolarHBondContact O-CG 3.4Å; V609-Q617 PolarHBondContact O-NE2 3.42Å; V609-A621 HydrophobicContact CG2-CB 4.32Å; V609-I624 HydrophobicContact CG2-CD1 4.16Å
610	G	91.2	Very high	94.6	Very high	71 Å²	71	60.3 Å²	60.3	73%	0.732	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-1.6	172.5	0	0	0	0	0	115.1	Q607 M608	Q607-G610 PolarHBondContact O-N 2.85Å; Q607-G610 VanDerWaalsContact O-N 3.1Å; M608-G610 PolarHBondContact O-N 3.32Å
611	S	91.7	Very high	94.7	Very high	30 Å²	30	57.1 Å²	57.1	21%	0.21	33%	0.332	C	S	.	.	S	Bend	trans	-70.4	163	178.8	70.9	0	0	0	0	112.1	M608 V609 D613 L616 Q617	M608-S611 WeakPolarHBondContact O-CB 3.31Å; M608-S611 PolarHBondContact O-N 2.72Å; M608-S611 PolarHBondContact O-OG 3.47Å; V609-S611 VanDerWaalsContact C-N 3.29Å; V609-S611 PolarHBondContact O-N 3.31Å; S611-D613 VanDerWaalsContact C-N 3.25Å; S611-D613 PolarHBondContact O-N 3.01Å; S611-L616 WeakPolarHBondContact OG-CD2 3.24Å; S611-Q617 PolarHBondContact O-NE2 2.9Å
612	S	93.4	Very high	94.8	Very high	126 Å²	126	57.8 Å²	57.8	88%	0.881	34%	0.339	S	S	*	.	S	Bend	trans	-81.7	0.7	174.3	54.3	0	0	0	0	114.1	P614	S612-P614 WeakPolarHBondContact O-CD 3.27Å
613	D	94.4	Very high	95	Very high	23 Å²	23	55.8 Å²	55.8	12%	0.123	33%	0.327	C	S	.	.			trans	-96.4	109.5	-173.4	177.5	-14.6	0	0	0	111.1	R577 S611 E615 L616 Q617	R577-D613 IonicContact CZ-OD2 3.11Å; R577-D613 IonicContact NE-OD1 3.41Å; R577-D613 IonicContact NE-OD2 2.68Å; R577-D613 PolarHBondContact NE-OD2 3.25Å; R577-D613 IonicContact NH2-OD1 2.66Å; R577-D613 IonicContact NH2-OD2 2.91Å; R577-D613 PolarHBondContact NH2-OD2 3.11Å; S611-D613 VanDerWaalsContact C-N 3.25Å; S611-D613 PolarHBondContact O-N 3.01Å; D613-E615 VanDerWaalsContact C-N 3.29Å; D613-E615 PolarHBondContact O-N 2.87Å; D613-E615 PolarHBondContact OD1-N 2.78Å; D613-L616 HydrophobicContact CB-CB 3.85Å; D613-L616 PolarHBondContact O-N 3.3Å; D613-L616 PolarHBondContact OD1-N 3.35Å; D613-Q617 WeakPolarHBondContact O-CG 3.42Å; D613-Q617 PolarHBondContact O-N 2.84Å
614	P	95.7	Very high	95.1	Very high	88 Å²	88	50.8 Å²	50.8	57%	0.571	31%	0.306	S	S	*	.	H	α-helix	trans	-62.3	-32.8	-174.2	-23.1	34.4	0	0	0	113.9	S612 T618	S612-P614 WeakPolarHBondContact O-CD 3.27Å; P614-T618 WeakPolarHBondContact O-CB 3.29Å; P614-T618 PolarHBondContact O-N 3.11Å; P614-T618 PolarHBondContact O-OG1 3.48Å
615	E	95.3	Very high	95.3	Very high	100 Å²	100	50.2 Å²	50.2	47%	0.467	31%	0.31	S	S	.	.	H	α-helix	trans	-72.5	-42.6	179.7	-67.1	-173.2	-170.8	0	0	110.8	R577 K581 D613 T618 A619	R577-E615 WeakPolarHBondContact CD-OE2 3.33Å; R577-E615 HydrophobicContact CG-CB 4.23Å; K581-E615 WeakPolarHBondContact CE-OE2 3.32Å; K581-E615 IonicContact NZ-OE2 2.68Å; K581-E615 PolarHBondContact NZ-OE2 3.11Å; D613-E615 VanDerWaalsContact C-N 3.29Å; D613-E615 PolarHBondContact O-N 2.87Å; D613-E615 PolarHBondContact OD1-N 2.78Å; E615-T618 PolarHBondContact O-N 3.29Å; E615-A619 WeakPolarHBondContact O-CB 3.42Å; E615-A619 PolarHBondContact O-N 3.14Å
616	L	96.2	Very high	95.3	Very high	5 Å²	5	51 Å²	51	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-43.6	174.5	174.5	55.7	0	0	0	111	H576 R577 A580 M608 S611 D613 S620	H576-L616 HydrophobicContact CB-CD1 4.21Å; H576-L616 HydrophobicContact CB-CD2 3.97Å; R577-L616 HydrophobicContact CB-CB 4.45Å; A580-L616 HydrophobicContact CB-CD1 3.47Å; A580-L616 VanDerWaalsContact CB-CD1 3.47Å; M608-L616 HydrophobicContact CB-CD1 3.93Å; M608-L616 HydrophobicContact CB-CD2 4.23Å; M608-L616 HydrophobicContact CB-CG 4.06Å; M608-L616 HydrophobicContact CG-CD1 4.35Å; M608-L616 HydrophobicContact SD-CD2 4.21Å; S611-L616 WeakPolarHBondContact OG-CD2 3.24Å; D613-L616 HydrophobicContact CB-CB 3.85Å; D613-L616 PolarHBondContact O-N 3.3Å; D613-L616 PolarHBondContact OD1-N 3.35Å; L616-S620 WeakPolarHBondContact O-CB 3.36Å; L616-S620 PolarHBondContact O-N 3.32Å; L616-S620 PolarHBondContact O-OG 2.87Å
617	Q	96.6	Very high	95.4	Very high	73 Å²	73	46.5 Å²	46.5	34%	0.341	29%	0.291	S	S	.	.	H	α-helix	trans	-57.7	-52.1	175.1	-73.2	-175.8	-21.4	0	0	111.4	V609 S611 D613 A619 S620 A621	V609-Q617 WeakPolarHBondContact O-CG 3.4Å; V609-Q617 PolarHBondContact O-NE2 3.42Å; S611-Q617 PolarHBondContact O-NE2 2.9Å; D613-Q617 WeakPolarHBondContact O-CG 3.42Å; D613-Q617 PolarHBondContact O-N 2.84Å; Q617-A619 PolarHBondContact O-N 3.34Å; Q617-S620 PolarHBondContact O-N 3.37Å; Q617-A621 VanDerWaalsContact O-CB 3.27Å; Q617-A621 WeakPolarHBondContact O-CB 3.35Å; Q617-A621 PolarHBondContact O-N 3Å
618	T	96.6	Very high	95.5	Very high	98 Å²	98	48.8 Å²	48.8	60%	0.601	29%	0.294	S	S	*	.	H	α-helix	trans	-61.9	-46.6	-177.1	-59	0	0	0	0	111.4	P614 E615 G622	P614-T618 WeakPolarHBondContact O-CB 3.29Å; P614-T618 PolarHBondContact O-N 3.11Å; P614-T618 PolarHBondContact O-OG1 3.48Å; E615-T618 PolarHBondContact O-N 3.29Å; T618-G622 PolarHBondContact O-N 3.1Å
619	A	97.3	Very high	95.6	Very high	4 Å²	4	54.8 Å²	54.8	3%	0.033	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-42.9	178.5	0	0	0	0	0	111.9	A580 K581 F584 E615 Q617 G622 C623	A580-A619 HydrophobicContact CB-CB 3.92Å; K581-A619 HydrophobicContact CG-CB 4.07Å; F584-A619 HydrophobicContact CB-CB 4.4Å; E615-A619 WeakPolarHBondContact O-CB 3.42Å; E615-A619 PolarHBondContact O-N 3.14Å; Q617-A619 PolarHBondContact O-N 3.34Å; A619-G622 PolarHBondContact O-N 3.15Å; A619-C623 WeakPolarHBondContact O-CB 3.37Å; A619-C623 PolarHBondContact O-N 3.45Å
620	S	97.2	Very high	95.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.2	-47.1	178.6	-59	0	0	0	0	111.7	L616 Q617 C623 I624	L616-S620 WeakPolarHBondContact O-CB 3.36Å; L616-S620 PolarHBondContact O-N 3.32Å; L616-S620 PolarHBondContact O-OG 2.87Å; Q617-S620 PolarHBondContact O-N 3.37Å; S620-C623 PolarHBondContact O-N 3.43Å; S620-I624 WeakPolarHBondContact O-CG1 3.41Å; S620-I624 PolarHBondContact O-N 3.41Å
621	A	96.9	Very high	95.8	Very high	47 Å²	47	53.4 Å²	53.4	39%	0.388	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-41.1	176.5	0	0	0	0	0	111.8	V609 Q617 I624 S625	V609-A621 HydrophobicContact CG2-CB 4.32Å; Q617-A621 VanDerWaalsContact O-CB 3.27Å; Q617-A621 WeakPolarHBondContact O-CB 3.35Å; Q617-A621 PolarHBondContact O-N 3Å; A621-I624 PolarHBondContact O-N 2.91Å; A621-S625 WeakPolarHBondContact O-CB 3.4Å; A621-S625 PolarHBondContact O-N 3.38Å
622	G	96.9	Very high	95.9	Very high	13 Å²	13	56 Å²	56	13%	0.134	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-45.1	175.4	0	0	0	0	0	112.5	T618 A619 S625 N626	T618-G622 PolarHBondContact O-N 3.1Å; A619-G622 PolarHBondContact O-N 3.15Å; G622-S625 WeakPolarHBondContact O-CB 3.35Å; G622-S625 PolarHBondContact O-N 3.41Å; G622-N626 PolarHBondContact O-N 2.97Å; G622-N626 VanDerWaalsContact O-N 3.11Å
623	C	97.2	Very high	95.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.3	-46.1	176.2	-173.8	0	0	0	0	111.9	F584 L605 A619 S620 S625 N626 I627	F584-C623 HydrophobicContact CB-CB 4.33Å; L605-C623 HydrophobicContact CD1-CB 3.79Å; L605-C623 VanDerWaalsContact CD1-SG 3.57Å; A619-C623 WeakPolarHBondContact O-CB 3.37Å; A619-C623 PolarHBondContact O-N 3.45Å; S620-C623 PolarHBondContact O-N 3.43Å; C623-S625 VanDerWaalsContact C-N 3.29Å; C623-S625 PolarHBondContact O-N 3.47Å; C623-N626 PolarHBondContact O-N 3.43Å; C623-I627 WeakPolarHBondContact O-CG1 3.45Å; C623-I627 PolarHBondContact O-N 3.33Å; C623-I627 VanDerWaalsContact O-N 3.15Å
624	I	96.8	Very high	95.8	Very high	34 Å²	34	56 Å²	56	17%	0.174	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-40.9	175.4	-66.4	165.3	0	0	0	110.7	L605 L606 V609 S620 A621 N626 I627 R628	L605-I624 HydrophobicContact CB-CD1 3.68Å; L605-I624 HydrophobicContact CB-CG1 3.8Å; L605-I624 HydrophobicContact CD1-CG1 4.03Å; L606-I624 HydrophobicContact CD2-CD1 4Å; L606-I624 HydrophobicContact CG-CD1 4.12Å; V609-I624 HydrophobicContact CG2-CD1 4.16Å; S620-I624 WeakPolarHBondContact O-CG1 3.41Å; S620-I624 PolarHBondContact O-N 3.41Å; A621-I624 PolarHBondContact O-N 2.91Å; I624-N626 PolarHBondContact O-N 3.07Å; I624-I627 PolarHBondContact O-N 3.3Å; I624-R628 WeakPolarHBondContact O-CB 3.35Å; I624-R628 PolarHBondContact O-N 3.14Å
625	S	97.2	Very high	95.6	Very high	43 Å²	43	57 Å²	57	30%	0.301	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-44.4	179.1	-167	0	0	0	0	111.7	A621 G622 C623 R628 R629	A621-S625 WeakPolarHBondContact O-CB 3.4Å; A621-S625 PolarHBondContact O-N 3.38Å; G622-S625 WeakPolarHBondContact O-CB 3.35Å; G622-S625 PolarHBondContact O-N 3.41Å; C623-S625 VanDerWaalsContact C-N 3.29Å; C623-S625 PolarHBondContact O-N 3.47Å; S625-R628 PolarHBondContact O-N 3.09Å; S625-R629 WeakPolarHBondContact O-CG 3.34Å; S625-R629 PolarHBondContact O-N 2.91Å; S625-R629 PolarHBondContact OG-NH2 2.9Å
626	N	96.8	Very high	95.4	Very high	18 Å²	18	59.5 Å²	59.5	10%	0.096	31%	0.312	C	S	.	.	H	α-helix	trans	-64.5	-45.1	177.5	-69.6	-18.4	0	0	0	112.1	S587 G622 C623 I624 R628 R629 L630	S587-N626 WeakPolarHBondContact O-CB 3.42Å; S587-N626 PolarHBondContact OG-ND2 3.11Å; G622-N626 PolarHBondContact O-N 2.97Å; G622-N626 VanDerWaalsContact O-N 3.11Å; C623-N626 PolarHBondContact O-N 3.43Å; I624-N626 PolarHBondContact O-N 3.07Å; N626-R628 VanDerWaalsContact C-N 3.33Å; N626-R628 PolarHBondContact O-N 3.29Å; N626-R629 PolarHBondContact O-N 3.02Å; N626-R629 PolarHBondContact OD1-NH1 3.14Å; N626-L630 PolarHBondContact O-N 3.29Å; N626-L630 VanDerWaalsContact O-N 3.07Å
627	I	95.8	Very high	95.1	Very high	10 Å²	10	62.8 Å²	62.8	5%	0.051	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-45.1	176	-65.3	167.3	0	0	0	110.6	C593 M596 V601 V602 C623 I624 L630 A631	C593-I627 HydrophobicContact CB-CG1 4.29Å; M596-I627 HydrophobicContact CB-CD1 4.44Å; V601-I627 HydrophobicContact CG1-CD1 3.47Å; V601-I627 VanDerWaalsContact CG1-CD1 3.47Å; V602-I627 HydrophobicContact CG2-CD1 4.42Å; V602-I627 HydrophobicContact CG2-CG2 4.39Å; C623-I627 WeakPolarHBondContact O-CG1 3.45Å; C623-I627 PolarHBondContact O-N 3.33Å; C623-I627 VanDerWaalsContact O-N 3.15Å; I624-I627 PolarHBondContact O-N 3.3Å; I627-L630 PolarHBondContact O-N 3.26Å; I627-A631 PolarHBondContact O-N 2.97Å
628	R	95.9	Very high	94.6	Very high	168 Å²	168	65.1 Å²	65.1	63%	0.634	34%	0.343	S	S	*	.	H	α-helix	trans	-63.9	-41.9	178	179.5	176.6	167.9	163.8	-1.6	112	I624 S625 N626 L630 A631 L632	I624-R628 WeakPolarHBondContact O-CB 3.35Å; I624-R628 PolarHBondContact O-N 3.14Å; S625-R628 PolarHBondContact O-N 3.09Å; N626-R628 VanDerWaalsContact C-N 3.33Å; N626-R628 PolarHBondContact O-N 3.29Å; R628-L630 VanDerWaalsContact C-N 3.32Å; R628-L630 PolarHBondContact O-N 3.39Å; R628-A631 PolarHBondContact O-N 3.48Å; R628-L632 HydrophobicContact CG-CD1 3.9Å; R628-L632 HydrophobicContact CG-CG 4.25Å; R628-L632 WeakPolarHBondContact O-CB 3.34Å; R628-L632 WeakPolarHBondContact O-CG 3.33Å; R628-L632 PolarHBondContact O-N 3.46Å
629	R	95.9	Very high	94.1	Very high	149 Å²	149	64.2 Å²	64.2	56%	0.562	33%	0.334	S	S	*	.	H	α-helix	trans	-60.4	-42.3	176.6	-76	-176.6	-137	131.8	8	111.4	S625 N626 A633	S625-R629 WeakPolarHBondContact O-CG 3.34Å; S625-R629 PolarHBondContact O-N 2.91Å; S625-R629 PolarHBondContact OG-NH2 2.9Å; N626-R629 PolarHBondContact O-N 3.02Å; N626-R629 PolarHBondContact OD1-NH1 3.14Å; R629-A633 WeakPolarHBondContact O-CB 3.47Å; R629-A633 PolarHBondContact O-N 3.28Å
630	L	94.5	Very high	93.6	Very high	39 Å²	39	67.3 Å²	67.3	20%	0.204	35%	0.352	C	S	.	.	H	α-helix	trans	-62.8	-46	175.1	-179.1	63.5	0	0	0	111.8	P590 C593 V594 N626 I627 R628 A633 N634	P590-L630 HydrophobicContact CB-CD1 4Å; P590-L630 HydrophobicContact CB-CD2 4.25Å; P590-L630 WeakPolarHBondContact O-CD2 3.35Å; C593-L630 HydrophobicContact CB-CD2 3.47Å; C593-L630 VanDerWaalsContact CB-CD2 3.47Å; V594-L630 HydrophobicContact CG2-CD2 4.08Å; N626-L630 PolarHBondContact O-N 3.29Å; N626-L630 VanDerWaalsContact O-N 3.07Å; I627-L630 PolarHBondContact O-N 3.26Å; R628-L630 VanDerWaalsContact C-N 3.32Å; R628-L630 PolarHBondContact O-N 3.39Å; L630-A633 PolarHBondContact O-N 3.01Å; L630-N634 PolarHBondContact O-N 3.35Å
631	A	93.5	Very high	93.1	Very high	53 Å²	53	73.2 Å²	73.2	44%	0.438	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-47.2	178.4	0	0	0	0	0	112.2	I627 R628 A633 N634 E635	I627-A631 PolarHBondContact O-N 2.97Å; R628-A631 PolarHBondContact O-N 3.48Å; A631-A633 PolarHBondContact O-N 3.28Å; A631-N634 PolarHBondContact O-N 2.92Å; A631-E635 PolarHBondContact O-N 3.03Å
632	L	94.5	Very high	92.4	Very high	85 Å²	85	74.8 Å²	74.8	45%	0.445	38%	0.38	S	S	.	.	H	α-helix	trans	-65.2	-37.5	178.1	-70.8	173.9	0	0	0	112.6	R628 E635 K636	R628-L632 HydrophobicContact CG-CD1 3.9Å; R628-L632 HydrophobicContact CG-CG 4.25Å; R628-L632 WeakPolarHBondContact O-CB 3.34Å; R628-L632 WeakPolarHBondContact O-CG 3.33Å; R628-L632 PolarHBondContact O-N 3.46Å; L632-E635 PolarHBondContact O-N 3.33Å; L632-K636 WeakPolarHBondContact O-CB 3.37Å; L632-K636 PolarHBondContact O-N 2.92Å
633	A	93.5	Very high	91.7	Very high	51 Å²	51	79.9 Å²	79.9	42%	0.421	40%	0.4	S	S	.	.	H	α-helix	trans	-62.7	-44.3	174.8	0	0	0	0	0	111.2	R629 L630 A631 K636 V637	R629-A633 WeakPolarHBondContact O-CB 3.47Å; R629-A633 PolarHBondContact O-N 3.28Å; L630-A633 PolarHBondContact O-N 3.01Å; A631-A633 PolarHBondContact O-N 3.28Å; A633-K636 PolarHBondContact O-N 3.34Å; A633-V637 WeakPolarHBondContact O-CG2 3.49Å; A633-V637 PolarHBondContact O-N 2.99Å
634	N	91.2	Very high	91	Very high	97 Å²	97	85.7 Å²	85.7	52%	0.519	43%	0.427	S	S	.	.	H	α-helix	trans	-64.2	-41.7	175.9	-76.8	-24.1	0	0	0	112.4	L630 A631 V637 H638	L630-N634 PolarHBondContact O-N 3.35Å; A631-N634 PolarHBondContact O-N 2.92Å; N634-V637 PolarHBondContact O-N 3.4Å; N634-H638 WeakPolarHBondContact O-CB 3.36Å; N634-H638 PolarHBondContact O-N 2.95Å
635	E	91.1	Very high	90.2	Very high	110 Å²	110	91 Å²	91	51%	0.514	45%	0.449	S	S	.	.	H	α-helix	trans	-61.3	-45.4	175.9	-172.2	-179.8	-179	0	0	111.5	A631 L632 V637 H638 L639	A631-E635 PolarHBondContact O-N 3.03Å; L632-E635 PolarHBondContact O-N 3.33Å; E635-V637 VanDerWaalsContact C-N 3.34Å; E635-V637 PolarHBondContact O-N 2.86Å; E635-H638 PolarHBondContact O-N 3.42Å; E635-H638 VanDerWaalsContact O-N 3.15Å; E635-L639 HydrophobicContact CG-CD1 4.19Å; E635-L639 WeakPolarHBondContact O-CB 3.42Å; E635-L639 WeakPolarHBondContact O-CG 3.48Å; E635-L639 PolarHBondContact O-N 3.41Å
636	K	91.1	Very high	89.4	Confident	152 Å²	152	94 Å²	94	66%	0.661	46%	0.46	S	S	*	.	H	α-helix	trans	-60.2	-42.5	176.6	-172.5	178.2	-179.7	-178.8	0	112.1	L632 A633 T640	L632-K636 WeakPolarHBondContact O-CB 3.37Å; L632-K636 PolarHBondContact O-N 2.92Å; A633-K636 PolarHBondContact O-N 3.34Å; K636-T640 WeakPolarHBondContact O-CB 3.49Å; K636-T640 PolarHBondContact O-N 3.07Å; K636-T640 PolarHBondContact O-OG1 2.73Å
637	V	89.8	Confident	88.4	Confident	75 Å²	75	100.6 Å²	100.6	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-42	175.4	172.2	0	0	0	0	110.8	A633 N634 E635 T640 K641	A633-V637 WeakPolarHBondContact O-CG2 3.49Å; A633-V637 PolarHBondContact O-N 2.99Å; N634-V637 PolarHBondContact O-N 3.4Å; E635-V637 VanDerWaalsContact C-N 3.34Å; E635-V637 PolarHBondContact O-N 2.86Å; V637-T640 PolarHBondContact O-N 3.02Å; V637-K641 HydrophobicContact CG1-CD 4.34Å; V637-K641 WeakPolarHBondContact O-CG 3.44Å; V637-K641 PolarHBondContact O-N 3.15Å
638	H	86.3	Confident	87.2	Confident	121 Å²	121	106 Å²	106	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-64.6	-44.3	178.5	-171.4	34.1	0	0	0	112.2	N634 E635 T640 K641 L642	N634-H638 WeakPolarHBondContact O-CB 3.36Å; N634-H638 PolarHBondContact O-N 2.95Å; E635-H638 PolarHBondContact O-N 3.42Å; E635-H638 VanDerWaalsContact O-N 3.15Å; H638-T640 VanDerWaalsContact C-N 3.32Å; H638-T640 PolarHBondContact O-N 3.32Å; H638-K641 PolarHBondContact O-N 3.44Å; H638-L642 WeakPolarHBondContact O-CB 3.48Å; H638-L642 PolarHBondContact O-N 3.02Å
639	L	86.5	Confident	85.9	Confident	80 Å²	80	102.6 Å²	102.6	42%	0.419	51%	0.506	S	S	.	.	H	α-helix	trans	-60.3	-41.9	174.6	-73	169.8	0	0	0	111.5	E635 L642 H643	E635-L639 HydrophobicContact CG-CD1 4.19Å; E635-L639 WeakPolarHBondContact O-CB 3.42Å; E635-L639 WeakPolarHBondContact O-CG 3.48Å; E635-L639 PolarHBondContact O-N 3.41Å; L639-L642 PolarHBondContact O-N 3.34Å; L639-H643 PolarHBondContact O-N 2.92Å; L639-H643 PolarHBondContact O-ND1 3.22Å
640	T	87.6	Confident	84.1	Confident	69 Å²	69	97.5 Å²	97.5	42%	0.423	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-47.2	177.8	-53.1	0	0	0	0	111.1	K636 V637 H638 L642 H643 E644	K636-T640 WeakPolarHBondContact O-CB 3.49Å; K636-T640 PolarHBondContact O-N 3.07Å; K636-T640 PolarHBondContact O-OG1 2.73Å; V637-T640 PolarHBondContact O-N 3.02Å; H638-T640 VanDerWaalsContact C-N 3.32Å; H638-T640 PolarHBondContact O-N 3.32Å; T640-L642 VanDerWaalsContact C-N 3.29Å; T640-L642 PolarHBondContact O-N 3.25Å; T640-H643 PolarHBondContact O-N 3.45Å; T640-E644 WeakPolarHBondContact O-CG 3.47Å; T640-E644 PolarHBondContact O-N 2.96Å
641	K	85.8	Confident	82.4	Confident	123 Å²	123	100.4 Å²	100.4	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-35.6	175.2	-71.6	178.9	179.3	-179.2	0	112.7	V637 H638 K645	V637-K641 HydrophobicContact CG1-CD 4.34Å; V637-K641 WeakPolarHBondContact O-CG 3.44Å; V637-K641 PolarHBondContact O-N 3.15Å; H638-K641 PolarHBondContact O-N 3.44Å; K641-K645 WeakPolarHBondContact O-CG 3.39Å; K641-K645 PolarHBondContact O-N 2.75Å
642	L	83.1	Confident	80.5	Confident	81 Å²	81	103.4 Å²	103.4	42%	0.424	52%	0.517	S	S	.	.	H	α-helix	trans	-68.1	-43.8	176.6	-171.7	67.7	0	0	0	111.3	H638 L639 T640 E644 K645 I646	H638-L642 WeakPolarHBondContact O-CB 3.48Å; H638-L642 PolarHBondContact O-N 3.02Å; L639-L642 PolarHBondContact O-N 3.34Å; T640-L642 VanDerWaalsContact C-N 3.29Å; T640-L642 PolarHBondContact O-N 3.25Å; L642-E644 VanDerWaalsContact C-N 3.32Å; L642-E644 PolarHBondContact O-N 3.06Å; L642-K645 PolarHBondContact O-N 2.96Å; L642-I646 HydrophobicContact CG-CD1 4.11Å; L642-I646 VanDerWaalsContact O-CG1 3.32Å; L642-I646 WeakPolarHBondContact O-CG1 3.44Å; L642-I646 PolarHBondContact O-N 2.91Å
643	H	81.7	Confident	78.3	Confident	120 Å²	120	105.2 Å²	105.2	56%	0.556	53%	0.527	S	S	*	.	H	α-helix	trans	-61.4	-39.4	175.5	-76.9	89.5	0	0	0	112.1	L639 T640 I646 K647	L639-H643 PolarHBondContact O-N 2.92Å; L639-H643 PolarHBondContact O-ND1 3.22Å; T640-H643 PolarHBondContact O-N 3.45Å; H643-I646 PolarHBondContact O-N 2.94Å; H643-K647 WeakPolarHBondContact O-CG 3.32Å; H643-K647 PolarHBondContact O-N 3.33Å
644	E	83.4	Confident	76.4	Confident	122 Å²	122	105.8 Å²	105.8	57%	0.57	53%	0.528	S	S	*	.	H	α-helix	trans	-64.1	-43.7	174.3	-72.5	173.2	174.9	0	0	112.2	T640 L642 I646 K647 F648	T640-E644 WeakPolarHBondContact O-CG 3.47Å; T640-E644 PolarHBondContact O-N 2.96Å; L642-E644 VanDerWaalsContact C-N 3.32Å; L642-E644 PolarHBondContact O-N 3.06Å; E644-I646 PolarHBondContact O-N 3.25Å; E644-K647 PolarHBondContact O-N 3.34Å; E644-F648 WeakPolarHBondContact O-CB 3.49Å; E644-F648 PolarHBondContact O-N 2.93Å
645	K	79.4	Confident	74.4	Confident	145 Å²	145	105.6 Å²	105.6	63%	0.63	53%	0.531	S	S	*	.	H	α-helix	trans	-61.8	-41.7	174.6	-78.8	-177.6	177.8	-176.9	0	112.4	K641 L642 F648 N649	K641-K645 WeakPolarHBondContact O-CG 3.39Å; K641-K645 PolarHBondContact O-N 2.75Å; L642-K645 PolarHBondContact O-N 2.96Å; K645-F648 PolarHBondContact O-N 3.18Å; K645-N649 WeakPolarHBondContact O-CB 3.47Å; K645-N649 PolarHBondContact O-N 3.43Å
646	I	79.4	Confident	72.5	Confident	106 Å²	106	105.8 Å²	105.8	54%	0.544	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-44.1	177.2	-67.8	166.9	0	0	0	110.5	L642 H643 E644 F648 N649 G650	L642-I646 HydrophobicContact CG-CD1 4.11Å; L642-I646 VanDerWaalsContact O-CG1 3.32Å; L642-I646 WeakPolarHBondContact O-CG1 3.44Å; L642-I646 PolarHBondContact O-N 2.91Å; H643-I646 PolarHBondContact O-N 2.94Å; E644-I646 PolarHBondContact O-N 3.25Å; I646-F648 VanDerWaalsContact C-N 3.33Å; I646-F648 PolarHBondContact O-N 3.39Å; I646-N649 PolarHBondContact O-N 3.45Å; I646-G650 PolarHBondContact O-N 3.33Å
647	K	76.6	Confident	70.4	Confident	157 Å²	157	107.5 Å²	107.5	68%	0.683	55%	0.547	S	S	*	.	H	α-helix	trans	-59.4	-43.6	173.8	-78.4	-177.1	177.6	-178.9	0	111.6	H643 E644 G650 I651	H643-K647 WeakPolarHBondContact O-CG 3.32Å; H643-K647 PolarHBondContact O-N 3.33Å; E644-K647 PolarHBondContact O-N 3.34Å; K647-G650 PolarHBondContact O-N 3.49Å; K647-I651 WeakPolarHBondContact O-CD1 3.44Å; K647-I651 WeakPolarHBondContact O-CG1 3.21Å; K647-I651 PolarHBondContact O-N 2.93Å
648	F	71.2	Confident	68.3	Low	124 Å²	124	112.6 Å²	112.6	54%	0.544	56%	0.563	S	S	.	*	H	α-helix	trans	-67.3	-40.3	-179.6	-162.7	-102.4	0	0	0	113	E644 K645 I646 I651 K652	E644-F648 WeakPolarHBondContact O-CB 3.49Å; E644-F648 PolarHBondContact O-N 2.93Å; K645-F648 PolarHBondContact O-N 3.18Å; I646-F648 VanDerWaalsContact C-N 3.33Å; I646-F648 PolarHBondContact O-N 3.39Å; F648-I651 PolarHBondContact O-N 3.05Å; F648-K652 HydrophobicContact CD1-CD 4.45Å; F648-K652 HydrophobicContact CE1-CD 4.27Å; F648-K652 PolarHBondContact O-N 3.44Å
649	N	67.5	Low	66.1	Low	96 Å²	96	111.6 Å²	111.6	51%	0.513	57%	0.569	S	S	.	*	H	α-helix	trans	-70.4	-37.8	175.6	-74.2	-9.9	0	0	0	112.2	K645 I646 I651 K652 D653	K645-N649 WeakPolarHBondContact O-CB 3.47Å; K645-N649 PolarHBondContact O-N 3.43Å; I646-N649 PolarHBondContact O-N 3.45Å; N649-I651 VanDerWaalsContact C-N 3.27Å; N649-I651 PolarHBondContact O-N 3.43Å; N649-K652 PolarHBondContact O-N 3.06Å; N649-D653 PolarHBondContact O-N 3.37Å
650	G	59.2	Low	63.8	Low	42 Å²	42	112.9 Å²	112.9	43%	0.433	59%	0.585	S	S	.	*	H	α-helix	trans	-62.6	-32.7	173	0	0	0	0	0	113.2	I646 K647 S654	I646-G650 PolarHBondContact O-N 3.33Å; K647-G650 PolarHBondContact O-N 3.49Å; G650-S654 WeakPolarHBondContact O-CB 3.48Å; G650-S654 PolarHBondContact O-N 2.89Å
651	I	57.9	Low	61.6	Low	100 Å²	100	119.1 Å²	119.1	51%	0.513	61%	0.606	S	S	.	*	H	α-helix	trans	-71.5	-37.7	174.6	-66.8	162	0	0	0	111.2	K647 F648 N649 S654 T655	K647-I651 WeakPolarHBondContact O-CD1 3.44Å; K647-I651 WeakPolarHBondContact O-CG1 3.21Å; K647-I651 PolarHBondContact O-N 2.93Å; F648-I651 PolarHBondContact O-N 3.05Å; N649-I651 VanDerWaalsContact C-N 3.27Å; N649-I651 PolarHBondContact O-N 3.43Å; I651-S654 PolarHBondContact O-N 3.08Å; I651-S654 PolarHBondContact O-OG 2.79Å; I651-T655 PolarHBondContact O-N 2.77Å; I651-T655 VanDerWaalsContact O-N 3.08Å; I651-T655 PolarHBondContact O-OG1 3.32Å
652	K	52.9	Low	59.5	Low	115 Å²	115	120.9 Å²	120.9	50%	0.5	62%	0.621	S	S	.	*	H	α-helix	trans	-66	-40.9	175.7	-77.1	-176.6	172.8	-179.8	0	113	F648 N649 S654 T655 V656	F648-K652 HydrophobicContact CD1-CD 4.45Å; F648-K652 HydrophobicContact CE1-CD 4.27Å; F648-K652 PolarHBondContact O-N 3.44Å; N649-K652 PolarHBondContact O-N 3.06Å; K652-S654 VanDerWaalsContact C-N 3.26Å; K652-S654 PolarHBondContact O-N 3.24Å; K652-T655 WeakPolarHBondContact CA-OG1 3.49Å; K652-T655 PolarHBondContact O-N 3.21Å; K652-T655 PolarHBondContact O-OG1 3.23Å; K652-V656 WeakPolarHBondContact O-CG2 3.45Å; K652-V656 PolarHBondContact O-N 3.19Å
653	D	49.4	Very low	57.2	Low	123 Å²	123	126.3 Å²	126.3	66%	0.658	64%	0.642	S	S	*	*	H	α-helix	trans	-68.4	-27.7	175.8	-81.5	-20.9	0	0	0	112.7	N649	N649-D653 PolarHBondContact O-N 3.37Å
654	S	52.3	Low	55.1	Low	63 Å²	63	127 Å²	127	44%	0.441	65%	0.654	S	S	.	*	H	α-helix	trans	-78.7	-26	175.8	77.9	0	0	0	0	113.9	G650 I651 K652	G650-S654 WeakPolarHBondContact O-CB 3.48Å; G650-S654 PolarHBondContact O-N 2.89Å; I651-S654 PolarHBondContact O-N 3.08Å; I651-S654 PolarHBondContact O-OG 2.79Å; K652-S654 VanDerWaalsContact C-N 3.26Å; K652-S654 PolarHBondContact O-N 3.24Å
655	T	50.7	Low	53.1	Low	93 Å²	93	126.8 Å²	126.8	57%	0.571	67%	0.667	S	S	*	*	H	α-helix	trans	-82.8	-27.1	176.7	25.1	0	0	0	0	113.1	I651 K652	I651-T655 PolarHBondContact O-N 2.77Å; I651-T655 VanDerWaalsContact O-N 3.08Å; I651-T655 PolarHBondContact O-OG1 3.32Å; K652-T655 WeakPolarHBondContact CA-OG1 3.49Å; K652-T655 PolarHBondContact O-N 3.21Å; K652-T655 PolarHBondContact O-OG1 3.23Å
656	V	50.3	Low	51.2	Low	114 Å²	114	125.6 Å²	125.6	69%	0.691	67%	0.674	S	S	*	*	H	α-helix	trans	-76.5	-22.4	175.6	178.3	0	0	0	0	112.8	K652	K652-V656 WeakPolarHBondContact O-CG2 3.45Å; K652-V656 PolarHBondContact O-N 3.19Å
657	K	46.6	Very low	49.2	Very low	189 Å²	189	126.1 Å²	126.1	82%	0.822	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-4.1	178.7	-79.6	-176.2	177.7	175.6	0	115.8
658	K	45.5	Very low	47.4	Very low	182 Å²	182	126.4 Å²	126.4	79%	0.791	69%	0.69	S	S	*	*			trans	-113	6.6	-175.5	-82.6	-176.9	174.8	178.8	0	115.8	S660	K658-S660 VanDerWaalsContact C-N 3.25Å; K658-S660 PolarHBondContact O-N 3.3Å
659	S	40.2	Very low	46	Very low	99 Å²	99	127 Å²	127	69%	0.692	69%	0.694	S	S	*	*			trans	-82.4	63.5	171.5	59.9	0	0	0	0	112
660	S	39.7	Very low	44.6	Very low	108 Å²	108	129.7 Å²	129.7	76%	0.755	70%	0.704	S	S	*	*	S	Bend	trans	-159.9	117.1	165	-81.9	0	0	0	0	109.3	K658	K658-S660 VanDerWaalsContact C-N 3.25Å; K658-S660 PolarHBondContact O-N 3.3Å
661	K	41.7	Very low	43.7	Very low	200 Å²	200	134.5 Å²	134.5	87%	0.87	71%	0.714	S	S	*	*	S	Bend	trans	92.2	103	173.3	-59.9	-179.2	176.2	177.1	0	117.9
662	N	39.8	Very low	42.9	Very low	159 Å²	159	137 Å²	137	85%	0.85	72%	0.724	S	S	*	*			trans	80.1	109.8	134.8	-71	0.5	0	0	0	121.6
663	K	35	Very low	42.2	Very low	195 Å²	195	138.1 Å²	138.1	85%	0.848	73%	0.731	S	S	*	*			trans	-57.6	135.3	153.9	-67	171.5	171.6	177.5	0	110.9
664	T	38.4	Very low	41.7	Very low	134 Å²	134	141.6 Å²	141.6	82%	0.822	74%	0.736	S	S	*	*				174.6	112.8	117.5	28.4	0	0	0	0	111.6
665	S	40.5	Very low	41	Very low	119 Å²	119	145.4 Å²	145.4	83%	0.832	75%	0.746	S	S	*	*			trans	28	156.1	142.5	-52.8	0	0	0	0	125.4
666	P	40.1	Very low	40.3	Very low	120 Å²	120	148.2 Å²	148.2	78%	0.779	75%	0.753	S	S	*	*			trans	-120.6	169.7	-150.2	41.2	-25.5	0	0	0	115.4
667	S	37.7	Very low	39.7	Very low	117 Å²	117	151.5 Å²	151.5	82%	0.818	76%	0.761	S	S	*	*			trans	160.5	153.9	156.3	57.8	0	0	0	0	107.7
668	H	39.3	Very low	39.2	Very low	163 Å²	163	151 Å²	151	76%	0.755	76%	0.762	S	S	*	*			cis	-170.1	163.9	-15.1	-131	-0.7	0	0	0	106.2
669	H	40.2	Very low	38.8	Very low	135 Å²	135	148.5 Å²	148.5	63%	0.625	76%	0.757	S	S	*	*			trans	85.3	115	152.7	-73.1	28.8	0	0	0	119
670	H	40.1	Very low	38.6	Very low	154 Å²	154	152.2 Å²	152.2	71%	0.713	76%	0.763	S	S	*	*				97	148.9	96.2	-95.2	52.8	0	0	0	110.1
671	H	38.8	Very low	38.3	Very low	142 Å²	142	155.8 Å²	155.8	66%	0.657	77%	0.768	S	S	*	*			cis	-174.8	173	-17.4	-149.8	20.9	0	0	0	105.8
672	H	40.7	Very low	38.2	Very low	153 Å²	153	150.6 Å²	150.6	71%	0.708	76%	0.755	S	S	*	*			trans	76.2	150.4	167.5	-69.5	-77	0	0	0	120.1
673	H	38.4	Very low	38.1	Very low	139 Å²	139	149.4 Å²	149.4	64%	0.644	75%	0.748	S	S	*	*			cis	179.5	172.2	-32.2	-132.5	-63.4	0	0	0	106.3
674	Y	38.9	Very low	38.1	Very low	196 Å²	196	148 Å²	148	77%	0.769	74%	0.744	S	S	*	*			trans	108.5	102.9	166.8	-65.5	-72.9	0	0	0	114.1
675	E	37.6	Very low	37.9	Very low	142 Å²	142	147 Å²	147	66%	0.664	73%	0.734	S	S	*	*				67.6	136.1	77.2	-79.5	178.6	-178.9	0	0	111.8
676	E	36.4	Very low	37.7	Very low	153 Å²	153	149.1 Å²	149.1	72%	0.715	73%	0.73	S	S	*	*			cis	-174.3	154.4	16.3	-136	177.6	-160.9	0	0	108.6
677	Q	38.2	Very low	37.6	Very low	182 Å²	182	149 Å²	149	85%	0.85	73%	0.732	S	S	*	*			trans	148.6	121.8	131.8	-84.2	-177.4	-2.5	0	0	115.8
678	E	35.5	Very low	37.1	Very low	179 Å²	179	154.6 Å²	154.6	84%	0.836	74%	0.736	S	S	*	*			trans	-77.6	157	178.2	-62.1	167.5	128	0	0	113.5
679	N	37.6	Very low	36.9	Very low	130 Å²	130	156.4 Å²	156.4	70%	0.695	74%	0.744	S	S	*	*				-174.2	123	113.5	-101.1	-29.9	0	0	0	114.3
680	Q	35.6	Very low	36.3	Very low	177 Å²	177	158.5 Å²	158.5	83%	0.827	75%	0.754	S	S	*	*			trans	77.9	103.3	132	-70	170.7	-3.5	0	0	122.5
681	E	33.1	Very low	36	Very low	182 Å²	182	158 Å²	158	85%	0.85	76%	0.762	S	S	*	*			trans	-61.5	-164.7	152.5	-117.9	-179.7	-163.2	0	0	113.9
682	P	40.5	Very low	35.6	Very low	92 Å²	92	158.4 Å²	158.4	60%	0.597	77%	0.769	S	S	*	*			cis	-143.5	-174.9	-11.1	25.9	-0	0	0	0	115.6
683	L	36.9	Very low	35.3	Very low	133 Å²	133	159 Å²	159	70%	0.696	78%	0.777	S	S	*	*			trans	150	104.9	132.3	-77.1	161.2	0	0	0	111.2
684	E	36.1	Very low	34.8	Very low	165 Å²	165	159.1 Å²	159.1	77%	0.771	78%	0.782	S	S	*	*				80	139.6	91.2	-83.7	-172	-177	0	0	114
685	N	33.6	Very low	34.5	Very low	114 Å²	114	157.4 Å²	157.4	61%	0.61	79%	0.786	S	S	*	*			cis	-173.6	163	-10	-135.4	-16.5	0	0	0	108.9
686	H	37.2	Very low	34.1	Very low	164 Å²	164	159.3 Å²	159.3	76%	0.759	79%	0.793	S	S	*	*			trans	73.3	135	162.5	-57.3	-49.8	0	0	0	118.8
687	S	36.5	Very low	33.7	Very low	117 Å²	117	157 Å²	157	82%	0.818	79%	0.793	S	S	*	*			cis	-157.6	144.8	20.1	31.8	0	0	0	0	111.2
688	R	28.3	Very low	33.4	Very low	235 Å²	235	155.4 Å²	155.4	89%	0.887	79%	0.789	S	S	*	*			trans	-78	142.6	172.2	-74.7	171.5	166.4	152.5	-4.8	110.5
689	E	34.9	Very low	33	Very low	201 Å²	201	154.1 Å²	154.1	94%	0.939	79%	0.786	S	S	*	*			trans	-133.6	121.4	145.1	-103	-179.2	172.4	0	0	108.9
690	E	27.7	Very low	32.8	Very low	178 Å²	178	153 Å²	153	83%	0.832	79%	0.789	S	S	*	*			trans	-80.3	133.6	171.6	-69.6	169.1	145.2	0	0	109.1
691	T	34.7	Very low	32.5	Very low	143 Å²	143	151.5 Å²	151.5	88%	0.877	79%	0.786	S	S	*	*			trans	-144.6	105.2	143.4	49.6	0	0	0	0	109.1
692	D	29	Very low	32.5	Very low	152 Å²	152	149.8 Å²	149.8	81%	0.813	78%	0.783	S	S	*	*			trans	-45.5	137.1	153.2	-90.6	-41.6	0	0	0	110.8
693	L	34.7	Very low	32	Very low	166 Å²	166	154 Å²	154	87%	0.869	79%	0.794	S	S	*	*			trans	-159.1	92.6	144.1	-99.8	162	0	0	0	107.9	D695	L693-D695 PolarHBondContact O-N 3.38Å
694	N	27.8	Very low	31.7	Very low	141 Å²	141	155.7 Å²	155.7	75%	0.754	80%	0.802	S	S	*	*			trans	-58.1	122.4	157.1	-99.4	-36.8	0	0	0	108.6
695	D	33.6	Very low	31.6	Very low	159 Å²	159	152.6 Å²	152.6	85%	0.85	80%	0.799	S	S	*	*			trans	-139.7	110	146.5	-108.9	-23.9	0	0	0	111	L693	L693-D695 PolarHBondContact O-N 3.38Å
696	K	28.9	Very low	31.4	Very low	183 Å²	183	154.6 Å²	154.6	80%	0.796	81%	0.81	S	S	*	*			trans	-73.2	132.1	161.3	-71	173.5	175.9	174.3	0	106.7
697	S	27.9	Very low	31	Very low	105 Å²	105	155.2 Å²	155.2	73%	0.734	81%	0.812	S	S	*	*				161.1	156	113.5	59.1	0	0	0	0	112.8
698	I	32	Very low	30.8	Very low	147 Å²	147	157 Å²	157	75%	0.754	81%	0.813	S	S	*	*			trans	95.8	83.9	159.6	-49.1	166.7	0	0	0	115.1
699	I	27.3	Very low	30.9	Very low	152 Å²	152	153.8 Å²	153.8	78%	0.779	81%	0.814	S	S	*	*			trans	-48.6	127.2	143.7	-63.6	159.7	0	0	0	109.4
700	S	33.6	Very low	31	Very low	107 Å²	107	150 Å²	150	75%	0.748	80%	0.804	S	S	*	*			trans	-144.2	105.2	146.5	56.5	0	0	0	0	107.8
701	D	28.2	Very low	31.3	Very low	146 Å²	146	145.7 Å²	145.7	78%	0.781	80%	0.799	S	S	*	*			trans	-58.9	129.9	162.3	-74.1	-48.2	0	0	0	108.8
702	D	33.2	Very low	31.3	Very low	145 Å²	145	145.7 Å²	145.7	78%	0.775	80%	0.798	S	S	*	*			trans	-156.2	112.4	147	-97.9	-31.5	0	0	0	110.7
703	H	29.7	Very low	31.5	Very low	181 Å²	181	148.8 Å²	148.8	84%	0.838	80%	0.799	S	S	*	*			trans	28.4	99.6	148.7	-70.8	-57	0	0	0	119.2
704	I	30.6	Very low	31.5	Very low	168 Å²	168	145.5 Å²	145.5	86%	0.862	79%	0.786	S	S	*	*			trans	-122	117.6	147.3	-63.4	-179.9	0	0	0	109.2
705	S	33.3	Very low	31.8	Very low	101 Å²	101	145 Å²	145	71%	0.706	79%	0.788	S	S	*	*			trans	-52.9	139.2	177.5	49.9	0	0	0	0	113.7	H707	S705-H707 PolarHBondContact O-N 3.02Å; S705-H707 VanDerWaalsContact O-N 3.14Å
706	N	29.6	Very low	31.8	Very low	156 Å²	156	145.6 Å²	145.6	83%	0.834	79%	0.79	S	S	*	*	S	Bend	trans	-41.9	110.7	156.3	-67.1	-35.3	0	0	0	111.4
707	H	29.9	Very low	32	Very low	176 Å²	176	141.6 Å²	141.6	82%	0.815	79%	0.785	S	S	*	*			trans	175.5	98.1	149	-93.7	-56.6	0	0	0	108	S705	S705-H707 PolarHBondContact O-N 3.02Å; S705-H707 VanDerWaalsContact O-N 3.14Å
708	D	31.1	Very low	32.2	Very low	156 Å²	156	142.8 Å²	142.8	83%	0.834	78%	0.783	S	S	*	*			trans	160.3	70.2	144.7	-86.5	-16	0	0	0	110.6
709	D	31.4	Very low	32.2	Very low	167 Å²	167	143.8 Å²	143.8	89%	0.893	79%	0.79	S	S	*	*	S	Bend	trans	-116.9	22.6	176.7	-116.7	-11.7	0	0	0	112.2
710	T	36.1	Very low	32.3	Very low	121 Å²	121	144.6 Å²	144.6	74%	0.742	80%	0.795	S	S	*	*	S	Bend	trans	-127.7	0.3	-169.2	-9.5	0	0	0	0	115.9
711	A	33.7	Very low	32.3	Very low	87 Å²	87	148 Å²	148	72%	0.719	80%	0.8	S	S	*	*	S	Bend	trans	-99.1	-6.8	-175.1	0	0	0	0	0	115.4
712	V	35.5	Very low	32.4	Very low	143 Å²	143	147 Å²	147	87%	0.867	80%	0.798	S	S	*	*	S	Bend	trans	-98.3	2.1	-174.5	-175.2	0	0	0	0	112.8
713	R	33.5	Very low	32.4	Very low	217 Å²	217	149.4 Å²	149.4	82%	0.819	81%	0.805	S	S	*	*	S	Bend	trans	-109.7	3	-174.2	-81	-176.5	172.8	172.1	-0.8	116.3
714	T	33.7	Very low	32.5	Very low	98 Å²	98	146.3 Å²	146.3	60%	0.601	80%	0.804	S	S	*	*	S	Bend	trans	-118.3	23.1	-163.4	-7	0	0	0	0	116.1
715	T	34.9	Very low	32.7	Very low	131 Å²	131	142 Å²	142	80%	0.804	80%	0.801	S	S	*	*	S	Bend	trans	-128.3	9.6	-178.5	45.5	0	0	0	0	115.7
716	L	33.8	Very low	32.6	Very low	171 Å²	171	146.3 Å²	146.3	90%	0.895	81%	0.81	S	S	*	*	S	Bend	trans	-126.8	11.5	-178.3	-80.3	162.2	0	0	0	115.1
717	S	33.7	Very low	33	Very low	98 Å²	98	146 Å²	146	69%	0.685	81%	0.813	S	S	*	*	S	Bend	trans	-126.7	-12.6	-173.5	-41.5	0	0	0	0	116.2
718	D	31.4	Very low	33.2	Very low	131 Å²	131	144.2 Å²	144.2	70%	0.701	81%	0.81	S	S	*	*			trans	-116.2	91.9	-173	-65.4	-18.9	0	0	0	110.3
719	N	32.6	Very low	33.3	Very low	167 Å²	167	143.2 Å²	143.2	89%	0.893	80%	0.804	S	S	*	*	S	Bend	trans	-172.5	30.4	157.3	-93.3	-25.8	0	0	0	113.7
720	L	29.2	Very low	33.4	Very low	169 Å²	169	139.8 Å²	139.8	89%	0.885	79%	0.793	S	S	*	*			trans	-137.8	74.3	176.7	-89.8	154.9	0	0	0	109.2
721	E	33.1	Very low	33.3	Very low	180 Å²	180	142.3 Å²	142.3	84%	0.841	80%	0.801	S	S	*	*			trans	-160.5	96.8	160.7	-110.5	164.3	-151.1	0	0	111
722	T	30.3	Very low	33.2	Very low	123 Å²	123	147.2 Å²	147.2	76%	0.755	81%	0.807	S	S	*	*			trans	35.7	110.8	135.8	57.8	0	0	0	0	119.5
723	H	34	Very low	33.2	Very low	196 Å²	196	147.3 Å²	147.3	91%	0.907	81%	0.807	S	S	*	*			trans	-126.2	101.9	142.4	-95.4	-62	0	0	0	110.3
724	S	31.7	Very low	33.3	Very low	117 Å²	117	142.1 Å²	142.1	82%	0.818	80%	0.804	S	S	*	*			trans	-68.9	133.1	157.4	48.5	0	0	0	0	109.9
725	G	34.9	Very low	33.2	Very low	78 Å²	78	143.2 Å²	143.2	80%	0.804	81%	0.813	S	S	*	*			trans	169	94.8	173.4	0	0	0	0	0	112.1
726	E	31.3	Very low	33.4	Very low	191 Å²	191	146.3 Å²	146.3	89%	0.893	82%	0.818	S	S	*	*			trans	-44.3	141.3	176	-59	163.9	142.2	0	0	113.9
727	V	36.9	Very low	33.3	Very low	150 Å²	150	145.5 Å²	145.5	91%	0.909	81%	0.813	S	S	*	*				-156.1	133.1	118.6	177.5	0	0	0	0	109.5
728	N	33.6	Very low	33.6	Very low	138 Å²	138	147.2 Å²	147.2	74%	0.738	82%	0.819	S	S	*	*			trans	-56.9	154.8	-175.1	-88.8	-38.6	0	0	0	119.3
729	N	34.9	Very low	33.8	Very low	135 Å²	135	146.4 Å²	146.4	72%	0.722	82%	0.819	S	S	*	*			trans	92.6	113.1	133	-79.9	-10.4	0	0	0	121.7
730	S	32.2	Very low	33.9	Very low	95 Å²	95	145.5 Å²	145.5	66%	0.664	81%	0.814	S	S	*	*				90	98.3	124.3	-63.4	0	0	0	0	118.1
731	L	34.9	Very low	34.3	Very low	173 Å²	173	142.7 Å²	142.7	91%	0.906	81%	0.809	S	S	*	*				177.3	136.2	90.6	-94.9	146.4	0	0	0	112.4
732	K	31.9	Very low	34.5	Very low	191 Å²	191	141.3 Å²	141.3	83%	0.83	81%	0.807	S	S	*	*			trans	-58.9	155.4	176.5	-72.7	165.8	166.7	174.4	0	112.9
733	V	35.1	Very low	35	Very low	144 Å²	144	142.8 Å²	142.8	87%	0.873	81%	0.809	S	S	*	*				-176.4	142.3	98.1	162	0	0	0	0	110.6
734	S	34.4	Very low	35.5	Very low	108 Å²	108	138.8 Å²	138.8	76%	0.755	80%	0.803	S	S	*	*			trans	-79	169	-160.7	-44.3	0	0	0	0	117.6
735	P	33.1	Very low	35.8	Very low	121 Å²	121	138.5 Å²	138.5	79%	0.786	80%	0.801	S	S	*	*			trans	-97.4	151.3	168.6	36.7	-28.1	0	0	0	112.4
736	Q	39.1	Very low	36.5	Very low	196 Å²	196	140.4 Å²	140.4	92%	0.916	80%	0.799	S	S	*	*			trans	-132.8	129.3	163.2	-88.3	-157.9	-22.9	0	0	112.4
737	I	32.2	Very low	37.1	Very low	155 Å²	155	142.8 Å²	142.8	80%	0.795	82%	0.818	S	S	*	*			trans	-69.2	145.5	160.8	-63.3	158.3	0	0	0	108.4
738	V	38.3	Very low	37.1	Very low	133 Å²	133	142.4 Å²	142.4	81%	0.806	81%	0.813	S	S	*	*			trans	-172.4	146.4	134.7	164.4	0	0	0	0	110.1
739	T	37.3	Very low	37.3	Very low	115 Å²	115	142.6 Å²	142.6	71%	0.706	82%	0.817	S	S	*	*			trans	-68.4	157.9	-166.7	47.9	0	0	0	0	119.2
740	D	32.7	Very low	37.4	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	82%	0.823	S	S	*	*			trans	4	130	147.1	-64.5	-33.7	0	0	0	119.6
741	S	38.5	Very low	37.7	Very low	110 Å²	110	145.9 Å²	145.9	77%	0.769	83%	0.832	S	S	*	*				165.9	124	102	44.5	0	0	0	0	112.9
742	N	38	Very low	37.9	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	83%	0.827	S	S	*	*			trans	47.7	116.5	133.2	-82.8	-7.6	0	0	0	121.2
743	I	41.1	Very low	38.3	Very low	154 Å²	154	141.1 Å²	141.1	79%	0.79	83%	0.827	S	S	*	*				151.1	122.4	114.1	-80.7	146.7	0	0	0	113.3
744	S	42.8	Very low	38.5	Very low	113 Å²	113	140.9 Å²	140.9	79%	0.79	82%	0.824	S	S	*	*			trans	62.2	121.7	148.3	-64.4	0	0	0	0	123.3
745	S	38	Very low	38.8	Very low	111 Å²	111	143.4 Å²	143.4	78%	0.776	83%	0.829	S	S	*	*			trans	-62.2	-173.4	157.7	-30.6	0	0	0	0	113.3
746	P	49.3	Very low	39.3	Very low	118 Å²	118	145.3 Å²	145.3	77%	0.766	83%	0.833	S	S	*	*			cis	-131.4	167.4	-35.3	25.7	-4.9	0	0	0	113.2
747	N	44.6	Very low	39.3	Very low	240 Å²	240	140.6 Å²	140.6	100%	1.283	83%	0.825	S	S	*	*			trans	-146.6	0	140	-119.8	1.9	0	0	0	108.5

Retrieved 747 of 747 residues in 406 ms (Link to these results)

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